smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCN1C(C)=C(C)S/C1=C1/SC(=S)N(N)C1=O 3022231 FVNGKHVKDJDONU-VQHVLOKHSA-N 287.435 2.210 10 10 CECE COc1ccc(N2CCN([C@@](C)(CN)C(C)C)CC2)cc1 58496979 WHJSIBFEMJCSDU-KRWDZBQOSA-N 291.439 2.191 10 10 CECE Nc1ccc(CSc2ncnc3nc[nH]c23)cc1 51035881 VZSMRFPOAOZLEU-UHFFFAOYSA-N 257.322 2.227 10 10 CECE COc1ccc(N2CCC(N[C@@H](C)[C@@H](C)CO)CC2)cc1 305131938 NETHOEQIAHHIMV-KBPBESRZSA-N 292.423 2.271 10 10 CECE CCOC1CCN(Cc2cc([N+](=O)[O-])ccc2O)CC1 170913810 CBFUZBVHZQABOM-UHFFFAOYSA-N 280.324 2.301 10 10 CECE CCCNCc1cc(F)c(N(C)CC(=O)NCC)c(F)c1 62712894 WABAMVUBRZJHDY-UHFFFAOYSA-N 299.365 2.037 10 10 CECE C[C@H](NCCC[S@](C)=O)c1ccc(N(C)C)cc1 126776606 DTBLBTYLSUTZCX-KPZWWZAWSA-N 268.426 2.172 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CC12CCNCC2 70254477 FURPCKNYRKQVIA-GXTWGEPZSA-N 288.391 2.301 10 10 CECE C[C@@H](CO)[C@@H](C)NCc1cccc(Br)c1O 125745675 GBZFXELFJNZQDW-DTWKUNHWSA-N 288.185 2.261 10 10 CECE C[C@H](NCc1cncs1)c1ccc(O)cc1O 127990453 CUKRFQODLLCYSL-QMMMGPOBSA-N 250.323 2.405 10 10 CECE C[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2)C[C@@H]1N(C)C 312150504 JPZMBBACQATVGC-KYXKSCCESA-N 274.364 2.171 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)N(C)CCNC)c1 70303432 HWAXQNMHCXENDE-LBPRGKRZSA-N 293.411 2.343 10 10 CECE CN[C@H]1CCN(c2cc(OC)c(OC)c(OC)c2)[C@@H](C)C1 49694302 IBDXVUAKKVOQGR-RYUDHWBXSA-N 294.395 2.289 10 10 CECE Cc1csc(NC(=O)c2ccc(O)c(O)c2)n1 226955428 AUTBVFFCCKJSNL-UHFFFAOYSA-N 250.279 2.115 10 10 CECE CC(C)OCCOC(=O)CCc1ccc(N)cc1 41087581 WOEFYNFEWBERNQ-UHFFFAOYSA-N 251.326 2.170 10 10 CECE NC1C[C@@H]2CC[C@H](C1)N2Cc1cc(Cl)ccc1O 40749136 DLQBDOJKYNRFSF-YHWZYXNKSA-N 266.772 2.500 10 10 CECE CCCN(CC)C1CN(c2ccc(CN)cc2F)C1 2141159714 HMZPLDOTHMZOEO-UHFFFAOYSA-N 265.376 2.205 10 10 CECE CCCN[C@@](C)(CO)CCSc1nccs1 82907247 YDJXHAOELVFUGH-LLVKDONJSA-N 260.428 2.376 10 10 CECE c1ccc(CNCc2ccc(N3CCNCC3)cc2)cc1 84846344 JFEAUZZYEBUZLN-UHFFFAOYSA-N 281.403 2.386 10 10 CECE CN[C@@H](C)c1ccc(N(C)CC(C)(C)O)c(F)c1 92968434 DVGDKGBWDMAPJD-JTQLQIEISA-N 254.349 2.313 10 10 CECE C[C@H](NC[C@H](O)C(F)(F)F)c1ccc(F)cc1O 230659215 XWBVSPFEPCMBIF-WKEGUHRASA-N 267.222 2.105 10 10 CECE CC1(C)CN(Cc2ccc(N3CCOCC3)cc2)CCO1 91917496 MJOYTXLJWHEGQB-UHFFFAOYSA-N 290.407 2.134 10 10 CECE CC(C)CN1CC[C@H](N)[C@H]1c1ccc(N(C)C)cc1 250600682 RLOKAVHPNQIUPR-JKSUJKDBSA-N 261.413 2.483 10 10 CECE CN(C)c1ccc(CNCC2(O)Cc3ccccc3C2)cc1 377771551 OISQKKNDNJDKGI-UHFFFAOYSA-N 296.414 2.372 10 10 CECE CN(CC1(C)COC1)c1ccc(/C=C/C(=O)O)cc1F 705586449 VRTGTPVTJVXQBB-GQCTYLIASA-N 279.311 2.396 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3CN(C)C[C@@H]3C2)c(Cl)c1 705611839 AURFJXFQCGALBF-RAIGVLPGSA-N 280.799 2.391 10 10 CECE NCc1ccc(N2[C@H](CO)C[C@@H]3CCC[C@@H]32)c(F)c1F 2164831165 FHTDJMFOZZFTPH-DLOVCJGASA-N 282.334 2.163 10 10 CECE CN(C)c1ccc([C@@H](O)c2ccn3nccc3c2)cc1 2165305452 OLRJDCKXYHXTPG-MRXNPFEDSA-N 267.332 2.482 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@]12COC[C@H]1C2(F)F 2163068349 GZESYLPLEFXXIL-MCIONIFRSA-N 282.334 2.295 10 10 CECE COC[C@@]1([C@H](O)c2ccc(N(C)C)cc2)CCCCO1 2163078099 GMZJTGXRTCNVEA-HZPDHXFCSA-N 279.380 2.372 10 10 CECE O[C@H](C[C@H]1COCCO1)c1ccc(N2CCCC2)cc1 2163096910 ZWQRZZHRNLKWEF-JKSUJKDBSA-N 277.364 2.126 10 10 CECE CN1CCCc2cc(C3=C[C@]4(CCOC4)NC3)ccc21 2163105765 GNASNXQWXXQGOJ-KRWDZBQOSA-N 270.376 2.215 10 10 CECE COCCOCC[C@H](O)c1ccc(N2CCCC2)cc1 2163107922 QSOBHLGAMZNRBQ-INIZCTEOSA-N 279.380 2.373 10 10 CECE CC[C@H](COC)C[C@@H](NN)c1ccc2c(c1)CCN2C 2163144617 SAYPWCBYNVSXEQ-SWLSCSKDSA-N 277.412 2.246 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1sccc1F 815836101 PXYTYMMUFCGQAC-UHFFFAOYSA-N 267.281 2.228 10 10 CECE N=C(N)N[C@@H](c1cc(Cl)ccc1O)C(F)(F)F 575245922 BXBXVSAVWVMWBU-ZETCQYMHSA-N 267.638 2.132 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@](C)(O)C2CC=CC2)cc1 2134293000 KFRCQUMATYTKQL-CVEARBPZSA-N 260.381 2.470 10 10 CECE C[C@@H](CNC(=O)NCc1ccccc1O)CC(F)F 826035966 QQTYSSXQOVXOPZ-SECBINFHSA-N 272.295 2.483 10 10 CECE CN(C)c1ccc(/C=C\CN2CCC3(COC3)C2)cc1 827643323 IHYBSDKENOVPCW-ARJAWSKDSA-N 272.392 2.488 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H]2C[C@@H]2C)c1 728947986 INIRPSLQDUVTKE-GARJFASQSA-N 278.352 2.417 10 10 CECE Nc1ccc(CCN2CC[C@H]3CC[C@H](O)[C@H]2C3)cc1 722206319 OHMBTEBSBGZNLE-BMFZPTHFSA-N 260.381 2.047 10 10 CECE COc1ccc(CNC(=O)C[C@@H](C)[C@H]2CCCO2)c(O)c1 846948967 DUZFNMLWTMVKAY-IAQYHMDHSA-N 293.363 2.222 10 10 CECE COc1ccc(N2CC[C@H](N[C@H]3CCCNCC3)C2)cc1 849350812 XFJAOHJUNIWTJI-GJZGRUSLSA-N 289.423 2.006 10 10 CECE Oc1cc2c(cc1CN1CC[C@]3(C1)CC3(F)F)OCO2 844760291 PIGMYICLAWXGBT-CYBMUJFWSA-N 283.274 2.352 10 10 CECE COC[C@H](O)CN(CC(C)C)c1ccc(OC)cc1 747681647 FCSWOKGEBNKZFC-CQSZACIVSA-N 267.369 2.165 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)C1(F)CC1 843758454 PJORGYGJMIMOPT-UHFFFAOYSA-N 250.317 2.213 10 10 CECE COC[C@@H](C)[C@@H](C)C(=O)NCc1c(O)cccc1F 928705578 KBKVXMQUFCMTOP-NXEZZACHSA-N 269.316 2.066 10 10 CECE C[C@H](N[C@@H]1C[C@@H](O)C12CCC2)c1ccc(F)cc1O 850545083 DPXYNKCVSFCGGM-CUOATXAZSA-N 265.328 2.485 10 10 CECE O=C(NCc1c(O)cccc1F)[C@H]1CCCSC1 928705998 NHIKDCZHNMCGIF-VIFPVBQESA-N 269.341 2.291 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)c3ccccn3)C2)cc1 855234976 SHGXRLFPJAWYEM-ZDUSSCGKSA-N 297.358 2.099 10 10 CECE CSCCN(CC(=O)O)[C@@H](C)c1ccc(F)cc1O 696929684 KUDAMIQKEBKMBX-VIFPVBQESA-N 287.356 2.342 10 10 CECE COC[C@@H]1CCCN1c1ccc([C@H](C)O)cc1F 696591673 WXPOIRUFVAXEHC-JQWIXIFHSA-N 253.317 2.494 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2C[C@H](C)O[C@@H]2C)c1 866443977 XLMFKXSCGLDRRQ-KZWBYHQPSA-N 293.363 2.395 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=N)N[C@@H]1C[C@@H]1C 864459784 CEKYLSRKEYHOKS-SMDDNHRTSA-N 260.385 2.083 10 10 CECE CCN(C)C(=O)OCCNCc1cccc(Cl)c1O 1876009201 YEIJECRFYLRKHM-UHFFFAOYSA-N 286.759 2.224 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)N1CC2(CC(F)C2)C1 779536110 VPDFPVAKNYXZLD-DUXPYHPUSA-N 277.295 2.072 10 10 CECE NC[C@@H]1CN(c2ccc(N)cc2)CC[C@@H]1C(F)(F)F 1876258565 LVHVCKJSSMDWCX-SKDRFNHKSA-N 273.302 2.232 10 10 CECE CC(C)(C)O[C@@H]1C[C@H]1C(=O)N1Cc2cccc(O)c2C1 871205798 LCODBXAWDSTIIF-BXUZGUMPSA-N 275.348 2.438 10 10 CECE CCNc1cn[nH]c(=N[C@H](C)c2ccccc2O)c1 1877587173 DPFGGBOSSXEWDP-SNVBAGLBSA-N 258.325 2.209 10 10 CECE C[C@@H]1C[C@@H](CC(=O)N[C@H](C)c2ccccc2O)CO1 1877573756 OJIAGTRTICBGFF-UTUOFQBUSA-N 263.337 2.385 10 10 CECE NCCCc1nc2cc(N)ccc2n1Cc1ccc(N)cc1 76004152 IDPPXXGUTDUJAA-UHFFFAOYSA-N 295.390 2.140 10 10 CECE CN(Cc1ccccc1O)C(=O)C(C)(C)c1cnc[nH]1 788283349 OHLGKYAICNDAKD-UHFFFAOYSA-N 273.336 2.052 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccn1)C1CC1 1135813376 DCSKEWDJWNZBBB-UHFFFAOYSA-N 298.342 2.227 10 10 CECE C[C@H](N)c1cc(F)c(N(C)[C@@H]2COC[C@H]2C)c(F)c1 1880924563 SGXUNEZFLSXNJK-VYUIOLGVSA-N 270.323 2.456 10 10 CECE CC[C@@H]1CN2CCC[C@H]2CN1Cc1ccccc1O 248404139 ZWTRZZCDIWBVEN-CABCVRRESA-N 260.381 2.451 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N(CC1CC1)CC1CC1 1301487806 FXDAJNYRQDDOQD-UHFFFAOYSA-N 275.348 2.289 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H]2CNCC23CCC3)cc1 1886938757 OXFBHZFDERGJLI-GJZGRUSLSA-N 259.397 2.142 10 10 CECE COc1ccc(O)c(CNCC(C)(C)CN(C)C)c1 20087922 GOMPSBRUMQKURM-UHFFFAOYSA-N 266.385 2.078 10 10 CECE CCN(CC)c1ccc([C@H]2CNCCN2CC)c(O)c1 83583663 UPEKAUWUYVXKAK-OAHLLOKOSA-N 277.412 2.205 10 10 CECE COc1cccc([C@@H]2NCCc3cccc(O)c32)c1O 83593540 WWOWKUUBILXXIC-HNNXBMFYSA-N 271.316 2.342 10 10 CECE CN(C)c1ncc(CNCc2ccccc2O)s1 1963333698 UYSHEFJBARPNAR-UHFFFAOYSA-N 263.366 2.205 10 10 CECE Oc1cc2c(cc1O)[C@H]([C@H]1C[C@@H]3C=C[C@H]1C3)NCC2 83724212 MJQMTVGHHVDTAU-IZXSPOQTSA-N 257.333 2.497 10 10 CECE C/C(=C\c1ccco1)C(=O)NCc1cc(O)ccc1O 1176755731 UKODNVIPJHVTCU-JXMROGBWSA-N 273.288 2.411 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1csc([N+](=O)[O-])c1 701323065 KRCSVRPTLCNVQD-UHFFFAOYSA-N 255.259 2.087 10 10 CECE CCCO[C@@H]1CCN(c2c(F)cc(CN)cc2F)C1 701673627 PJHUUZDAVOXRIQ-LLVKDONJSA-N 270.323 2.429 10 10 CECE CC(C)(C)OC(=O)N1C[C@H](NCc2ccccc2O)CO1 703372790 KYGZQVSYEVTOMB-LBPRGKRZSA-N 294.351 2.033 10 10 CECE CCN1CC(CN(C)c2ccc([C@H](C)NC)cc2F)C1 692225124 DBAWVWOAZBJXDT-LBPRGKRZSA-N 279.403 2.494 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC34CCC4)ccc21 706457501 WZBCRIZMZHQFJA-ZDUSSCGKSA-N 257.337 2.032 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](C)[C@@H](CO)C2)cc1Cl 709219813 DYTRFGCGEHZQFZ-OUAUKWLOSA-N 268.788 2.424 10 10 CECE C[C@@H]1CN(c2c(F)cc(CN)cc2F)CC(C)(C)O1 62718703 ATINBQATSAGQCM-SECBINFHSA-N 270.323 2.427 10 10 CECE Cc1ccc(S[C@@H](C)C(=O)Nc2ccc(N)cc2)nn1 711713032 VBEBCNWRICRVFU-JTQLQIEISA-N 288.376 2.487 10 10 CECE CN1CCN(c2c(F)cc(CO)cc2F)CCC1(C)C 712605303 AOVRVKMYVMWJLQ-UHFFFAOYSA-N 284.350 2.378 10 10 CECE COC[C@@H](CN(C)Cc1cc(Cl)ccc1O)OC 691300042 MWCHOAWITQXYFB-GFCCVEGCSA-N 273.760 2.139 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1cc(O)ccc1O 691687365 CJOHGIRCRFSVLN-QMMMGPOBSA-N 262.269 2.013 10 10 CECE COc1ccc(O)c([C@H](C)NCC[C@H](O)C(F)(F)F)c1 717351565 PKWLQHFNUAVXBB-UFBFGSQYSA-N 293.285 2.365 10 10 CECE C[C@H]1C[C@H](NC(=O)CCc2ccc(N)cc2)C[C@@H](C)O1 694787927 ALXQOWOYPDCSLG-JJLQDPRZSA-N 276.380 2.274 10 10 CECE CC[C@H]1CN(Cc2cc(OC)ccc2O)[C@@H](CC)CN1 86445608 YXVKETMWVADBDG-KBPBESRZSA-N 278.396 2.363 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1CCCSCC1 822009447 QFSHGWQEDKCZSH-SECBINFHSA-N 265.382 2.065 10 10 CECE CCCN[C@H](C)c1ccc(N2CCN(C)CC2)cc1O 93669828 ZTCWSKSFUAJENG-CYBMUJFWSA-N 277.412 2.205 10 10 CECE CC[C@H]1CCN(S(=O)(=O)Cc2ccc(N)cc2)[C@@H]1C 2115280754 YYKOXORTDFSKEU-YPMHNXCESA-N 282.409 2.219 10 10 CECE CC[C@@H]1C[C@H]1CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 2200016858 QXOPONHZJICMAR-JRPNMDOOSA-N 274.364 2.179 10 10 CECE Cc1ncccc1/C=C/C(=O)N(C)c1ccccn1 1350725713 TZSFCUXDLADSGY-CMDGGOBGSA-N 253.305 2.461 10 10 CECE COc1ccc(N2C[C@H](CO)CC(C)(C)C2)c(N)c1 2115960842 SNPBOHHMPMCHEF-LLVKDONJSA-N 264.369 2.122 10 10 CECE COC1(c2noc(CCc3ccc(N)cc3)n2)CC1 2116573780 QUQGWRCJJPQZOW-UHFFFAOYSA-N 259.309 2.073 10 10 CECE CCOc1cc(CNCC(C)C)ccc1N1CCNCC1 212027155 XNLIWWQBOLTCKD-UHFFFAOYSA-N 291.439 2.241 10 10 CECE CO[C@H]1C=C[C@H](NCc2ccc3c(c2)CCN3C)C1 2119400383 XANVNXCYBGIVCO-GJZGRUSLSA-N 258.365 2.112 10 10 CECE CC(C)(C)S(=O)(=O)CCOCCc1ccc(N)cc1 2119729253 HLIIOYOUSMXTQQ-UHFFFAOYSA-N 285.409 2.041 10 10 CECE NCc1ccc(N2CC3(CO)CCC2CC3)cc1F 2122358151 DNFGHAJSYUMQKB-UHFFFAOYSA-N 264.344 2.026 10 10 CECE CCO[C@H]1CC[C@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2123017119 DQFRZYVVZDLOLX-TUAOUCFPSA-N 266.345 2.493 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1ccc2nccnc2c1 1543142725 IHMHRQGZBDQSRG-UHFFFAOYSA-N 295.298 2.222 10 10 CECE CCOc1cccc(NC(=O)Cc2ccc(O)c(O)c2)n1 1629380523 OEHLAUHZEUEFCS-UHFFFAOYSA-N 288.303 2.073 10 10 CECE C[C@H](Oc1cccc(F)c1)C(=O)N(C)CCN=[N+]=[N-] 1912149345 FHDFPQGKIDUGAH-VIFPVBQESA-N 266.276 2.362 10 10 CECE C[C@@H]1CCCC[C@H]1NC(=O)CN1CC[C@@H](CN=[N+]=[N-])C1 1912163459 JULYJGCJZQYDGC-FRRDWIJNSA-N 279.388 2.314 10 10 CECE CC1(C)CO[C@@H](CC(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 1912149135 BPNRBMNOWOSMHK-MNOVXSKESA-N 266.345 2.350 10 10 CECE COC(=O)C1(NCCCN=[N+]=[N-])C[C@H]2[C@H](C1)C2(C)C 1912179218 SCZIJFDIQQWLGB-UWVGGRQHSA-N 266.345 2.254 10 10 CECE CC(C)(C)CCS(=O)(=O)N1CC[C@H](CN=[N+]=[N-])C1 1912169057 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C[C@@H](N)c1ccc(N2CC[C@H](O)[C@H]2C)cc1Br 1914303285 JIYJIYHNYXLNKE-KKFJDGPESA-N 299.212 2.428 10 10 CECE Oc1c(Cl)cccc1CNC1CC(n2cnnc2)C1 2127670757 YUNOKGYWYWDFRS-UHFFFAOYSA-N 278.743 2.130 10 10 CECE CCN(CC1CN(C)C1)c1ccc2c(c1)CC[C@@H]2N 2128328053 QLCJYOWJBFHXEJ-INIZCTEOSA-N 259.397 2.021 10 10 CECE O=C(N[C@H]1C[C@@H]1C1CCCC1)c1cccc(O)c1O 1966131365 NAGGXVIRMPCZIL-NEPJUHHUSA-N 261.321 2.406 10 10 CECE CCCN(CCN(C)C)c1ccc2c(c1)CC[C@H]2O 2128318412 LKPHDXPJMJTCFJ-MRXNPFEDSA-N 262.397 2.444 10 10 CECE CN[C@@H]1CCCc2cc(N3CC[C@]3(C)CO)ccc21 2128274183 NRNKALXSBASBRC-HZPDHXFCSA-N 260.381 2.245 10 10 CECE COC[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128269893 XJQFBFVVYMFAPA-WBMJQRKESA-N 260.381 2.495 10 10 CECE CN[C@@H]1CCc2cc(N(CCO)CC(C)C)ccc21 2128311828 ZYRMQXUWQJFAKK-MRXNPFEDSA-N 262.397 2.348 10 10 CECE O=c1cc(-c2cccc(O)c2O)oc2cc(O)cc(O)c12 14756805 STAGATUVRDVEAT-UHFFFAOYSA-N 286.239 2.282 10 10 CECE biogenic,in-vitro CCOC(=O)c1cccc(N)c1N[C@@H]1CCCN(CC)C1 161050794 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261.321 2.358 10 10 CECE Cc1ccc([C@H](C)NC2CC([C@H](F)CO)C2)c(O)c1 1907285472 QRBCAMBAIYEWDO-DLOFLVKXSA-N 267.344 2.460 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCc1cc2ccccc2[nH]1 1449457229 SVRAQVNXQCOZEF-UHFFFAOYSA-N 296.326 2.438 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(Cc2ccccc2CC(=O)O)C1 1912168091 RPSKXGPTSYRPQL-LLVKDONJSA-N 274.324 2.446 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)C[C@@H]1CCCOCC1 1912194118 ISXXLVPQLFCDHH-LLVKDONJSA-N 254.334 2.352 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1ccc2[nH]ccc2c1 1912157340 SFRLUBTZNWQLJE-LBPRGKRZSA-N 273.296 2.282 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CC(=O)NCc2cccs2)C1 1912167057 FVSHMWNEIGWPOF-SNVBAGLBSA-N 279.369 2.139 10 10 CECE CN1CC[C@@H](CN2CCCC[C@@H](CN=[N+]=[N-])C2)C1 1912168123 RXALVGATMFXYGV-QWHCGFSZSA-N 251.378 2.351 10 10 CECE O=S(=O)(Nc1ccc(O)cc1)C1CC(C(F)F)C1 1912665112 SGVDWWANMTVXMI-UHFFFAOYSA-N 277.292 2.178 10 10 CECE O=C(N1Cc2cccc(O)c2C1)C(F)(F)c1nccs1 1455038098 YIXOQOHIGXXPIA-UHFFFAOYSA-N 296.298 2.483 10 10 CECE C[C@H]1C(=O)N(C)[C@H](C)[C@H](C)N1Cc1ccc(N(C)C)cc1 1460300948 AELFBKXOQVMXEI-RDBSUJKOSA-N 289.423 2.192 10 10 CECE CC[C@H]1CN(CCCOc2ccc(N)cc2)CCN1C 110703499 YFHMINSUQCTBHB-HNNXBMFYSA-N 277.412 2.064 10 10 CECE C[C@@H](NC(=O)COc1ccc(O)cc1)c1ccccc1O 1471195459 JEPSYBRZAWZNAH-LLVKDONJSA-N 287.315 2.354 10 10 CECE CCCN(Cc1cc(OC)ccc1O)[C@@H]1CCCNC1 110937712 GFSSDQCBBYQBJW-CQSZACIVSA-N 278.396 2.365 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N(C)CCF)ccc21 1917035910 JJFPYRUBYJCBJQ-CYBMUJFWSA-N 265.332 2.085 10 10 CECE Cc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c(O)c1O 1632478320 XQCNGMYTMNVSMG-GFCCVEGCSA-N 292.379 2.009 10 10 CECE Cc1ncoc1CNC(=O)NCc1cccc(Cl)c1O 1565444635 VUJQJPXNQGGHMD-UHFFFAOYSA-N 295.726 2.341 10 10 CECE CCc1ncnc(NCc2c(O)cccc2O)c1F 1652267679 TYYVOAKNISZCPK-UHFFFAOYSA-N 263.272 2.201 10 10 CECE Nc1ccc(CC(=O)N[C@]23CCC[C@H]2CSC3)cc1 2137304551 HJFGMQOADCLSNU-WFASDCNBSA-N 276.405 2.213 10 10 CECE CC(C)(C)OC(=O)NCCCONCc1ccccc1O 1928520519 VFJIQGXVGCWEBG-UHFFFAOYSA-N 296.367 2.328 10 10 CECE CO[C@@]1(C)CCCN(c2c(F)cc(CN)cc2F)C1 230248330 JXJFDCRVGQQLOH-AWEZNQCLSA-N 270.323 2.429 10 10 CECE C[C@]1(O)CCCN(c2c(F)cc(CN)cc2F)CC1 230345336 HHBDXJGIIYITDX-AWEZNQCLSA-N 270.323 2.165 10 10 CECE C[C@@H](N)c1csc(NC(=O)Nc2ccc(N)cc2)n1 2138369374 OAMKLONPPHTIQP-SSDOTTSWSA-N 277.353 2.389 10 10 CECE C[C@@H]1CC[C@H](CN2CCN(c3ccc(N)cc3)C2=O)O1 232033712 JICZVJHIYZMKGF-BXUZGUMPSA-N 275.352 2.078 10 10 CECE COc1ccc(N(C)[C@H]2CCCC[C@H]2N)c(OC)c1 259094872 RXHHUAARPAYWFV-OLZOCXBDSA-N 264.369 2.410 10 10 CECE CC[C@H](OC1CCN(c2ccc(N)cc2)CC1)C(=O)O 585880376 TXCCACCSHZEDAH-AWEZNQCLSA-N 278.352 2.117 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(OC)c2)CCCO1 2139689220 VHNCCVSZRPXJCZ-AWEZNQCLSA-N 264.369 2.159 10 10 CECE CC[C@@H]1CCOCCN1c1ccc(CN)c(OC)c1 2139698328 HHWYLVZRLQFGOA-CYBMUJFWSA-N 264.369 2.159 10 10 CECE CNCc1ccc(N(C)[C@H]2C[C@@H](OC)C2)cc1OC 2139696158 DFDHQAJJNOOMGO-OKILXGFUSA-N 264.369 2.028 10 10 CECE [N-]=[N+]=NCCN[C@]1(C(=O)O)CC[C@@H]1OCc1ccccc1 1934875003 OXBTXZFIDPQELV-GXTWGEPZSA-N 290.323 2.089 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@]12C[C@H](CO1)C2 2140265595 FJJXQELFEFMSPG-LYRGGWFBSA-N 258.365 2.118 10 10 CECE CN(C)[C@H]1CCN(c2ccc(CN)c3ccccc23)C1 234256548 IWCDFSYOGKLQDK-AWEZNQCLSA-N 269.392 2.439 10 10 CECE CCc1ccc(NC(=O)c2cccc(O)c2O)cc1N 125965316 KOUQXTWYTBPXTM-UHFFFAOYSA-N 272.304 2.495 10 10 CECE CC(C)SC[C@](C)(O)[C@H](N)c1ccccc1O 1943689129 DGURCLWHHFKKSW-OLZOCXBDSA-N 255.383 2.285 10 10 CECE Cc1ncnc(CNCc2c(O)cccc2F)c1C 2141703500 TZYRAVHMOMPEAW-UHFFFAOYSA-N 261.300 2.228 10 10 CECE O[C@H]1C[C@H](CNCc2ccc3c(c2)CCO3)C12CCC2 1875438936 ABFZBEJCPWAUHD-ZBFHGGJFSA-N 273.376 2.262 10 10 CECE CO[C@H]1C[C@@H](NCc2c(O)cccc2Cl)C[C@H]1OC 1875527633 WYWCZCWVOZWOAL-KFKUMKOWSA-N 285.771 2.328 10 10 CECE CN(C[C@@H]1C[C@H]1CF)c1ccc(CO)c([N+](=O)[O-])c1 1875815292 OIOULTWDEYIYND-QWRGUYRKSA-N 268.288 2.129 10 10 CECE NC[C@H]1C[C@H](C(F)(F)F)CCN1c1ccc(N)cc1 1876400041 WOPUFQRIIISXMM-BXKDBHETSA-N 273.302 2.375 10 10 CECE CN(C)[C@H]1C[C@@H](CNCc2cc(F)cc(F)c2O)C1 883161380 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Cc1ccc(CN[C@H](CC(C)C)C(=O)N(C)C)c(O)c1 1963047859 SVJIVIIBFXJLTN-CQSZACIVSA-N 278.396 2.293 10 10 CECE CN(C)c1nc(CNCc2ccc(F)c(F)c2O)cs1 2149568132 VEGIREWQSUIYOP-UHFFFAOYSA-N 299.346 2.483 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1c2ccccc2C[C@H]1O 1963629103 IZVJCSQOVKHQIM-HZPDHXFCSA-N 273.307 2.279 10 10 CECE CC1(C)[C@@H](O)C[C@H]1CNCc1c(O)cccc1F 1966071972 LEHQUVTUJVDPQZ-ZANVPECISA-N 253.317 2.028 10 10 CECE CC1(C)COC[C@H](CN[C@H]2CCc3cccc(O)c32)O1 1967471048 LZBIIIDQSGGQIU-STQMWFEESA-N 277.364 2.163 10 10 CECE CN(C[C@@H](O)c1ccc(F)cc1)c1ccc(CN)cc1 1967636535 WSRRQHWWKAAIGW-MRXNPFEDSA-N 274.339 2.454 10 10 CECE Cn1ccc(C(C)(C)CNCc2ccc(F)cc2O)n1 1967777941 IWSRBBKIWLWQLN-UHFFFAOYSA-N 277.343 2.332 10 10 CECE CC[C@@H]1CCN(Cc2ccc(C)cc2O)[C@@H]1C(=O)O 1968202595 PWLUWUITQOMIJF-RISCZKNCSA-N 263.337 2.386 10 10 CECE CO[C@@H]1C[C@H]2C[C@H]1C[C@H]2NCc1c(O)cccc1F 1974142651 YOHNNRBQBYHAOQ-YJKIEOBBSA-N 265.328 2.434 10 10 CECE Cc1cc(Sc2ncc([C@@H](C)O)s2)n(C)n1 1976519972 QEAYSYNEKCWSEY-SSDOTTSWSA-N 255.368 2.390 10 10 CECE Oc1cc(Br)ccc1CNCc1cnco1 1977446248 OFNODDHGKQHFIB-UHFFFAOYSA-N 283.125 2.433 10 10 CECE CN[C@H](C[C@@H]1CC1(F)F)[C@@H](O)c1ccc(N(C)C)cc1 2147715258 UUJNRAKQPXGMRO-BNOWGMLFSA-N 284.350 2.419 10 10 CECE CNC(=O)CC1CCN(c2ccc([C@@H](C)N)cc2)CC1 2145060817 USUHTQFZAZOPIC-GFCCVEGCSA-N 275.396 2.059 10 10 CECE Cc1nc([C@@H](N)[C@@H](O)c2ccc3c(c2)CCN3C)cs1 2147824920 PVUFOMMDPPUQRU-CABCVRRESA-N 289.404 2.177 10 10 CECE CC[C@@H](N)c1ccc(N2CCO[C@H](CCOC)C2)cc1 2148075643 ZLTWKCAGJIYWGK-HZPDHXFCSA-N 278.396 2.338 10 10 CECE CCOC(=O)CCc1cc(N(C)C)ccc1OC 260464697 SHOJQYVPMCHIFX-UHFFFAOYSA-N 251.326 2.257 10 10 CECE O=C(O)[C@H]1C[C@]12CCCN(Cc1cc(F)ccc1O)C2 2146459197 GBQGTTVZFFAQTB-DOMZBBRYSA-N 279.311 2.218 10 10 CECE CC(C)(C)[C@](N)(CSc1nccs1)C(=O)O 1995442958 TWPJWYCEPAOLBO-JTQLQIEISA-N 260.384 2.063 10 10 CECE CCN1CCC[C@H](N(C)c2ccc(CNC)cc2F)C1 2158727589 CKQQARJBDAEWQQ-AWEZNQCLSA-N 279.403 2.466 10 10 CECE OCc1ccc(N(C2CC2)C2COC2)c(Cl)c1 1998272948 CFOMUTZUUBSSBW-UHFFFAOYSA-N 253.729 2.200 10 10 CECE CO[C@@H]1CN(c2ccc([C@@H](C)N)cc2Cl)[C@H]2COC[C@H]12 2158352945 JPLKOUGCQJPBFI-PBUVFVDJSA-N 296.798 2.210 10 10 CECE C[C@H](N(C)S(=O)(=O)Cc1ccc(N)cc1)C(C)(C)C 44353572 OMMLMMAEWRGTDQ-NSHDSACASA-N 284.425 2.465 10 10 CECE CNCc1ccc(N2CCC[C@@](O)(COC)C2)cc1Cl 2151835871 FGPUYYHAXMHWMP-HNNXBMFYSA-N 298.814 2.037 10 10 CECE COC(=O)c1cnc(Sc2ncc(C)n2C)s1 2011479526 ODVFGOVOTMSDAZ-UHFFFAOYSA-N 269.351 2.123 10 10 CECE CCN(CC)C[C@H](C)NC(=O)CCc1ccc(N)cc1 45661850 QKKXPPZZOUDEIJ-ZDUSSCGKSA-N 277.412 2.048 10 10 CECE C[C@H](N[C@H]1CCC(=O)N[C@H]1C)c1ccc(N(C)C)cc1 282281122 LAMZRZDSBOYJSI-HUBLWGQQSA-N 275.396 2.070 10 10 CECE Nc1cccc(Br)c1N[C@@H]1CC[C@@H]2CNC[C@@H]21 2016950821 FKRANDJLMJGQED-VDDIYKPWSA-N 296.212 2.441 10 10 CECE CN1CCC[C@H](NCc2ccc3c(c2)CCCN3C)C1 50286790 BXDXRVKDMVPAES-INIZCTEOSA-N 273.424 2.253 10 10 CECE CC[C@@H](CN(C)C)N[C@@H](C)c1ccc(O)cc1O 2029871635 WHPKBWUFZZKMSM-QWRGUYRKSA-N 252.358 2.089 10 10 CECE COc1cc(N)c(N2CCC[C@H](OC)[C@@H]2C)cc1OC 2155358267 RHHZMUHSYBTWCT-GWCFXTLKSA-N 280.368 2.290 10 10 CECE C[C@H](NC[C@H]1CO[C@H](C)C1)c1cc(O)ccc1O 2040302290 OABCDPZFYDUQJF-VWYCJHECSA-N 251.326 2.173 10 10 CECE CNCC[C@H]1CCCCN1Cc1ccc(O)c(O)c1 70190796 UDMPOHXQWWPMCF-CYBMUJFWSA-N 264.369 2.062 10 10 CECE Nc1ccc(NC(=O)[C@@H]2COc3ccccc3C2)cc1 70158398 GKBSRMBFGAKDPO-LBPRGKRZSA-N 268.316 2.459 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])C[C@@H](OC)C1(C)C 2156424152 CJKKCCVJSIAUHC-MFKMUULPSA-N 284.360 2.023 10 10 CECE CCN(Cc1cc(C(C)=O)ccc1O)[C@@H]1CCOC1 311466132 NEDUBBZOGFIIBF-CQSZACIVSA-N 263.337 2.206 10 10 CECE CNCc1cc(F)c(N(C)C[C@H](C)COC)c(F)c1 312097544 SEPVITONFRSELJ-JTQLQIEISA-N 272.339 2.403 10 10 CECE O=C(O)C1CC2(CCN(Cc3c(O)cccc3F)C2)C1 2161313011 AWUCSPQUZZLWRU-UHFFFAOYSA-N 279.311 2.218 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1C(=O)Nc1ccnn1-c1ccc(N)cc1 2161529436 HVDNVQKNJJZKHO-MSRIBSCDSA-N 270.336 2.295 10 10 CECE CN(Cc1cc(N)ccc1O)C1[C@H]2CCC[C@H]1COC2 2169098800 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2.157 10 10 CECE C[C@H](NC[C@H]1CCO[C@H]1C)c1ccc(O)cc1O 300613028 SIGCHEJCMIOYBM-GARJFASQSA-N 251.326 2.173 10 10 CECE Cc1cnn(C)c1CN1CCc2cc([C@@H](C)N)ccc21 2154340060 REJLBYNUIUTDHE-GFCCVEGCSA-N 270.380 2.311 10 10 CECE NCc1cc(F)c(N2CCC(CCO)CC2)c(F)c1 401021488 RDSVAMLRFVYYKU-UHFFFAOYSA-N 270.323 2.022 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)C[C@@H]1CCOC1 401259991 QHXXOSISOORYIT-AWEZNQCLSA-N 276.380 2.434 10 10 CECE C[C@@H](N[C@@H]1CC[C@H]2CC[C@H]1O2)c1cc(O)ccc1O 401630884 DRQIOWGFEBTYAR-VDYMJLGFSA-N 263.337 2.458 10 10 CECE COc1cccc(O)c1C(=O)NCCCCN=[N+]=[N-] 405339866 CAXBPYNFKBWGCA-UHFFFAOYSA-N 264.285 2.221 10 10 CECE CC(C)N(C)C[C@@H](C)N[C@@H](C)c1c(O)cccc1O 311656036 FMTCPKVVXFUYQK-NEPJUHHUSA-N 266.385 2.477 10 10 CECE COc1cc(F)cc(NC(=O)c2ccc(O)c(O)c2)c1 312204258 AKKFLLVEUMLXCS-UHFFFAOYSA-N 277.251 2.498 10 10 CECE COCC[C@@H](COC)N[C@H](C)c1cc(OC)ccc1O 313168018 IUEUIXYZUZUHMK-NEPJUHHUSA-N 283.368 2.103 10 10 CECE COCCO[C@H]1CCCN(c2ccc([C@@H](C)O)cc2)C1 2158832668 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OCc1cc(F)c(N2[C@H](CO)C[C@@H]3CCC[C@H]32)c(F)c1 2164662417 HLLNZSJHDFFTBS-COPLHBTASA-N 283.318 2.197 10 10 CECE CO[C@@H]1CC(OCCCc2ccc(N)cc2)C[C@H]1OC 2166417927 HXVQCXQEPZXNJB-HZPDHXFCSA-N 279.380 2.410 10 10 CECE CCCn1ccc([C@H](N)c2ccc3c(c2)CCN3C)n1 2173478389 RKQFDXGVMARVRR-MRXNPFEDSA-N 270.380 2.334 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CO[C@]3(CCOC3)C2)c1 2178982395 LKQAGHKMNNNAPO-WOSRLPQWSA-N 277.364 2.299 10 10 CECE C[C@@H](N)c1ccc(N2CC(C(=O)NC3CC3)C2)c(Cl)c1 2168047871 ZLHPPFCWSHZIIS-SECBINFHSA-N 293.798 2.075 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)ccc1C[C@H](C)N 2174673840 WBDUFQFJNXMSFA-OSMBCOQSSA-N 274.408 2.213 10 10 CECE C[C@H]1CC(F)(F)CCN1C(=O)Cc1ccc(O)c(O)c1 1635729927 LTTGDKGUEGHFDG-VIFPVBQESA-N 285.290 2.287 10 10 CECE COC[C@]1(F)CCN(c2ccc(C[C@@H](C)N)c(C)c2)C1 2179804010 QDPFZUUSXIACGX-CJNGLKHVSA-N 280.387 2.450 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c(F)c1 2194514124 PMTYCGUBJOQFGF-HJUHTLPRSA-N 282.334 2.014 10 10 CECE CC[C@H](N)c1ccc(N(C)[C@H]2CCC(=O)N(C)C2)cc1 2188487750 UYVJXOSHTVAJDZ-GJZGRUSLSA-N 275.396 2.153 10 10 CECE CO[C@H]1CCCN(c2ccc(CO)c([N+](=O)[O-])c2)[C@@H]1C 2188572518 SQJVIBYROYDQOM-YGRLFVJLSA-N 280.324 2.091 10 10 CECE CCc1cc(CN(C)c2ccc(CN)c(F)c2)n(C)n1 2192440185 ULSDMZHECCYJLV-UHFFFAOYSA-N 276.359 2.217 10 10 CECE CCCN(CC(F)(F)F)C(=O)c1cc(O)c(O)c(O)c1 2188874454 HQKXXGBGOAADCU-UHFFFAOYSA-N 293.241 2.218 10 10 CECE Cc1cn2[nH]c(=N[C@@H](C)c3ccccc3O)ccc2n1 2192626862 RFAXZATVUJHROL-NSHDSACASA-N 268.320 2.338 10 10 CECE C[C@H](N[C@H]1C2CCN(CC2)[C@H]1C)c1cc(O)ccc1O 2192787017 QMODLHVIYSJQOZ-XMZIXOGTSA-N 276.380 2.231 10 10 CECE COc1ccc(N2CC[C@H](CN)C[C@@H]2C)cc1F 2044339201 UBUYJZLJWGYRAB-QWRGUYRKSA-N 252.333 2.398 10 10 CECE CC(C)[C@H](O)CN(C)CCCc1ccc(N)cc1 2048674444 YKJYLVTZLVNEOW-OAHLLOKOSA-N 250.386 2.150 10 10 CECE Oc1cccc(Cl)c1CNC[C@H]1CC2(CCOCC2)O1 2189480201 LDCXSISTIIZDLH-LLVKDONJSA-N 297.782 2.473 10 10 CECE C[C@@H](O)c1ccc(N2CC=C(CO)CC2)c(F)c1 2051392152 GFQOPGFFPVNLOD-SNVBAGLBSA-N 251.301 2.008 10 10 CECE C[C@@H]1OC2(C(=O)N3CCCC[C@H](CN=[N+]=[N-])C3)CC1C2 2193086068 AYWSZTJKHAWABE-QSZRKCJJSA-N 278.356 2.493 10 10 CECE C[C@@H](O)c1ccc(N2CC[S@@](=O)C[C@H]2C)cc1Cl 2051910987 YUBFKIHWGXNQAE-CLFVBBPSSA-N 287.812 2.351 10 10 CECE CO[C@H]1C[C@@H](CNc2ccc(N)cc2)C[C@H]1OC 2054477776 HTDVKGQVFWRAHQ-ZOZIMZAQSA-N 250.342 2.121 10 10 CECE N[C@H]1CCCc2cc(N3CC4(CC4)C[C@H]3CO)ccc21 2184691560 PNUADCCVTIQGOT-HOCLYGCPSA-N 272.392 2.374 10 10 CECE COC1(C(F)(F)F)CN(c2ccc3c(c2)CC[C@@H]3O)C1 2184736975 AGLRCOBALUZTEU-LBPRGKRZSA-N 287.281 2.434 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@@H]3N)CC[C@H]1N(C)C 2184743092 GNCJDGCJMOFJDR-AFAVFJNCSA-N 273.424 2.409 10 10 CECE CN1CC[C@@H]2CCN(c3ccc4c(c3)CC[C@H]4O)C[C@H]21 2184738388 SIHBNGVTLOEABB-CSMYWGQOSA-N 272.392 2.197 10 10 CECE CCN(C)C[C@H]1CCN(c2ccc3c(c2)CC[C@H]3N)C1 2184727230 UJQYXFXXUJLPPR-CXAGYDPISA-N 273.424 2.411 10 10 CECE CC[C@H](O)CN(C)c1ccc(CNC2CC2)c(C)c1 2106629451 RCXLJDADAMVDQA-INIZCTEOSA-N 262.397 2.454 10 10 CECE CCOC(=O)c1nnc(Nc2ccc(N)cc2)s1 2064492638 HRJJQMVEOMZAFW-UHFFFAOYSA-N 264.310 2.041 10 10 CECE C[C@H](NC[C@@H]1CC(C)(C)O1)c1ccc(O)cc1O 2069136448 SWSKJWBCUJXAGT-ONGXEEELSA-N 251.326 2.316 10 10 CECE NC(=O)N[C@H]1CC[C@H](NCc2cccc(Cl)c2O)CC1 2186196092 WVMNVKMFQCEKHW-XYPYZODXSA-N 297.786 2.115 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1NC[C@@H]3C2 2071650138 IQLNFHUTILMGTR-LGTSKVTRSA-N 263.772 2.331 10 10 CECE C[C@H](N)CCCC(=O)N[C@@H](C)c1ccccc1O 2072491684 UCMRXTVFEDVGFM-QWRGUYRKSA-N 250.342 2.087 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N3CC=C(C)C3)ccc21 2197873685 GHCPMQQKWRGYKN-OAHLLOKOSA-N 271.364 2.446 10 10 CECE CCNCc1ccc(N2CCC[C@@](F)(CO)C2)cc1 2101309438 BVOWVVQRGNXUJB-HNNXBMFYSA-N 266.360 2.097 10 10 CECE CC(C)CO[C@@H]1CCN(Cc2cc(N)ccc2O)C1 2102463042 OAGBFTIVOJEHAY-CQSZACIVSA-N 264.369 2.221 10 10 CECE CO[C@@H]1CC[C@@H]1CCNCc1ccc(F)cc1O 2084176205 LKNIYURKZXTLRR-QMTHXVAHSA-N 253.317 2.436 10 10 CECE CN[C@H](CN(C)c1ccc(OC)cc1)C1(Cl)CC1 2085571856 FGZPVXGINCWMGP-CYBMUJFWSA-N 268.788 2.491 10 10 CECE CCOC(=O)[C@@](CSc1nccs1)(NC)C(C)C 2086572080 WYEZRLBXZHHXCZ-LBPRGKRZSA-N 288.438 2.413 10 10 CECE CN[C@H](c1cccnc1)c1ccc2c(c1)CCN2C 2106795313 GEOQYOKEXJAVLP-INIZCTEOSA-N 253.349 2.383 10 10 CECE CCOC1CC([C@@H](N)c2ccc3c(c2)CCN3C)C1 2106852274 DHIWIPYUINADMA-XUJLQICISA-N 260.381 2.494 10 10 CECE C[C@@H]1C[C@@H]([C@@H](O)c2ccc(N3CCCCC3)cc2)N1 2106834333 SUFHGFLFEJPKOP-KCXAZCMYSA-N 260.381 2.461 10 10 CECE CCc1cnc([C@@H](NC)c2ccc(N(C)C)cc2)[nH]1 2107889807 SKGVLWGLNFIPAB-AWEZNQCLSA-N 258.369 2.347 10 10 CECE Oc1cccc2c1[C@H](N1CC[C@H]3COCC[C@H]31)CC2 2088706446 KVQFVXZYOSXAOY-BFHYXJOUSA-N 259.349 2.490 10 10 CECE CC1(C)CO[C@H](C(=O)N2CCC(CN=[N+]=[N-])CC2)C1 2109963199 CNDJVWVGPSYVPU-NSHDSACASA-N 266.345 2.350 10 10 CECE N[C@@H](c1ccccc1O)c1cccc2nccnc12 2090035324 QETHYWNZQGICHJ-AWEZNQCLSA-N 251.289 2.384 10 10 CECE CN1CCc2cc([C@@H](O)C(=O)c3ccoc3)ccc21 2090964771 BECSTQSKBVHIAS-CQSZACIVSA-N 257.289 2.188 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2cnn3c2CCC3)CC1 2111483142 MZBBEPZHWUIBOI-GFCCVEGCSA-N 260.345 2.494 10 10 CECE CCOC1CCC(O)([C@@H](N)c2ccccc2O)CC1 2091868601 SYZLPNCXIXUFSZ-WPBUFGDCSA-N 265.353 2.102 10 10 CECE CC1(C)CCN(c2ccc(CN)cc2F)C[C@@H]1CO 2092264426 MZCAFDYAAJKRQS-GFCCVEGCSA-N 266.360 2.129 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)cc1Cl 2093096734 AYCLKIDGMNOBEZ-HYNSBDGHSA-N 280.799 2.424 10 10 CECE Nc1ccc(CCCN2CC[C@H](O)C3(CC3)C2)cc1 2093175599 DXSWHEMRYMZMQV-HNNXBMFYSA-N 260.381 2.048 10 10 CECE Oc1cccc(CN[C@@H]2CC[C@@H]3OCC[C@H]3C2)c1O 2094066494 BMHBRNNJTWXYBQ-SUHUHFCYSA-N 263.337 2.145 10 10 CECE CN1CCCc2cc([C@@H]3N[C@@H](C4CC4)CO3)ccc21 2094126410 GUECBJGXTOHYBG-GDBMZVCRSA-N 258.365 2.466 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1[C@H]2CC[C@@H]1C[C@@H](N)C2 2094909771 RRHXIMNTSIAAQC-FIQHERPVSA-N 262.353 2.113 10 10 CECE Nc1ncc(F)cc1OCc1cccc2nccn12 2095386064 LWZVKJUEYOBQOW-UHFFFAOYSA-N 258.256 2.030 10 10 CECE Nc1ccc(NC(=O)N2CCOC3(CCC3)C2)cc1 2095415125 KEBXFEDGIDSIGI-UHFFFAOYSA-N 261.325 2.056 10 10 CECE CN1CCCc2cc([C@@H](N)C[C@H]3CCOC3)ccc21 2098415431 WUTHLQSMYSXGGX-DOMZBBRYSA-N 260.381 2.495 10 10 CECE Nc1ccc(COCCCCN2CCCC2=O)cc1 2113477151 LJDORHAXEOTGQL-UHFFFAOYSA-N 262.353 2.188 10 10 CECE CCCN1CCCN(c2ccc(CN)c(OC)c2)CC1 2204546795 DVXLZLLIPIIKGL-UHFFFAOYSA-N 277.412 2.076 10 10 CECE Cc1ccc(CNCc2noc(C(F)(F)F)n2)c(O)c1 2204634386 AWOQEPMSPICEFQ-UHFFFAOYSA-N 287.241 2.392 10 10 CECE O=C(O)C[C@@H]1[C@H]2CC[C@@H](C2)N1Cc1ccc(F)cc1O 2204627416 QEWUQIJZNXWMKE-TVYUQYBPSA-N 279.311 2.359 10 10 CECE COc1ccc(N2CC(C)(C)[C@@H]2CO)c2c1CCC2 2269101908 HYCSWTRYIMIXMU-HNNXBMFYSA-N 261.365 2.391 10 10 CECE C[C@H](NC(=O)[C@@H]1CC[C@@]1(C)C(=O)O)c1ccccc1O 2207208296 IOOMSXVBKBBDOI-CCUNJIBTSA-N 277.320 2.070 10 10 CECE COC[C@H]1CC[C@@H]1N(C)c1cc(OC)c(OC)cc1N 2207395361 CEGRTGAGMGLQQQ-PWSUYJOCSA-N 280.368 2.147 10 10 CECE CC1CC(CS(=O)(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2218745208 LVOSDSSDHCMNGP-WFBLGPOFSA-N 272.374 2.183 10 10 CECE COc1ccc(N2CC[C@]23C[C@@H](CO)C3)cc1F 2219605594 PKMOTHBRJMZUJW-YPFXGUDJSA-N 251.301 2.186 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@H](SC)C1 2220417419 NGNDAPVFANRLBM-ZDUSSCGKSA-N 266.410 2.356 10 10 CECE CCNCc1ccc(N2CC[C@H](O)[C@H]2CC)cc1C 2273227470 LHLOLORJZVFBBV-CVEARBPZSA-N 262.397 2.454 10 10 CECE COc1ccc(N2CC[C@H](OC(F)F)C2)c(N)c1 2222932625 GWXZOAASMQMBOQ-VIFPVBQESA-N 258.268 2.095 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)[C@H]1C[C@@H](O)C1 2224213783 PIKZVBDEKSAOHT-GASCZTMLSA-N 260.381 2.207 10 10 CECE CN1CCCc2cc(N3C[C@@H]4[C@@H](CO)C[C@H]4C3)ccc21 2235036772 DCIDFSBNCCFSRD-LZWOXQAQSA-N 272.392 2.134 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OCCO3)CC[C@H]1CCO 2235107491 YZUCJYWOAJUEBC-OLZOCXBDSA-N 277.364 2.303 10 10 CECE CC(C)(O)[C@H]1CN(c2ccc(OC3CC3)cc2)CCO1 2235101330 LZCXTCQWVPLJLG-OAHLLOKOSA-N 277.364 2.204 10 10 CECE C[C@]12CC[C@]1(C)C(=O)N(c1ccc(N)c(F)c1)C2=O 2225880468 MWFUMUCDLAXHIK-ZIAGYGMSSA-N 262.284 2.088 10 10 CECE CCNCc1cc(OC)ccc1N1C[C@@H](CO)C[C@@H]1C 2235956091 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2.248 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)C2C[C@@H]3C1[C@@H]3C2 1916928616 VGVNBCNCUUPBIC-ZUEAIZGSSA-N 259.349 2.060 10 10 CECE CN1CCc2cc(CNCC3CCC(O)CC3)ccc21 227658625 CIQOZHDFFGTNPS-UHFFFAOYSA-N 274.408 2.320 10 10 CECE C[C@H]1CC[C@H](CCC(=O)NCc2c(O)cccc2O)O1 1647270205 NWACCUXIFKQWFK-WDEREUQCSA-N 279.336 2.062 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccc(Cl)cn1 1643104409 XHSJMKWVMIUUQW-UHFFFAOYSA-N 278.695 2.076 10 10 CECE CC(=O)N1CC(NCc2cc(Cl)cc(Cl)c2O)C1 1926289700 GPAYDFCXFAOSED-UHFFFAOYSA-N 289.162 2.019 10 10 CECE Oc1ccc(CN[C@]23CCC[C@@H]2CSC3)c(O)c1O 2137301605 BNUBKQCTDPXJLO-YGRLFVJLSA-N 281.377 2.179 10 10 CECE CON(CC(=O)N(C)c1ccc(N)cc1)Cc1ccccc1 1928701407 NTWBXVJHDFFDHL-UHFFFAOYSA-N 299.374 2.295 10 10 CECE CC(=O)C(=O)[C@H](O)c1c(C)sc(C)c1Br 1930028154 RATIYXHSJQWFAY-SNVBAGLBSA-N 291.166 2.319 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCCN2CCOCCO 162265579 ISQUCSWFGBXRJQ-CQSZACIVSA-N 292.423 2.119 10 10 CECE Cc1ccccc1/C=C1/SC(=S)N(CCN)C1=O 31934910 VTIAYKCCLZWLPL-DHZHZOJOSA-N 278.402 2.155 10 10 CECE CCN(c1ccc(CNC)c(OC)c1)[C@@H]1CCOC1 2139697225 RVERAYDWKPTNIY-CQSZACIVSA-N 264.369 2.030 10 10 CECE Cc1cccc(CNCc2cnc(C(=O)O)s2)c1O 2139757332 HCIJMKYNSACKIC-UHFFFAOYSA-N 278.333 2.145 10 10 CECE Cc1cccc(CNC(=O)c2ccncc2F)c1O 2139743714 NSZDJPBULYMRBN-UHFFFAOYSA-N 260.268 2.165 10 10 CECE COc1cc(N2Cc3nc(C)sc3C2)ccc1CO 2139700871 PDGYLBCSZYGQEW-UHFFFAOYSA-N 276.361 2.473 10 10 CECE CC[C@@H](NC)c1ccc(N2CCCN(C)CC2)cc1 233902841 XRJNYWCQNSTFMY-MRXNPFEDSA-N 261.413 2.499 10 10 CECE CCc1cccc(CN[C@@H]2CC3(CCC3)[C@H]2O)c1O 2140684672 ULSOUWOVAUCJAH-HIFRSBDPSA-N 261.365 2.348 10 10 CECE CC[C@H]1OCC[C@H]1CNCc1cc(OC)ccc1O 234236033 KIGLIIDOKQNVPJ-XHDPSFHLSA-N 265.353 2.306 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCCN1 234303685 VXCLBDJFJFEXDJ-HNNXBMFYSA-N 261.413 2.327 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCOC[C@H]1C 1876435230 LYDFCSRMGGKNEG-GFCCVEGCSA-N 261.321 2.318 10 10 CECE C[C@@H]1CCC[C@@]1(C)NC(=O)COc1ccc(N)cc1 1878805109 BANCYLIHVRHBQY-IAQYHMDHSA-N 262.353 2.343 10 10 CECE 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2.262 10 10 CECE C[C@@H](NC(=O)[C@@]1(N)CCCC12CC2)c1ccccc1O 2235390674 LYPAXHJQRPPBSQ-BZNIZROVSA-N 274.364 2.231 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@@H]3[C@H]2C[C@@]3(C)O)cc1 2225455373 ZLSZMJJJIZUECS-KLHDSHLOSA-N 261.365 2.480 10 10 CECE COc1ccc(N(C)[C@H]2CCOCC[C@@H]2C)c(CN)c1 2235968234 PCLQNPLJGJMKLW-WFASDCNBSA-N 278.396 2.405 10 10 CECE COc1ccc(N2CC[C@H]3CCOC[C@H]3C2)c(CN)c1 2235964751 VBVLCRDZWACWBD-GXTWGEPZSA-N 276.380 2.017 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@H](OC(C)C)C1 2235956762 CFOHMIAWNTXXKO-OAHLLOKOSA-N 278.396 2.418 10 10 CECE COc1ccc(N(C)C2C[C@@H]3CC[C@H](C2)O3)c(CN)c1 2235956390 BDUSEOMBJNNUGL-LQDVMPOASA-N 276.380 2.300 10 10 CECE CCN1CCc2cc([C@]3(O)C[C@@H](C)CN[C@H]3C)ccc21 2235908488 WCDJIYGDVWOKTE-IGCXYCKISA-N 274.408 2.275 10 10 CECE C[C@H]1Cc2cc(N3[C@H]4CC[C@H]3[C@@H](CO)C4)ccc2O1 2226698032 XDVNOPROYOODQV-QJZXMWHDSA-N 259.349 2.360 10 10 CECE CCN1CCc2cc(N(C)C[C@H](O)C3CC3)ccc21 2226657921 UNEOTCJFUZIKPX-INIZCTEOSA-N 260.381 2.276 10 10 CECE CC(C)[C@H](O)CN(C)c1ccc2c(c1)OCCCO2 2226798534 JNKDCQUPHUDVEL-CYBMUJFWSA-N 265.353 2.301 10 10 CECE O[C@H]1CCC[C@@]12CCN(c1ccc3c(c1)CCO3)C2 2226750739 YIPSBRYXXUCSRP-HOTGVXAUSA-N 259.349 2.363 10 10 CECE C[C@H]1C[C@H](O)CCN(c2ccc3c(c2)COCC3)C1 2226713278 MFAHFVFUUZJFFL-BLLLJJGKSA-N 261.365 2.357 10 10 CECE OC[C@@H]1[C@@H]2C[C@H]2CN1c1ccc(OCC(F)F)cc1 2226737652 YGQYCWFNVKXECG-ZWKOPEQDSA-N 269.291 2.148 10 10 CECE Nc1ccc(OCCS(=O)(=O)CCCC2CC2)cc1 2227190436 BMQVWBSFAIDIFZ-UHFFFAOYSA-N 283.393 2.253 10 10 CECE O[C@H]1CCC2(CC2)N(c2ccc3c(c2)CC[C@H]3O)C1 2227479146 YKVQDALEYCZJQU-DZGCQCFKSA-N 259.349 2.160 10 10 CECE COc1ccc(N(C)C2[C@H]3CCC[C@H]23)c(CCN)c1 2227685338 FDHVTFLTEIALKW-KBPBESRZSA-N 260.381 2.431 10 10 CECE COc1ccc(N2CCC[C@@H]2CCCO)c(C=O)c1 2227696927 PYEPDWNETIDCSY-CYBMUJFWSA-N 263.337 2.249 10 10 CECE Cc1nc(Cl)ncc1NC(=O)COc1ccc(N)cc1 2238125277 DNGGQUYWTWGLIN-UHFFFAOYSA-N 292.726 2.038 10 10 CECE CC(F)(F)CCCCn1ccc2c(c1=O)CNCC2 2228666839 ZWEBCRFCUDBVBW-UHFFFAOYSA-N 270.323 2.320 10 10 CECE Cc1cc(N2C[C@H]3CCCC[C@@]3(CO)C2)ccc1CO 2238824036 PNNAFDDSAKLZNE-WBVHZDCISA-N 275.392 2.476 10 10 CECE CN(C)c1ccc(OCCCC[C@](C)(N)CO)cc1 2229376438 DWTOGSMJCPLPOL-HNNXBMFYSA-N 266.385 2.011 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)c1cccnc1F 2239638888 SKVIWSSBZWZLPK-UHFFFAOYSA-N 296.323 2.344 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@@H](O)C[C@H](F)C2)cc1 2240035649 OHKDPERYZVOFGH-INWMFGNUSA-N 280.387 2.484 10 10 CECE CCCN1CCN(c2ccc([C@H](C)O)cc2C)CC1=O 2240833193 LKVKNBSCEYSMSA-ZDUSSCGKSA-N 276.380 2.107 10 10 CECE C[C@@H](NCCCC1(O)CC1)c1ccc(F)cc1O 2257913801 UYLBVGRJWHTFCV-SNVBAGLBSA-N 253.317 2.487 10 10 CECE NC(=O)[C@H]1CC[C@H](NCc2cc(Cl)ccc2O)CC1 2272270963 RBUMZSVOFSXUDP-OTCDBFHCSA-N 282.771 2.179 10 10 CECE CN(C)CCCCCNCc1cc(F)cc(F)c1O 2273146176 KEYYSHVJHLPYKM-UHFFFAOYSA-N 272.339 2.492 10 10 CECE C[C@@H]1CN(c2ccc(OCF)cc2)CC[C@H]1CO 2263929331 GXHYYJZDRMSQAM-NEPJUHHUSA-N 253.317 2.447 10 10 CECE C[C@@H](N)c1ccc(N(C)CC[C@@H]2CCO2)c(F)c1 2263986866 SXSONFASJAJSHV-ZYHUDNBSSA-N 252.333 2.461 10 10 CECE FC(F)Oc1ccc(N2CC([C@H]3CCNC3)C2)cc1 2278472958 IJNNTKFKFGNHHN-JTQLQIEISA-N 268.307 2.334 10 10 CECE CSc1ncc(CNC(=O)c2ccc(O)cc2O)s1 2269119672 VEBYCCIGZXVYQZ-UHFFFAOYSA-N 296.373 2.206 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)ccc1[C@H](C)N 2269660582 AHABXDCHAKOIPQ-DUPGQFARSA-N 260.381 2.364 10 10 CECE O=C(C[S@](=O)C[C@H]1CC12CCC2)c1ccc(O)c(O)c1 2279957541 RAMCJTWOPWRUIP-BIBXISHDSA-N 294.372 2.219 10 10 CECE C[C@@H](NC(=O)[C@@]1(N)C[C@H]2CC[C@H]1C2)c1ccccc1O 2283820562 HEZXBJIIVZSDTK-KZTGVZKYSA-N 274.364 2.087 10 10 CECE COc1cc(C)c(N2CC(C)(C)OC[C@@H]2CN)c(C)c1 2285039597 ZPBPHDPYYPEWDK-ZDUSSCGKSA-N 278.396 2.255 10 10 CECE Nc1ccc(OCCCS(=O)(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)cc1 2285652614 JPXLDSWVZIEEER-JYAVWHMHSA-N 295.404 2.251 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@@](=O)[C@H]1C[C@@H]2C[C@@H]2C1 2285659828 HKIRETDLKINXJB-WYDAEVBUSA-N 292.404 2.143 10 10 CECE Nc1ccc(NC(=O)C[S@@](=O)C2CC3(CCC3)C2)cc1 2288959850 WCUBGEPAQTZIEH-HXUWFJFHSA-N 292.404 2.289 10 10 CECE COC[C@H]1C[C@H](CN)N(c2c(C)cc(OC)cc2C)C1 2289515296 KRUARGJNWSWFEG-UONOGXRCSA-N 278.396 2.112 10 10 CECE CC(C)[C@H]1COCCN1Cc1cccc(F)c1O 1138128331 DCNWOZQDCPLVCL-CYBMUJFWSA-N 253.317 2.388 10 10 CECE CN(CCc1ccncc1)C(=O)C=Cc1ccc(O)c(O)c1 2307986918 MXZXKPDACLRABW-UHFFFAOYSA-N 298.342 2.207 10 10 CECE CN1CCC[C@@H]2CCN(CCCCN=[N+]=[N-])C[C@@H]21 2313991674 TUIOJCJYLOJHTL-OLZOCXBDSA-N 251.378 2.493 10 10 CECE NC1C[C@@H]2CCC[C@H](C1)C2NCc1ccccc1O 841047288 ZDFDSHMADYWSOC-FFMGESDNSA-N 260.381 2.388 10 10 CECE NN[C@@H](c1ccccc1O)[C@H]1C[C@@H](C(F)(F)F)C1 2327657098 ILTBMKUSSYORGQ-VHSKPIJISA-N 260.259 2.485 10 10 CECE C[C@H](N[C@H]1C[C@@H]2OCCC[C@H]12)c1ccc(O)cc1O 2328822615 ZZLXRLWSOZUFRZ-AETLKFDBSA-N 263.337 2.316 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@H]2CCC[C@@H]3C[C@H]23)c1 2329158085 ODQUARGMMQBJTF-ICCXJUOJSA-N 260.337 2.027 10 10 CECE CNCc1ccc(N2C[C@@]3(CO)CC[C@H]2C3)cc1Cl 2336502612 YUJCXABONRBLBA-DZGCQCFKSA-N 280.799 2.411 10 10 CECE CC12CC(C1)[C@@H](C(=O)N1CCC(N=[N+]=[N-])CC1)CO2 2337661926 XFODJUVCPVSLJX-QDYJBQRPSA-N 264.329 2.103 10 10 CECE C[C@]12C[C@H](C1)[C@@H](C[C@H](O)Cc1ccc(N)cc1)CO2 2337913544 RJYVMMMRPGZEBN-WMHQRMGPSA-N 261.365 2.377 10 10 CECE NCc1ccc(N2C[C@H](O)C23CCC3)cc1C1CC1 2339156821 ATVLDTMLMYUUKV-HNNXBMFYSA-N 258.365 2.126 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(SC)c2)C[C@@H]1CO 2353852606 WDBYGBZRWPKARJ-WCQYABFASA-N 280.437 2.322 10 10 CECE CSc1cc(N2CCCC[C@@H](CO)C2)ccc1CN 2353857965 DHVHVAGCWATSSL-GFCCVEGCSA-N 280.437 2.466 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CN([C@@H](C)c2cc(O)ccc2O)C1 2353985357 BFZFWAJHWQUSNJ-GARJFASQSA-N 279.336 2.201 10 10 CECE CN(C)c1ccc2c(c1)CCN2C[C@H]1[C@@H]2CCOC[C@@H]21 2355965906 UUWIFQCBXJRXRR-JYJNAYRXSA-N 272.392 2.398 10 10 CECE CN[C@H]1CCc2cc(N(C)C[C@@H]3[C@@H]4CCO[C@@H]43)ccc21 2356172455 XNSQXUUOFRYVSU-YVSFHVDLSA-N 272.392 2.364 10 10 CECE CCN[C@H]1CCc2cc(N3CC[C@@H](C)[C@@H](O)C3)ccc21 2356173251 XHKBPROPASNJKO-DQYPLSBCSA-N 274.408 2.491 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CCCSC1 136586986 FRFGETCCAOFXTJ-MRVPVSSYSA-N 252.339 2.275 10 10 CECE Nc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 63063534 SARCTPGWMZKFDJ-UHFFFAOYSA-N 257.249 2.429 10 10 CECE CC(C)(C(=O)O)[C@H](N)c1c(O)cccc1Br 309151254 IIUGTLUDRUVOMX-SECBINFHSA-N 288.141 2.265 10 10 CECE CN(CC1CCOCC1)c1ccc(CN)cc1F 111614249 RXQZSFNSMROQQH-UHFFFAOYSA-N 252.333 2.147 10 10 CECE COC(=O)[C@H](CCN(C)c1ccc(OC)cc1)NC(C)C 62528575 MYHZOJPJMHFXEY-HNNXBMFYSA-N 294.395 2.061 10 10 CECE NCc1ccc(N2CCC[C@H]2CCO)cc1Br 306077431 GXMTXDQXUBHDKQ-NSHDSACASA-N 299.212 2.259 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@](CN)(C3)C2)cc1OC 2357636594 ZFVKMDPNKMQNSE-WBMJQRKESA-N 276.380 2.269 10 10 CECE Cc1cc(C)c(O)c(CN2CCC(C(=O)N(C)C)CC2)c1 120070086 DPNYXPHAFIMPLQ-UHFFFAOYSA-N 290.407 2.309 10 10 CECE COc1cc(C)cc(CN2CCOC3(CCC3)C2)c1O 129865135 HVPPWZQMFWVXHC-UHFFFAOYSA-N 277.364 2.464 10 10 CECE Nc1ccc(OCCn2ncc3ccccc3c2=O)cc1 36671549 PEOWVJMRAIDXLD-UHFFFAOYSA-N 281.315 2.058 10 10 CECE C[C@H](NCCC(=O)N1CCCCC1)c1cc(O)ccc1O 123747773 CVXQZQHXSFEJFL-LBPRGKRZSA-N 292.379 2.151 10 10 CECE COc1ccc([C@H](C)NC[C@@H](C)N(C)C)c(O)c1 38088242 NHIKLYBFBYQTKQ-MNOVXSKESA-N 252.358 2.002 10 10 CECE CCN(Cc1cc(Cl)ccc1O)[C@@H]1CCNC1 71312005 ADHFZWJYARZEHN-GFCCVEGCSA-N 254.761 2.229 10 10 CECE C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccncc1 180596804 FTZZAKBQTQGHHD-JOAKQRRISA-N 284.315 2.383 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N3CCc4sccc4C3)cc21 131337459 UWEUJQSHJUDMLI-OAHLLOKOSA-N 299.399 2.287 10 10 CECE CC(C)C[C@H](C)OC[C@@H](O)CNCc1ccccc1O 228415295 KRMXQHSZQNUCIC-ZFWWWQNUSA-N 281.396 2.294 10 10 CECE Cc1ccc(O)c(CN2C[C@@H]3CNC[C@@H]3C2(C)C)c1 90335119 VRTIBKNNFDAJLT-KBPBESRZSA-N 260.381 2.130 10 10 CECE CN(CC1CC(O)C1)c1ccc(CN)cc1Cl 91451640 XCLRDXDZYJTKLC-UHFFFAOYSA-N 254.761 2.006 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)CC(C)(C)CN 235503234 YVNILHVVHRKQNU-JTQLQIEISA-N 252.358 2.076 10 10 CECE CC[C@H](N)c1ccc(I)cc1O 95770481 RPOZLDQOXMPDFA-QMMMGPOBSA-N 277.105 2.407 10 10 CECE CCn1nncc1CNCc1c(O)cc(C)cc1Cl 527729367 OPTYMVGXGDFMJW-UHFFFAOYSA-N 280.759 2.255 10 10 CECE COc1cc(Cl)c(N(C)CCO)cc1Cl 259097489 UJOPNEFIMVEJTP-UHFFFAOYSA-N 250.125 2.431 10 10 CECE CCOc1ccc(N2CC[C@@H](C[C@H](C)C(N)=O)C2)cc1 250625550 DIPUQYBLQCGNDA-STQMWFEESA-N 276.380 2.423 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1C[C@H]2CC[C@H]1O2 250796511 YDTOCJLMXUXRIZ-XTWCZFFVSA-N 253.729 2.455 10 10 CECE COC(=O)/C=C/c1ccc(N(C)C2CC2)c([N+](=O)[O-])c1 298351834 UERMNWPSHBJOCB-XBXARRHUSA-N 276.292 2.380 10 10 CECE CO[C@@H](C)CCOc1ccc(N2CCNCC2)c(F)c1 2165534973 IFCLWILYNUMTQI-LBPRGKRZSA-N 282.359 2.039 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H]2CC[C@H]1[C@@H]2C(=O)O 2163762185 OZVWJLZMLRKOKR-HNCHUZPSSA-N 279.311 2.387 10 10 CECE CN(Cc1ccc(O)cc1O)[C@@H](CC(C)(C)C)C(=O)O 395842911 LBTWYZIZBUWBBL-LBPRGKRZSA-N 281.352 2.419 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)OCCCO3)C[C@@H]1CN 2162625460 WYJGGZPNUUEOQQ-OLZOCXBDSA-N 276.380 2.269 10 10 CECE CC1(C)COc2ccc(N3CC=CCC34CNC4)cc21 2162656252 AMQUSBDXMLWPRY-UHFFFAOYSA-N 270.376 2.465 10 10 CECE CCOc1ccc(N2C[C@H](N)C3(CCOCC3)C2)cc1 2162662139 LXROQLAOYBVJNR-HNNXBMFYSA-N 276.380 2.029 10 10 CECE CCN1CCc2cc([C@@H](O)[C@]3(CC)CCNC3)ccc21 2163067414 WSALOODYNIXAQD-IAGOWNOFSA-N 274.408 2.492 10 10 CECE CCN1CCc2cc([C@@H](O)c3cccc(N)n3)ccc21 2163073010 FETLDRROZMXEGQ-MRXNPFEDSA-N 269.348 2.128 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H](N)CC(F)(F)F)ccc21 2163098680 DMBVEXABFULEOL-WCQYABFASA-N 288.313 2.382 10 10 CECE C[C@@H]1OCCO[C@H]1[C@H](N)c1ccc(N2CCCC2)cc1 2163107959 RBQPQVVPTQUZNV-APHBMKBZSA-N 276.380 2.091 10 10 CECE N=C1COC[C@@H](c2cc(Cl)cc(Cl)c2O)N1 396747917 LWDWLNSGNZMNEV-QMMMGPOBSA-N 261.108 2.337 10 10 CECE Cc1coc(C)c1[C@@H](NN)c1ccc2c(c1)CCN2C 2163143012 JIQMTMHPOSDHGG-INIZCTEOSA-N 271.364 2.441 10 10 CECE COc1cccc([C@@H](C2CC2)N2CCOCC2)c1O 575299280 NFWCPICURDMYLZ-CQSZACIVSA-N 263.337 2.184 10 10 CECE O=C(N[C@@H]1COc2ccc(F)cc2C1)c1cc(O)cs1 811567523 ZSGHKMJAKVWYFL-JTQLQIEISA-N 293.319 2.326 10 10 CECE CN(C)c1ccc(CNC(=O)C2(CF)CCOCC2)cc1 822227122 VYKYWFSXGWYBIP-UHFFFAOYSA-N 294.370 2.135 10 10 CECE COC[C@H](CNC/C=C\c1ccc(N(C)C)cc1)OC 835046986 BGJQTKKBNPKEOP-KJPDOMRESA-N 278.396 2.017 10 10 CECE COc1cccc(CNC(=O)[C@@H](OC)C2CCCC2)c1O 830540152 FWJQKKSTJWBMGN-HNNXBMFYSA-N 293.363 2.222 10 10 CECE C[C@H](NC(=O)[C@H](C)c1cnccn1)c1ccccc1O 913763522 JEUUMVPRJGILAK-MNOVXSKESA-N 271.320 2.163 10 10 CECE Cc1cccc(O)c1CNC[C@]1(O)C[C@@H]2CCC[C@H]21 1891043373 VBPUXFYLFRLDDE-JGGQBBKZSA-N 261.365 2.341 10 10 CECE CN(C)c1ccc(/C=C/CN2CCO[C@H](CF)C2)cc1 840955452 VCWDLTBVKCQLCJ-QDLOVBKTSA-N 278.371 2.436 10 10 CECE CO[C@@H]1COCC[C@@H]1CNCc1c(O)cc(C)cc1Cl 840950798 ODCIXEABQKFUHF-IAQYHMDHSA-N 299.798 2.495 10 10 CECE Oc1cccc(CNc2ccc3c(c2)OCO3)c1O 41116466 VAMIXLPTGSFXOI-UHFFFAOYSA-N 259.261 2.439 10 10 CECE COc1cccc([C@@H](C)N[C@@H]2CCc3nc[nH]c3C2)c1O 846168447 CTWQEYUAUZGJIG-GHMZBOCLSA-N 287.363 2.332 10 10 CECE CN1CCc2cc(CNC3(CCO)CCCC3)ccc21 687187266 UVBHZINNRBPMMJ-UHFFFAOYSA-N 274.408 2.464 10 10 CECE C[C@@H]1CNC[C@H]1CN[C@H](C)c1ccc(F)cc1O 925784728 KHHWJTWDDDZBJS-MXWKQRLJSA-N 252.333 2.037 10 10 CECE Nc1ccc(NC(=O)CCCn2cc(F)cn2)cc1 1893232150 GJBSKQDQNYOJDF-UHFFFAOYSA-N 262.288 2.023 10 10 CECE C[C@]1(CCNC(=O)c2c(F)ccc(O)c2O)CC1(F)F 857322202 OHJPLISBAWUNRJ-LBPRGKRZSA-N 289.253 2.402 10 10 CECE C[C@H](N[C@@H]1CCCN(C)C1)c1cc([N+](=O)[O-])ccc1O 756447437 WRCDYHGLHNHMPZ-WDEREUQCSA-N 279.340 2.045 10 10 CECE CCn1nc(C)cc1C(=O)NCc1ccc(N(C)C)cc1 751060358 BEWUKENKJIWFLY-UHFFFAOYSA-N 286.379 2.207 10 10 CECE COc1ccc(N2CC[C@@H](N[C@@H]3CCCOCC3)C2)cc1 850487730 JDAKHUOHCKMDBI-HUUCEWRRSA-N 290.407 2.433 10 10 CECE O=C(COC(=O)[C@]12CCCC[C@@H]1C2)c1ccc(O)c(O)c1 869708853 RKWVLEVOYOLOCB-BZNIZROVSA-N 290.315 2.404 10 10 CECE CC[C@@H](COC)NC(=O)N[C@@H](C)c1ccccc1O 868293070 OVJNUUXWJXYDNH-QWRGUYRKSA-N 266.341 2.177 10 10 CECE CNc1cnc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cn1 860949632 BNYFFPFADHXCRQ-LLVKDONJSA-N 299.378 2.075 10 10 CECE CC[C@@H]1CCN(C(=N)NCc2cccc(OC)c2O)C1 864456532 IIELIIMMHJFDBL-LLVKDONJSA-N 277.368 2.157 10 10 CECE CCO[C@@H](C(=O)N1Cc2cccc(O)c2C1)C1CC1 871207724 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2.310 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@H](C(C)(C)O)C2)cc1Cl 2174148048 KOICXDSWDQYZIZ-IINYFYTJSA-N 299.798 2.369 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](O)C2(C)C)cc1O 381930118 WQJGVLRVTWLBRK-HZMBPMFUSA-N 264.369 2.022 10 10 CECE COc1cccc(CNCCSc2nccn2C)c1O 2165083859 XTVKQZYDNCQQFF-UHFFFAOYSA-N 293.392 2.016 10 10 CECE Cc1c[nH]nc1C(=O)N(Cc1ccc(N)cc1)C(C)C 383644447 MLCRTTJDQLPTJE-UHFFFAOYSA-N 272.352 2.351 10 10 CECE c1cc2c(cc1N1CCN3CCC[C@@H]3C1)CCCO2 383889051 YFJRULIIZAIZND-OAHLLOKOSA-N 258.365 2.296 10 10 CECE Cc1cc(CNCc2cccc(Br)c2O)n[nH]1 716450333 HBGCSQQVMPSSKU-UHFFFAOYSA-N 296.168 2.476 10 10 CECE CC(C)CNCc1ccc(N2CCSC[C@H]2CO)cc1 388000565 ZVHZWHCOKKOOQD-MRXNPFEDSA-N 294.464 2.346 10 10 CECE COc1ccc(N2C[C@@H](CN)CC23CCC3)c(OC)c1 2174532954 PIELMPKXDBQSBJ-GFCCVEGCSA-N 276.380 2.412 10 10 CECE CCCN(Cc1ccc(N)cc1)C[C@]1(C)CCNC1=O 698249935 GSFODJUDLHSLDY-INIZCTEOSA-N 275.396 2.007 10 10 CECE CO[C@H](CN[C@@H](C)c1c(O)cccc1O)C1CC1 394088938 ZWYNTIXBWMYFEM-TVQRCGJNSA-N 251.326 2.173 10 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2.420 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H]2CC[C@H]21 1912154136 AFOUWDDFXBSGMA-LOWVWBTDSA-N 266.345 2.398 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2ccc(Br)cn2)C1 1912179039 QSKNTQOZRDCBQS-QMMMGPOBSA-N 296.128 2.369 10 10 CECE COC(=O)c1cccc(CN2CC[C@@H](CN=[N+]=[N-])C2)n1 1912179813 XRAKYHFCBZHAJG-JTQLQIEISA-N 275.312 2.000 10 10 CECE CCOC(=O)C[C@@H]1CCN(c2ccc(OC)cc2)C1 107937663 ITOQMLJVZIRPNX-LBPRGKRZSA-N 263.337 2.475 10 10 CECE CCNCc1ccc(N2CCN(C)CC2)c(OC(C)C)c1 212125470 YDBYZUFEQXFFGD-UHFFFAOYSA-N 291.439 2.335 10 10 CECE CCC=C1CCN(c2ccc3c(c2)N(C)C(=O)[C@H]3N)C1 1915339743 OJCIBLWSWVZENH-HNNXBMFYSA-N 271.364 2.209 10 10 CECE OCc1ccc(N2CC[C@]23CCOC3)c(Cl)c1 1915335201 CUAOHTPQIJAAGM-CYBMUJFWSA-N 253.729 2.202 10 10 CECE CCCN[C@@H]1C(=O)Nc2cc(N3CC(F)C3)c(Cl)cc21 1916992440 SFXKYMLHYSORIM-ZDUSSCGKSA-N 297.761 2.491 10 10 CECE N[C@@]1(c2ccc(Br)cc2O)CC1(F)F 1536098213 WKZVYTIADSYVBJ-MRVPVSSYSA-N 264.069 2.348 10 10 CECE COc1ccc(N2CCC[C@](C)(O)C2)cc1OC 1542992239 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CC[C@H](C)[C@@H](NC)C(=O)NCc1ccc(N(C)C)cc1 1968439380 YZQZTYKQNAJKFM-SWLSCSKDSA-N 277.412 2.003 10 10 CECE CCNCc1ccc(N2CC[C@@H]([C@H](C)O)C2)c(F)c1 252784610 XUDWLZWVNXYPPM-WCQYABFASA-N 266.360 2.142 10 10 CECE C[C@H](NC[C@@H](O)CC(F)(F)F)c1cc(F)ccc1O 1970811993 XDHQMDBMJKYELE-CBAPKCEASA-N 281.249 2.495 10 10 CECE CCN[C@H](C1CC1)[C@H](O)c1ccc2c(c1)CCCN2C 2147860507 ZJUWBHDBXRAZBY-IAGOWNOFSA-N 274.408 2.491 10 10 CECE COc1cccc(CN[C@H]2CC(C)(C)[C@H]2OC)c1O 1974254469 ZHOXNSYABKQNOF-FZMZJTMJSA-N 265.353 2.304 10 10 CECE CCC[C@@H]1COC[C@]1(O)[C@H](NCC)c1ccccc1O 2148162973 LGMSPHCFBYFOHO-DAXOMENPSA-N 279.380 2.220 10 10 CECE NC1(c2cc3c(c(F)c2O)OCCO3)CCCC1 258757360 VVICGAXGYCNDPS-UHFFFAOYSA-N 253.273 2.031 10 10 CECE C[C@H]1C[C@H]1N(CCO)c1ccc(CN)cc1Cl 2002031861 LLJJZUAWFUUGKR-TVQRCGJNSA-N 254.761 2.006 10 10 CECE Nc1ccc(CCC(=O)N2C[C@H]3CCC[C@@H]3C2)cc1 159521941 PAURYROBGVWPBH-ZIAGYGMSSA-N 258.365 2.460 10 10 CECE CN(Cc1ccc(N)cc1)S(=O)(=O)c1ccc(F)cc1 35360306 SKFUQBAOEMAYQV-UHFFFAOYSA-N 294.351 2.229 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@@]3(CO)C2)c(F)c1 2146322259 YTNHVQXRKULELB-BBRMVZONSA-N 278.371 2.144 10 10 CECE CCNCc1ccc(N2C[C@]34CC[C@]3(COC4)C2)cc1 2146562470 PCDGZLZFEKDNGD-CALCHBBNSA-N 272.392 2.413 10 10 CECE CC(C)(C)OCCN1CCN(c2ccc(N)cc2)C1=O 163071181 MTBORJOVTCLHOW-UHFFFAOYSA-N 277.368 2.326 10 10 CECE CNCc1ccc(N2C[C@@H](CO)OC(C)(C)C2)c(Cl)c1 163286821 XXDGTBDLTAQSSO-LBPRGKRZSA-N 298.814 2.036 10 10 CECE COCCNCc1ccc(N2CCOC[C@H]2C)c(Cl)c1 163948303 MFJRWVRCZWDBKU-GFCCVEGCSA-N 298.814 2.301 10 10 CECE COc1ccc(O)c(CN2CCCNC[C@H]2C(C)C)c1 2159170059 VWUSDCURGUDFEO-HNNXBMFYSA-N 278.396 2.221 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1COCC[C@H]1C 2152556337 AYLSCKDJESYPFP-ZWNOBZJWSA-N 278.352 2.282 10 10 CECE O=C(O)C[C@H]1CC2(CC2)CN1Cc1cc(F)ccc1O 2152656303 DQBXXPXCUWNZAU-LBPRGKRZSA-N 279.311 2.361 10 10 CECE NCc1ccc(N2C[C@@]34CCC[C@]3(COC4)C2)cc1F 2153075986 AIQKHHZAUOTZOF-HZPDHXFCSA-N 276.355 2.291 10 10 CECE CCN(C)[C@@H]1CCN(CCCOc2ccc(N)cc2)C1 2154051724 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C[C@H]1CCN(CCN2CCC[C@H](N=[N+]=[N-])CC2)C1 2038005601 VGSXGMAQLFOQSH-STQMWFEESA-N 251.378 2.493 10 10 CECE CC[C@H](NCc1c(O)cccc1Cl)C(=O)N(C)C 2038814650 HDXHKSRIOAZMOP-NSHDSACASA-N 270.760 2.002 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](CO)C3)c(Cl)c1 2039483740 WVLGVLNIWHQGAN-MDZLAQPJSA-N 266.772 2.148 10 10 CECE CCOc1cccc(CNCC(C)(C)C(=O)OC)c1O 312742156 JJRWOQVZIIKMAY-UHFFFAOYSA-N 281.352 2.080 10 10 CECE CCOc1cccc(CNC[C@H]2C[C@H]3CC[C@H]2O3)c1O 312938806 ZIRBDIRUOBRDEK-MGPQQGTHSA-N 277.364 2.448 10 10 CECE CC[C@](C)(OC)[C@H](CN)N(C)c1ccc(OC)cc1 320162021 XKALYXZFBCMTSJ-GJZGRUSLSA-N 266.385 2.274 10 10 CECE CC(C)CN1CC[C@H](N(C)c2ccc(CN)c(F)c2)C1 2160077591 ZGPDREWRLKUKCZ-HNNXBMFYSA-N 279.403 2.451 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@@H]1CCCC1(F)F 2160509040 KRPYZJZEPFFVHI-CYBMUJFWSA-N 285.290 2.400 10 10 CECE Nc1ccc(OCCCN2CC3(CCC3)CC2=O)cc1 2170406241 PTBTYMKTCFVQQD-UHFFFAOYSA-N 274.364 2.440 10 10 CECE CC1(C)C[C@@H]([S@@](=O)Cc2ccc(N)cc2)CO1 703105580 XZQCARQXOVOGHH-PXAZEXFGSA-N 253.367 2.085 10 10 CECE CCCC1([C@@H](NCCN=[N+]=[N-])C(=O)OCC)CC1 687554016 IWDATMWZLXOTOC-JTQLQIEISA-N 254.334 2.398 10 10 CECE Nc1ccc(OCCN2C(=O)[C@H]3CCCCC[C@H]32)cc1 2170532333 DIPHPFORXUOYMR-LSDHHAIUSA-N 274.364 2.439 10 10 CECE CN1C[C@@H]2CC[C@H](C1)N2c1ccc(CN)c(Cl)c1 687237458 WTOAPEUOZMMYKC-BETUJISGSA-N 265.788 2.082 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2CN(C)C3)c(F)c1 687243462 YPWQXYPSBVTSPS-KBPBESRZSA-N 277.387 2.218 10 10 CECE CC[C@@H](O)c1ccc(N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O)cc1 2170658230 VBZBVELMSFLPEW-YWPYICTPSA-N 299.436 2.388 10 10 CECE COCCNCc1ccc(OC[C@@H](C)N(C)C)c(C)c1 2175839077 BYVPHURTJTYGMS-CQSZACIVSA-N 280.412 2.060 10 10 CECE Cc1nccnc1COC(=O)CCc1ccc(N)cc1 687302479 WWYLDPUZGFHGSY-UHFFFAOYSA-N 271.320 2.043 10 10 CECE CCNCc1cc(F)c(N2CC[C@H]3C[C@]3(O)C2)c(F)c1 2171003543 AXYGKQMANKXBOA-NHYWBVRUSA-N 282.334 2.035 10 10 CECE CC[C@H](NC)c1ccc(N(C)[C@H]2CCCNC2=O)cc1 2171078827 FIADHSCJVXTJIX-GJZGRUSLSA-N 275.396 2.072 10 10 CECE 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CCOc1ncccc1C(=O)NCCc1ccc(N)cc1 124416041 PPQZEKIFNOLLTK-UHFFFAOYSA-N 285.347 2.035 10 10 CECE Cc1ccc([C@H](C)N[C@@](C)(C(N)=O)C(C)C)c(O)c1 311974654 KNAXFMQEPIMMBK-XHDPSFHLSA-N 264.369 2.251 10 10 CECE CCN(CC(=O)OC(C)C)Cc1ccc(N)cc1 43446639 AUAIIQKWGPUHFB-UHFFFAOYSA-N 250.342 2.042 10 10 CECE CC[C@@H](C)N(CCOC)Cc1cc(N)ccc1O 42562154 NUMFTRZXJKBJOA-LLVKDONJSA-N 252.358 2.221 10 10 CECE CSCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 49180133 QFCRCHHGOXPLGU-GFCCVEGCSA-N 294.420 2.063 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(F)c(F)c(O)c1F 42012834 DCJAHGSIWAQLAC-UHFFFAOYSA-N 274.202 2.240 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Cl)CCN1C 133894854 YAKOYMWTAGGEML-SNVBAGLBSA-N 254.761 2.182 10 10 CECE C[C@H](c1cc(O)ccc1O)N(C)[C@@H]1CCC[C@@H]1CN 89109479 CUUJHKVLJVEYPL-JTNHKYCSSA-N 264.369 2.218 10 10 CECE C[C@H](N[C@@H]1CCCN(C)C1)c1cc(F)ccc1O 94617817 RZZJTRJCWJMWMK-CMPLNLGQSA-N 252.333 2.276 10 10 CECE Cc1ccc([C@H](C)NC[C@H](O)[C@@H]2CCCO2)c(O)c1C 527959836 ZIILHJPCHHQMQN-QEJZJMRPSA-N 279.380 2.200 10 10 CECE CCOC1CC(O)(CNCc2cc(Cl)cc(C)c2O)C1 278753150 SFPADQAKCGVOEB-UHFFFAOYSA-N 299.798 2.374 10 10 CECE COc1ccc(CN[C@H](CO)C[C@H](O)C(C)(C)C)cc1C 283800110 AKDUUOJIWYCJEK-HOCLYGCPSA-N 295.423 2.251 10 10 CECE CC[C@H]1CN(Cc2cccc(C)c2O)C[C@]2(CCOC2)O1 370210474 QEFFUGOZUBLGDK-RDJZCZTQSA-N 291.391 2.471 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H]1CCc2c(Cl)cccc21 808533410 KXHDGRUAOIRJNB-LLVKDONJSA-N 280.707 2.071 10 10 CECE CSc1ncc(CNCCC[C@H]2CCN2)s1 2243855323 KCKGIYLTBXIDCS-VIFPVBQESA-N 257.428 2.097 10 10 CECE CN(Cc1ccc(N)cc1)c1cccc2c1nnn2C 2162656682 ANJASWNFWSWIDY-UHFFFAOYSA-N 267.336 2.187 10 10 CECE CC(=O)C(=O)COC(=O)CCc1ccc(C(C)C)cc1 808505592 HJOWGUOFAPHSRK-UHFFFAOYSA-N 276.332 2.444 10 10 CECE CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@H](O)C(F)F 294927520 BKGVJIQGWKBTEF-WLTAIBSBSA-N 289.322 2.456 10 10 CECE CCN1CCc2cc([C@@]3(O)C[C@@H]4CC[C@H](C3)N4)ccc21 2163077774 XJYBKSLMJAOCRR-QLPKVWCKSA-N 272.392 2.171 10 10 CECE CO[C@]1([C@H](O)c2ccc(N3CCCC3)cc2)CCOC1 2163093012 YCBQJRFUEVSBSD-HZPDHXFCSA-N 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GGENNTUFVRKWRD-JTQLQIEISA-N 286.169 2.030 10 10 CECE COc1ccc(CN2CCCC[C@H](CN=[N+]=[N-])C2)nn1 1912178756 OXPCHGMMQWJMKI-LLVKDONJSA-N 276.344 2.398 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C[C@@H](C(=O)O)c2ccccc2)C1 1912192123 BAENOCZSHGAKMD-VXGBXAGGSA-N 260.297 2.239 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cnn(C3CC3)c2)C1 1912156915 OMHYOPAOFLHEFG-SNVBAGLBSA-N 260.301 2.133 10 10 CECE [N-]=[N+]=NC1CN(CCC(=O)Nc2cccc(F)c2)C1 1912179147 QITGDLXASDSNOP-UHFFFAOYSA-N 263.276 2.149 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@H]2CC[C@H]3C[C@H]2CO3)CC1 1912201780 ZDSJEEDQHQLCDH-ZMLRMANQSA-N 264.329 2.103 10 10 CECE C[C@H]1CCCCN1C(=O)CN1CCC(N=[N+]=[N-])CC1 1912203918 SSNZJVXEFNAKBZ-NSHDSACASA-N 265.361 2.162 10 10 CECE CCc1noc(CN2CCC[C@@H](CN=[N+]=[N-])C2)n1 1912211250 UPNLQFOZCUOHAJ-VIFPVBQESA-N 250.306 2.154 10 10 CECE Cc1cc(C(=O)N2CC(N=[N+]=[N-])C2)c(F)cc1F 1912208797 WGSYUUGKIGQBRK-UHFFFAOYSA-N 252.224 2.408 10 10 CECE COc1ccc([C@H](C)N2CCC[C@@H](N(C)C)C2)c(O)c1 217899007 CXQQEUJPVSJTPZ-QWHCGFSZSA-N 278.396 2.488 10 10 CECE CCOc1cccc([C@H](CCN)N2CCCC2)c1O 107556584 IYDJZCUSJVAQSV-ZDUSSCGKSA-N 264.369 2.277 10 10 CECE CN[C@@H](CCCF)[C@H](O)c1ccc(N(C)C)cc1 1913289993 XGAQJXVCOOBNLR-UONOGXRCSA-N 254.349 2.124 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@@]23CCOC3)cc1O 1915826858 VZQRUKQMZPGGMY-LRDDRELGSA-N 276.380 2.432 10 10 CECE COc1ccc(N(CCCN)[C@@H]2CCCOC2)cc1 224832675 QWEWRDUJEVLHAU-CQSZACIVSA-N 264.369 2.029 10 10 CECE CCOc1cccc(CNCC2CCC(O)CC2)c1O 227639659 VBMQNCZBQPFSJJ-UHFFFAOYSA-N 279.380 2.432 10 10 CECE O=C(Nc1cnn2ccccc12)c1cc(O)cs1 1634275285 SUOMTLYRRBSKKD-UHFFFAOYSA-N 259.290 2.354 10 10 CECE Cc1cc(O)ccc1CC(=O)N1Cc2cccc(O)c2C1 1632709286 RBXXZVRIVFRTDQ-UHFFFAOYSA-N 283.327 2.491 10 10 CECE CCN(CC)CC[C@H](C)NC(=O)c1c(F)ccc(O)c1O 1649152979 AIKDQPCERYLVQE-JTQLQIEISA-N 298.358 2.087 10 10 CECE Cc1cc(C(=O)NCc2cccc(Cl)c2O)ncn1 1640404943 IPWSOLOTKDCCSM-UHFFFAOYSA-N 277.711 2.074 10 10 CECE O=C(NCc1c(O)cccc1F)c1ccc2n[nH]cc2c1 1645048138 HXRUEWRHYAVZJU-UHFFFAOYSA-N 285.278 2.338 10 10 CECE COc1ccc(N(C)C[C@H](N)C[C@@H]2CCCO2)cc1 1926604231 PWKFIDWFLPBYBO-DOMZBBRYSA-N 264.369 2.028 10 10 CECE CCN1CC[C@@H]1C(=O)NCc1c(O)ccc2ccccc12 1597743150 XDKOWHNUIXGACO-OAHLLOKOSA-N 284.359 2.256 10 10 CECE Cc1ccccc1OCC(=O)NCc1cccc(O)c1O 1593734691 RVOKCPWVBCPNDV-UHFFFAOYSA-N 287.315 2.101 10 10 CECE CN1CCCc2cc(CN[C@@H]3CCC[C@@H]3CO)ccc21 231291576 UUWPNXGGLWHHLQ-HZPDHXFCSA-N 274.408 2.320 10 10 CECE CN[C@H](C)c1ccc(N2CCCCC[C@@H]2CO)cc1O 133688644 SVHYYPSVIDEFQL-TZMCWYRMSA-N 278.396 2.414 10 10 CECE CC1=CC2=NC(=O)/C(=C\c3ccc(F)cc3)C(=N)N2O1 5013483 FDLYQWCBGYVXRI-KNSKNOLWSA-N 271.251 2.276 10 10 CECE Cc1cc2c(cc1N(C)[C@@H]1CCC[C@H]1N)OCCO2 258842813 DUHQVGYNLCYETQ-VXGBXAGGSA-N 262.353 2.082 10 10 CECE Nc1ccc(Oc2cccc(N3CCNCC3)c2)cc1 259095734 FCTRFCOUOKVBJK-UHFFFAOYSA-N 269.348 2.471 10 10 CECE CCc1ncc(S(=O)(=O)Nc2cc(C)c(O)cc2C)[nH]1 234198028 KUMFHJYDDNYWPA-UHFFFAOYSA-N 295.364 2.095 10 10 CECE Nc1ccc(CCN2[C@H](CO)CCC23CCC3)cc1 2140862538 VAKAYGBFHISNFZ-HNNXBMFYSA-N 260.381 2.191 10 10 CECE CN(C)c1ccc(CNCC(=O)OC2CCCC2)cc1 1857871256 JBWHUZBNEBUQRM-UHFFFAOYSA-N 276.380 2.328 10 10 CECE C[C@@H](NCCCn1cccn1)c1c(O)cccc1O 235187786 HTMJQDYPGFFMBN-LLVKDONJSA-N 261.325 2.035 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H]2[C@H](N)CCC[C@H]2C1 235185788 ZPHANVKNMLAZOV-YVECIDJPSA-N 276.380 2.218 10 10 CECE C[C@@H](O)[C@@H](C)SCCCC(=O)Nc1ccc(N)cc1 235277339 FKFSTKFKUVZYSQ-GHMZBOCLSA-N 282.409 2.490 10 10 CECE COc1cccc(CNC[C@H]2C[C@H](O)C23CCC3)c1O 1875433975 YABTWKFRHLJSCT-OCCSQVGLSA-N 277.364 2.042 10 10 CECE CN(C)c1ccc(CNCC2CC3(CCN3C)C2)cc1 1875868017 GJVMZMHYNWCLND-UHFFFAOYSA-N 273.424 2.327 10 10 CECE CCC(CC)(CN)N(C)C(=O)Nc1ccc(N)cc1 1876148626 HGCJXEBTGUPENL-UHFFFAOYSA-N 264.373 2.250 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H](C2)O3)c2ccccc12 1899692875 KYNOEEJSXXHFPQ-BETUJISGSA-N 254.333 2.276 10 10 CECE C[C@@H](N)c1ccnc(N(C)Cc2ccccc2O)c1 1877523562 MQHNDMKXLXXKTG-LLVKDONJSA-N 257.337 2.443 10 10 CECE C[C@H](NC(=O)[C@@H](N)CC1CCC1)c1ccccc1O 1877588619 JLHQKXDJUJFVHN-GWCFXTLKSA-N 262.353 2.087 10 10 CECE Cc1ccnnc1CN[C@@H](C)c1cc(O)ccc1O 1877765405 AZIVGCSKZWMLAN-JTQLQIEISA-N 259.309 2.047 10 10 CECE C[C@H](NC[C@@]12CCOC[C@H]1C2)c1c(O)cccc1O 1880194590 FWKGQGPZNIMHRU-RWSFTLGLSA-N 263.337 2.175 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)[C@@H](C)CCO)c(F)c1 1880971563 ZBENBPHIYXLCLG-UWVGGRQHSA-N 272.339 2.452 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](C)[C@H](O)C2)c(F)c1 1880925102 APGMSCWSCCNXLT-MWODSPESSA-N 270.323 2.192 10 10 CECE CS[C@H](C)[C@H](N)[C@H](O)c1ccc(N2CCCC2)cc1 2142096868 JVHZPBJJCPNSAA-BYCMXARLSA-N 280.437 2.399 10 10 CECE C[C@@H](CCCNC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-] 1885562191 BWKPREFRGWVUEK-JTQLQIEISA-N 299.375 2.354 10 10 CECE C[C@H](NC[C@@H]1CNCC12CCC2)c1ccccc1O 1886930457 XFFWYXQEZTULOJ-STQMWFEESA-N 260.381 2.433 10 10 CECE COc1nsc(OC)c1CN(C)c1ccc(CN)cc1 2146836061 HLRKHILRNJEAML-UHFFFAOYSA-N 293.392 2.255 10 10 CECE CNC1(C)CCN([C@@H](C)c2cc(O)ccc2O)CC1 129684160 JLTXRCUKPLDPNS-NSHDSACASA-N 264.369 2.233 10 10 CECE CNCc1cnc(Sc2nc(C)cc(C)n2)s1 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CN(Cc1ccccc1O)c1nn(C)nc1C(F)(F)F 2235278512 WAMNTGATSGMKAB-UHFFFAOYSA-N 286.257 2.176 10 10 CECE O=C(NCc1c(F)cccc1F)c1ccc(O)c(O)c1 2235778458 XYAQKJCSWCLNIF-UHFFFAOYSA-N 279.242 2.306 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@H](C)[C@@H](OC)C1 2235968737 VKTIXDZZDAMDHD-WBMJQRKESA-N 278.396 2.276 10 10 CECE CC[C@@H](O)CN(C)c1ccc(OC)cc1CNC1CC1 2235953580 CQTXJCNWPQFPID-CQSZACIVSA-N 278.396 2.154 10 10 CECE CCN(CC)[C@@H]1CCN(c2ccc(OC)cc2CO)C1 2235998756 AYYQSKOSGGLZHR-CQSZACIVSA-N 278.396 2.108 10 10 CECE COc1ccc(N2CC[C@@]2(C)CO)c(CNC(C)C)c1 2235976746 JHGMWDGCRVXHNP-INIZCTEOSA-N 278.396 2.154 10 10 CECE COc1ccc(N2CCCO[C@H]3CCC[C@@H]32)c(CO)c1 2236004560 YKOOSVGNOBKYHM-HOTGVXAUSA-N 277.364 2.335 10 10 CECE COc1ccc(N(C)CC[C@@H]2OCC[C@@H]2C)c(CO)c1 2236001470 GOLZZVJHSAKLQH-LRDDRELGSA-N 279.380 2.439 10 10 CECE C[C@@H]1Cc2cc(N3C[C@@H]4CC[C@H](C3)C4O)ccc2O1 2226704455 VBZQGVUPKUKJDO-HUOYYHSISA-N 259.349 2.217 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)COCC3)CC[C@@H]1CO 2226716537 UOUPRVFHMLKAHI-TZMCWYRMSA-N 261.365 2.214 10 10 CECE C[C@@H]1C[C@@H](O)CN(c2ccc3c(c2)OCCCO3)C1 2226800064 RIQROIBPLJYCIZ-DGCLKSJQSA-N 263.337 2.055 10 10 CECE COc1ccc(N2CC(COC(C)C)C2)c(CN)c1 2227680880 CNKLHHZHJHFXHC-UHFFFAOYSA-N 264.369 2.015 10 10 CECE COc1ccc(N(C)CCCCN(C)C)c(C=O)c1 2227694622 IZGJUUJRFCBYSX-UHFFFAOYSA-N 264.369 2.286 10 10 CECE CCNCc1cc(OC)ccc1N(CC)C[C@H](C)O 2227675780 MAZGFWQCGZKAEJ-LBPRGKRZSA-N 266.385 2.012 10 10 CECE O=c1c2c(ccn1CC[C@]13CCC[C@@H]1C3)CCNC2 2228430349 NXRLSJTZIVATRM-CJNGLKHVSA-N 258.365 2.074 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)CC(C)(C)S(C)(=O)=O 2240842061 OMRTWYJOVBNNLT-LBPRGKRZSA-N 299.436 2.308 10 10 CECE CCc1nnc(Sc2ncc(C(=N)NO)s2)s1 2253287134 PHCVRAYEMRXEAZ-UHFFFAOYSA-N 287.395 2.012 10 10 CECE CSc1ncc(CNCC(C)=C(C)CO)s1 2243856713 PYWOKNANAKNIHA-UHFFFAOYSA-N 258.412 2.283 10 10 CECE CN[C@@H](C)c1ccc(N(C)C(C)(C)CO)cc1C 2257457685 LIJRRRUPPTYDRR-LBPRGKRZSA-N 250.386 2.483 10 10 CECE CNc1cncc(NCc2cnc(SC)s2)n1 2248601002 MLMSUEGKJDUGJE-UHFFFAOYSA-N 267.383 2.309 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)C3(C)O)cc1 2270687330 DCCBLXJNVGYNKS-XFDYKOMQSA-N 261.365 2.337 10 10 CECE CCO[C@]1(CN2CCC[C@@H](N=[N+]=[N-])CC2)CCOC1 2271591613 SCTKOHKTTQXRBZ-OLZOCXBDSA-N 268.361 2.347 10 10 CECE C[C@@]1(CO)C=CCCN1c1ccc2c(c1)CC[C@@H]2O 2264378262 BVVBUSXSWYVHSO-HOTGVXAUSA-N 259.349 2.184 10 10 CECE O[C@]12CCN(c3ccc(OCC(F)F)cc3)C[C@@H]1C2 2265186307 UUXJJKIXZRHFQM-HZMBPMFUSA-N 269.291 2.292 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1ccc(OC)c(C)c1OC 2277973945 DRTKQPOOPRDROM-YPMHNXCESA-N 265.353 2.362 10 10 CECE COc1ccc(CNC[C@@H](C)Cc2cn[nH]c2)c(O)c1 2290420236 CNNHMCPNLHDBGH-NSHDSACASA-N 275.352 2.092 10 10 CECE CCn1nc(C)c([C@@H](O)[C@@H](N)c2ccccc2O)c1Cl 2281403128 XMHGBGCSNRCDQE-QWHCGFSZSA-N 295.770 2.304 10 10 CECE O=C(C=Cc1ccccc1)NCc1ccc(O)c(O)c1 2301404170 ROTXSPHVBSMVQP-UHFFFAOYSA-N 269.300 2.427 10 10 CECE CCN(CCN=[N+]=[N-])Cc1cnc(OC)c(F)c1 2325197812 WMJFWOQDYFPZIF-UHFFFAOYSA-N 253.281 2.362 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c(F)c1 2330782453 VYYNFTHULYVRGR-ANGCBRKESA-N 264.344 2.066 10 10 CECE C[C@H]1C[C@]2(CCN(c3ccc(CN)cc3F)C2)CO1 2335498821 SJLYPGZWZRDEAW-NHYWBVRUSA-N 264.344 2.290 10 10 CECE C[C@H]1C[C@@]2(CCN(c3ccc(CN)cc3F)C2)CO1 2335498822 SJLYPGZWZRDEAW-XHDPSFHLSA-N 264.344 2.290 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc(OC)cc1OC 2336868676 NPUBJORQOZNNIS-HUUCEWRRSA-N 265.353 2.444 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccc(OC)cc1N 2337776045 IKBZFWZLNQWITF-UHFFFAOYSA-N 263.301 2.050 10 10 CECE C[C@@H]1CN(c2ccc(CO)c(C3CC3)c2)CCN1C 2339144171 UONMWKQEZMACPN-GFCCVEGCSA-N 260.381 2.197 10 10 CECE Nc1ccc(CC(=O)c2cn(C(F)(F)F)cn2)cc1 2340028205 XHHZNXUZFMEOEL-UHFFFAOYSA-N 269.226 2.367 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CCSC[C@H]2CO)c1C 2340862160 SBYFSATXTWYDRV-CHWSQXEVSA-N 280.437 2.237 10 10 CECE CN[C@H](CN(C)c1ccc(OC)cc1)[C@H]1CC1(F)F 2352326154 ZYCLKUGGEWTJLN-CHWSQXEVSA-N 270.323 2.375 10 10 CECE CC(=O)N(C)C1CN(c2ccc([C@@H](C)N)cc2Cl)C1 2353531545 OXYIBNHDZDVWIE-SECBINFHSA-N 281.787 2.027 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@]12C[C@@H](OC)[C@@H]1C2 2354276058 LINQHSYGYLUPCQ-LZWOXQAQSA-N 274.364 2.042 10 10 CECE N[C@@H]1C[C@H]([C@@H](O)c2ccc(N3CCCC3)cc2)[C@H]2C[C@H]21 2354906882 OCLMYBTWDWRDMS-NNXHMXCWSA-N 272.392 2.304 10 10 CECE CCCN(CC(=O)OCC)c1ccc(OC)cc1[N+](=O)[O-] 50071776 RUPAGWDIQOVWTR-UHFFFAOYSA-N 296.323 2.383 10 10 CECE CN(C)CCCN(C)c1ccc(CN)cc1Cl 111129279 JUKMRFJMDIOBNQ-UHFFFAOYSA-N 255.793 2.187 10 10 CECE CC[C@@H](N)Cc1ccc(N2C[C@@H]3COCC[C@@H]32)cc1C 2357226986 VUHLBFRORMATCX-INMHGKMJSA-N 274.408 2.500 10 10 CECE CCCN(c1ccc(CN)cc1)[C@H](C)C(=O)N1CCCC1 34654737 UBHMPEUHSSZQHC-CQSZACIVSA-N 289.423 2.373 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(F)c2)CCCO1 302332800 JCGOIMZHEJJFBC-CYBMUJFWSA-N 252.333 2.290 10 10 CECE O=C(O)[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 128808076 HCLLLZHJWHKDCO-SECBINFHSA-N 269.728 2.342 10 10 CECE COc1cc(Cl)cc([C@@H]2NC(=O)[C@H]3CCCCN32)c1O 183630020 IVJAZNZFIVBRQC-ZWNOBZJWSA-N 296.754 2.037 10 10 CECE CCOC1CCN(c2ccc(OC)cc2N)CC1 213389325 HTSGQPYASLZBCP-UHFFFAOYSA-N 250.342 2.283 10 10 CECE [N-]=[N+]=NCCCNC(=O)[C@@H]1CC[C@@H]1C(F)(F)F 2212879549 QZWNWLJEVODXMQ-RQJHMYQMSA-N 250.224 2.392 10 10 CECE C[C@@H]1CCC[C@H](NCc2ccc(O)c(O)c2O)C1 226750590 SKSGFZIVCPXPIZ-KOLCDFICSA-N 251.326 2.472 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@]1(C)CN 381164393 SVQGYPNZDWIBAQ-IINYFYTJSA-N 268.788 2.462 10 10 CECE CCC[C@@H](N[C@@H](C)c1ccc(O)cc1O)C(=O)O 86733508 QIGCXAFDXLMFOW-GZMMTYOYSA-N 253.298 2.002 10 10 CECE CCNCc1ccc(OC)c(CN2CC[C@@H](COC)C2)c1 81050631 OSAFPDIKNWUADH-OAHLLOKOSA-N 292.423 2.273 10 10 CECE CNCc1ccc(N2CCS[C@@H](C)C2)c(F)c1 137247889 OKGHSHXSFBTHIR-JTQLQIEISA-N 254.374 2.487 10 10 CECE CCOc1cccc(CN(CCOC)[C@@H](C)COC)c1O 133456158 WOLNNEAUBUSYLH-ZDUSSCGKSA-N 297.395 2.274 10 10 CECE CCCC1CCC(NCCCN=[N+]=[N-])(C(N)=O)CC1 90260566 YDDRZKRWUZWGPU-UHFFFAOYSA-N 267.377 2.491 10 10 CECE NCCCCc1c(O)c(O)cc(F)c1Br 258408210 AHRXONNMGFOHLN-UHFFFAOYSA-N 278.121 2.281 10 10 CECE CC(C)(N)Cc1c(Br)cc(F)c(O)c1O 258699264 SNODMCMCSWWQGB-UHFFFAOYSA-N 278.121 2.279 10 10 CECE CC(=O)C(=O)COC(=O)/C(C)=C/c1cccc(Cl)c1 808530929 HKKWDTFSQFIXRQ-RMKNXTFCSA-N 280.707 2.445 10 10 CECE Oc1cccc(Cl)c1CN1CCC[C@H]2CNC[C@H]21 299919256 LLYUGHXDLAZRSC-GXFFZTMASA-N 266.772 2.229 10 10 CECE CCCOC1(CNC(=O)CCc2ccc(N)cc2)CC1 2166602066 UNCVAYMIQGDZEW-UHFFFAOYSA-N 276.380 2.277 10 10 CECE CC[C@H](N)c1ccc(N(C)Cc2ncnn2CC)cc1 2168066034 RXNBCJMGHKTOAA-AWEZNQCLSA-N 273.384 2.344 10 10 CECE COCC(=C\C(=O)OC)/N=N/C(=O)OC(C)(C)C 393655910 LORIQFPZXDCDAS-JQAHBYNNSA-N 258.274 2.077 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@@H]2CN1c1ccc2c(c1)C[C@@H](C)O2 2162633330 XISWYXIZYAWTBF-UIBBOPPKSA-N 272.392 2.444 10 10 CECE CO[C@H]1CCN(c2ccc(OC(C)C)cc2)[C@H](CN)C1 2162650088 NQHNZOCAEWXPKE-HOCLYGCPSA-N 278.396 2.416 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC(C(N)=O)C2)cc1Cl 723172035 XGFJAJWIBDSYGX-JTQLQIEISA-N 295.814 2.322 10 10 CECE CN1CCc2cc([C@@H](O)C(F)(F)[C@H](N)C3CC3)ccc21 2163069607 RCELTSLCDLHSPF-ZIAGYGMSSA-N 282.334 2.085 10 10 CECE CCN1CCc2cc([C@H](N)c3cn(CC)cn3)ccc21 2163075979 JVLUBRGEUCNORP-INIZCTEOSA-N 270.380 2.334 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CC=C[C@H](N)C3)ccc21 2163101132 YDIKPBVSUUXWAD-UKPHBRMFSA-N 272.392 2.396 10 10 CECE CCN(CC)c1ccc([C@@H](N)c2cnnn2CC)cc1 2163130769 KRIRRAWTLAEKJL-OAHLLOKOSA-N 273.384 2.192 10 10 CECE COC1([C@H](NN)c2ccc3c(c2)CCN3C)CCCC1 2163135697 MHOOTWYANKMQCD-OAHLLOKOSA-N 275.396 2.143 10 10 CECE COc1ccc(N2CC[C@H]2CCC(=O)O)c([N+](=O)[O-])c1 2165713399 JBLFSCBTBQIUAV-SECBINFHSA-N 280.280 2.047 10 10 CECE COC1(C(F)(F)F)CN(c2ccc([C@@H](C)O)c(O)c2)C1 724165340 MSYMEDPFBDNFML-MRVPVSSYSA-N 291.269 2.213 10 10 CECE COc1cc(O)c(CN[C@H]2[C@H]3CCC[C@H]32)cc1OC 827488443 HFRNPDVCPROBIK-QHBPRCKVSA-N 263.337 2.298 10 10 CECE Cc1cc(O)c(CNC[C@@H]2CNC[C@H]2C)c(Cl)c1 903967413 JGODWNVXGYFUQP-MNOVXSKESA-N 268.788 2.299 10 10 CECE Cc1cc(O)c(CN2CCn3nc(C)nc3C2)c(Cl)c1 840915274 NTBOWLCGHHCDRS-UHFFFAOYSA-N 292.770 2.270 10 10 CECE CCN(CC)c1ccc(CNC(=O)N[C@H](C)[C@H](C)N)cc1 841716955 HKAHXGUVKAOTAE-QWHCGFSZSA-N 292.427 2.068 10 10 CECE CC[C@H](CC(F)F)C(=O)NCc1ccc(O)cc1O 910945736 XDSUUYCPUULQCE-MRVPVSSYSA-N 273.279 2.395 10 10 CECE CC1(CC(F)F)CN(C(=O)c2c(F)ccc(O)c2O)C1 844148388 QPPPARFOUODJQX-UHFFFAOYSA-N 289.253 2.354 10 10 CECE CCO[C@H]1C[C@H](NC(=O)NCc2cc(C)ccc2O)C1 858608666 LSHIDDFSYUENRF-JOCQHMNTSA-N 278.352 2.067 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H]3C[C@@H](C)O[C@@H]3C)C2)cc1 850347861 ZGTQNBKVUUQQHZ-VWPFQQQWSA-N 290.407 2.429 10 10 CECE C/C=C/CNC(=O)NCc1ccc(N(C)C)c(F)c1 858890750 PXGVDDWVQHKYCP-SNAWJCMRSA-N 265.332 2.267 10 10 CECE CC[C@@H](COCC1CC1)NC(=O)c1cc(O)cs1 855284579 VMDCIWUZIRQYLY-JTQLQIEISA-N 269.366 2.389 10 10 CECE CCCOC(=O)CN1C[C@H](CC)Oc2cc(CN)ccc21 74337736 QQFVRIGKTCONEU-ZDUSSCGKSA-N 292.379 2.076 10 10 CECE Nc1ccc(N2CCC([C@@H]3CCCNC3)CC2)cc1 1876242890 CIDHACCEIJVGCO-CQSZACIVSA-N 259.397 2.485 10 10 CECE CC(C)=C(C)[C@H](N)[C@@H](O)c1ccc2c(c1)CCN2C 1877433150 PCGUGVBGALYVCH-HOTGVXAUSA-N 260.381 2.396 10 10 CECE 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C[C@H](O)c1ccc(N(C)[C@H](C)c2cncn2C)cc1O 2155702545 ZLYMMVHCJZMFHW-MNOVXSKESA-N 275.352 2.376 10 10 CECE C[C@H](CN1CCCC1)N[C@H](C)c1cc(O)ccc1O 49149517 OQJDUYHEBYORRD-VXGBXAGGSA-N 264.369 2.233 10 10 CECE C[C@H](Cc1ccsc1)NC(=O)COc1ccc(N)cc1 49149277 OJLJEUXYACJQSZ-LLVKDONJSA-N 290.388 2.457 10 10 CECE CN1CCCc2cc(CN3CCC(CN)CC3)ccc21 50287750 OINVWIDYKUPURQ-UHFFFAOYSA-N 273.424 2.240 10 10 CECE CC1(C)CCC2(CC1)CC(NCCN=[N+]=[N-])(C(N)=O)C2 2156533531 NVUAKJZFVKBJRT-UHFFFAOYSA-N 279.388 2.491 10 10 CECE COC[C@@]1(C)CCN(Cc2cccc(F)c2O)C1 294119314 DNJDSONDVFTSHO-AWEZNQCLSA-N 253.317 2.390 10 10 CECE Nc1ccc(CCC(=O)NCC2CC(F)C2)cc1 2031641837 MULRILWONHWIET-UHFFFAOYSA-N 250.317 2.066 10 10 CECE CO[C@H]1CN(c2ccc(CO)cc2Cl)CC12CC2 2032384121 IFNDETBKZFGKSR-ZDUSSCGKSA-N 267.756 2.448 10 10 CECE CCCc1noc(CN(C)CCc2ccc(N)cc2)n1 2160396725 DBEMVBUKIAWNJH-UHFFFAOYSA-N 274.368 2.279 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1COC[C@H]1CC1CC1 2158040795 ZVBDTPVRHHVBHR-MFKMUULPSA-N 276.336 2.194 10 10 CECE 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COC(=O)[C@]12C[C@H]1CCCN2Cc1ccc(N(C)C)cc1 933163765 IEGDQTRHTXWMJP-PBHICJAKSA-N 288.391 2.280 10 10 CECE C[C@@H](NC(=O)N[C@@H]1CCOC1(C)C)c1ccccc1O 868664862 KOSIROPCXRDYGO-ZWNOBZJWSA-N 278.352 2.320 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1Cc1ccc(N)cc1 1952942032 ILBHKPHARVGMJM-KGLIPLIRSA-N 292.379 2.494 10 10 CECE C[C@H]1CC[C@H](NCc2cccc(Br)c2O)CN1 863484808 NAFICXXQGSXQIV-ONGXEEELSA-N 299.212 2.385 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C)c1cncnc1 863875673 DBHCOCRQGXPEIS-ZDUSSCGKSA-N 298.390 2.271 10 10 CECE CCN(C)c1ccc(CN(C)CC2(CO)CC2)cc1 773887901 JHDZYYXPNIZFJL-UHFFFAOYSA-N 262.397 2.347 10 10 CECE CN(C)c1ccc(/C=C/c2ccn(CCO)c(=O)c2)cc1 57870693 RFWXSGTZZUALSU-ONEGZZNKSA-N 284.359 2.077 10 10 CECE Nc1ccc(Cn2c(C=O)nc3cccc(C(=O)O)c32)cc1 76081514 NGBNTXSEOKDIOJ-UHFFFAOYSA-N 295.298 2.178 10 10 CECE Cc1ccc(O)c([C@H](N)c2nnc(CC(C)C)o2)c1 83447414 FWCPKLHCDWOLPT-ZDUSSCGKSA-N 261.325 2.330 10 10 CECE Cc1ccnc(NCc2cc([N+](=O)[O-])ccc2O)n1 83433670 VMPSHJWRCJPPPS-UHFFFAOYSA-N 260.253 2.011 10 10 CECE COc1cc2c(cc1OC)N(C)[C@H](C)C[C@H]2C(=O)O 84165597 HNFLWYUZOPIBRA-PSASIEDQSA-N 265.309 2.100 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1CC=CCC1 90259546 FEDPXBHCYIPXPB-MNOVXSKESA-N 252.318 2.174 10 10 CECE C[C@@H](N[C@@H]1CCCC12OCCO2)c1ccccc1O 715614741 PYYCFXPVAZAMBD-BXUZGUMPSA-N 263.337 2.338 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@@H](CN)C2(CCC2)C1 703237109 WFPFLBAMLXDGOZ-NWDGAFQWSA-N 276.380 2.220 10 10 CECE C[C@@H](c1cnn(C)c1)N(C)C(=O)Nc1ccc(N)cc1 710137413 JFIGUCQEZFMZOS-JTQLQIEISA-N 273.340 2.227 10 10 CECE Nc1ccc(CC(=O)OCCCOC(F)(F)F)cc1 713438063 RUCFSJRFIZRSIG-UHFFFAOYSA-N 277.242 2.281 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H]3COC[C@H]32)c(F)c1 690320492 CAIVGLYRAOOPLL-IFUGULHKSA-N 264.344 2.461 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1Cl 78901524 FUNWOZUGXJTDOI-QWRGUYRKSA-N 295.814 2.322 10 10 CECE CN(C[C@@H]1CCC[C@@H]1O)c1ccc(CO)cc1Cl 689253731 SJUTZXAVAXBXHC-FZMZJTMJSA-N 269.772 2.430 10 10 CECE Cc1nc(Cl)nc(NCc2ccccc2O)n1 694815631 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10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC(n2cccn2)C1 2232100573 OAYPDHVZOVJRQL-LBPRGKRZSA-N 257.337 2.306 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@]3(F)C2)cc1O 2222657629 OBPUEIFSGGTSII-RBZYPMLTSA-N 251.301 2.384 10 10 CECE CCN(C(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21)c1ccc(N)cc1 2233172079 FXYZQUKKLSZBBI-TUKIKUTGSA-N 274.364 2.437 10 10 CECE CCOc1ncc([C@@H](O)Cc2ccc(N)cc2)s1 2223411943 KQQZVTWYCKOBGQ-NSHDSACASA-N 264.350 2.400 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)Cc1sccc1C(=O)O 2234168257 ZXUQZNINZXOYFB-RKDXNWHRSA-N 294.336 2.336 10 10 CECE C[C@@H](O)c1ccc(N2[C@H]3CCC[C@H]2CN(C)C3)cc1O 2234727852 OPLLQBMXVHDFDK-XBFCOCLRSA-N 276.380 2.118 10 10 CECE COC[C@@](C)(CO)N(C)c1ccc(OC2CCC2)cc1 2234882628 IWKCXGIDLSUTTE-MRXNPFEDSA-N 279.380 2.452 10 10 CECE COc1ccnc(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])c1 2225798588 JORKQRMBNUXBGF-ZJUUUORDSA-N 261.285 2.051 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H](CO)C3)c(C=O)c1 2235985761 KFSXMMYEFVSKAY-UBSAEIQESA-N 275.348 2.247 10 10 CECE 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CCC[C@@H](CC)N(C)C(=O)c1cc(O)c(O)c(O)c1 1879157554 JQOVAFGNTNDRGW-SNVBAGLBSA-N 267.325 2.454 10 10 CECE Cc1ccnc(N)c1CNCc1ccc(N(C)C)c(F)c1 894209165 OTPUOZYCUZPKMG-UHFFFAOYSA-N 288.370 2.467 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)[C@H](C)C[S@](C)=O)c(F)c1 1880481199 CKSCCEMOTAGNFT-LQJGKPAFSA-N 291.363 2.221 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](CO)[C@@H]2C)c(F)c1 1880491250 VAGIIXYUKNJDTG-LPEHRKFASA-N 271.307 2.225 10 10 CECE C[C@H](N[C@H]([C@H](C)O)C(F)(F)F)c1c(O)cccc1O 1882723189 XYOUESFQDVFGKL-OKTBNZSVSA-N 279.258 2.060 10 10 CECE Cc1ccc(C(=O)NCc2nc3ccccc3o2)c(O)c1O 1141591490 FHAFOJBIBQEYSQ-UHFFFAOYSA-N 298.298 2.477 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)CCC[C@@H](C)N 133534662 SUUPDBJUOGFVIX-NEPJUHHUSA-N 264.369 2.429 10 10 CECE COc1ccc(CNC(=O)c2cccc(O)c2)c(O)c1 794378169 DIJVQPSJKOTOSC-UHFFFAOYSA-N 273.288 2.036 10 10 CECE COC(=O)[C@](N)(CSc1nccs1)c1ccccc1 45596262 ZYWHUASULYUZFJ-ZDUSSCGKSA-N 294.401 2.262 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 1156885973 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273.424 2.088 10 10 CECE COc1ccc(N)c(C(=O)N2CCC(N=[N+]=[N-])CC2)c1 2286946677 RXODRGKNAWYGSW-UHFFFAOYSA-N 275.312 2.192 10 10 CECE COCCN(C[C@@H](C)O)c1ccc(OCC(F)F)cc1 2288069938 UAOBTVPGGDXICT-LLVKDONJSA-N 289.322 2.164 10 10 CECE c1cc2c(cc1CNC[C@@H]1C[C@@H]3CC[C@H]1O3)CCO2 2296757409 LWPPDNYLMUSWJN-OFQRWUPVSA-N 259.349 2.279 10 10 CECE CN(C)c1ccc(CN[C@]2(C(=O)O)CCCSC2)cc1 2296917605 VKLBPLZWBSJBSG-OAHLLOKOSA-N 294.420 2.193 10 10 CECE O=C(/C=C/c1cnccn1)N1CCc2c(F)ccc(F)c21 492940495 KBCCJPUELHZSNB-DAFODLJHSA-N 287.269 2.357 10 10 CECE Oc1ccc(F)cc1CN[C@H]1CC[C@@H]2C[C@H]1CO2 2312748463 PSOJGUZKYUBEEM-UHTWSYAYSA-N 251.301 2.188 10 10 CECE CSc1cc(N2C[C@@H]3CC[C@H](C2)O3)ccc1CN 2328548691 JOTGNNNBGBKGEX-BETUJISGSA-N 264.394 2.235 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2C[C@H](N)[C@@H](C2)C1 2333671654 GBOVXUGFIBCPGG-ZHPDPMBESA-N 264.344 2.261 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1C(=O)Nc1ccc(N)cc1 2336764789 QHAAPSABNFSYPB-GXTWGEPZSA-N 263.341 2.036 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc2c(c1)CC[C@@H]2O 2336808292 GNQNHHXBHDLLRA-ARFHVFGLSA-N 261.365 2.406 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H]2COC[C@H](C2)C1 2337776820 IJBLYYWIXNXZCO-ZSBIGDGJSA-N 266.345 2.208 10 10 CECE C[C@@H]1C[C@H](O)CN(c2ccc(CN)c(C3CC3)c2)C1 2339160525 MPBLOKUFHALPHS-ABAIWWIYSA-N 260.381 2.230 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@H]1CSC2(CNC2)C1 2339809619 UGXAFBNDLRTYIY-NEPJUHHUSA-N 278.421 2.233 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCC23CN(C)C3)c1C 2340849594 XOONJFFLWBAZMO-CYBMUJFWSA-N 260.381 2.251 10 10 CECE COc1ccc(N2CC[C@H](O)[C@@H](C)[C@@H]2C)c(OC)c1 2344528861 HKMFDRXTFGRPTD-MJVIPROJSA-N 265.353 2.299 10 10 CECE CSc1cc(N2CCC3(CC2)COC3)ccc1CN 2353856868 JNTFUUWZCALUIE-UHFFFAOYSA-N 278.421 2.484 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@H]1[C@H]2C(=O)O 2354636400 AFICZZYSRLDIBE-COPCRZHJSA-N 279.311 2.387 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c2ccccc12 2355618589 CLOJWBOFSSZLCE-YMRXKLBXSA-N 268.360 2.258 10 10 CECE COc1ccc(N2CCN(C[C@H](O)C(C)(C)C)CC2)cc1 59322679 HZGVHSYPZMUOMS-INIZCTEOSA-N 292.423 2.224 10 10 CECE CC(C)N(C)c1cc2c(cc1Br)[C@H](N)C(=O)N2 118589785 RZCFESFNGJRRTJ-NSHDSACASA-N 298.184 2.246 10 10 CECE Cc1cc(Cl)cc(CN(CC(N)=O)C(C)C)c1O 179579790 GEZIEJDUTNSBRU-UHFFFAOYSA-N 270.760 2.050 10 10 CECE N[C@H]1CN(Cc2ccccc2)C[C@@H]1c1ccc(O)c(O)c1 307190254 WZTIYGUDRZTSIH-CABCVRRESA-N 284.359 2.025 10 10 CECE Cc1nnc(CN(C)Cc2ccccc2O)n1C1CC1 111235001 NUAHTZSBTSURRS-UHFFFAOYSA-N 272.352 2.259 10 10 CECE C[C@H](NC1CCC(O)CC1)c1ccc(F)cc1O 62744856 UXQAPUIUUMQTJH-GCVQQVDUSA-N 253.317 2.485 10 10 CECE C[C@H]1CC[C@@H](C(=O)O)N([C@H](C)c2cc(O)ccc2O)C1 2357920810 INRBSPSFHOUQJA-CWSCBRNRSA-N 279.336 2.344 10 10 CECE Nc1ccc(OCCC(=O)NCc2cccc(F)c2)cc1 40302188 RHNRDTKMRKRUHH-UHFFFAOYSA-N 288.322 2.493 10 10 CECE [N-]=[N+]=NCC1(c2ccc([N+](=O)[O-])cc2)OCCO1 137849795 NYUTWEMKLVMYJV-UHFFFAOYSA-N 250.214 2.105 10 10 CECE COC(=O)[C@@H](CNCc1ccccc1O)c1ccccc1 228415468 LGFXNMHLEKKGJH-HNNXBMFYSA-N 285.343 2.439 10 10 CECE Cc1ccc(NC(=O)CN2C(=O)CSC2=S)cc1C 82322813 OMRUZIOBNPOXLA-UHFFFAOYSA-N 294.401 2.102 10 10 CECE COc1ccc([C@H](C)N2CCC(NC(C)=O)CC2)c(O)c1 228355230 NNQJCZJWIBMVDC-NSHDSACASA-N 292.379 2.062 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@@]1(C)C(=O)O 235199926 GHQALCDKFXERIU-OTYXRUKQSA-N 265.309 2.098 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)C(=O)Nc1ccccn1 96785331 XYPQORMVTYWCMA-SNVBAGLBSA-N 272.304 2.310 10 10 CECE CCCN(C[C@@H]1CN(CC)CCO1)c1ccc(CN)cc1 92051495 IDCKNWPENPMFRX-KRWDZBQOSA-N 291.439 2.082 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)CCCCO 92173081 PRSLSFQKPJWDJU-NSHDSACASA-N 251.326 2.074 10 10 CECE Oc1c([C@H]2COCCN2)ccc(Cl)c1Br 95719164 DYZBTJCOYOXCPJ-MRVPVSSYSA-N 292.560 2.469 10 10 CECE N[C@H](c1cc(I)ccc1O)C1CC1 95769524 HHZZZOSFPSKRAG-JTQLQIEISA-N 289.116 2.407 10 10 CECE C[C@H]1CNC[C@H](C)CN(c2ccc3c(c2)OCCO3)C1 49664245 POPTWJVAJMZPPF-STQMWFEESA-N 276.380 2.140 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H]1CCC(=O)N(C)C1 250987132 UDLZYIREXUPPQQ-AGIUHOORSA-N 288.391 2.459 10 10 CECE CCC[C@H]1CN(Cc2ccc(N(C)C)cc2)CCN1 93496962 IXDNTPPAFQSAQM-HNNXBMFYSA-N 261.413 2.327 10 10 CECE CCCN(Cc1ccc(N)cc1)c1ncc(OC)cn1 2165616594 BBCMDFFDDFHKBR-UHFFFAOYSA-N 272.352 2.484 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H](C(=O)O)C3CC3)ccc21 2166998664 AWVDZKPDZBBOMG-HUUCEWRRSA-N 274.364 2.180 10 10 CECE C[C@H]1Cc2cc(N(C)Cc3ccc(=N)[nH]c3)ccc2O1 2165639084 AMCYMAFOVIIEAB-NSHDSACASA-N 269.348 2.454 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@H]2CO)c(Cl)c1 299955838 HNDHIURLUQKNCE-IINYFYTJSA-N 268.788 2.267 10 10 CECE CCN[C@H](C(=O)OCC)c1ccc2c(c1)CCCN2C 2164107626 MXNHGVQBAKACQG-HNNXBMFYSA-N 276.380 2.283 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H]2CCN(C)C2=O)c(Cl)c1 723197556 FRXUMFSHDWWJAG-HZMBPMFUSA-N 295.814 2.287 10 10 CECE CCN1CCc2cc([C@@H](NC)c3cccnn3)ccc21 2163072760 ZNBWGVGNYZSODN-MRXNPFEDSA-N 268.364 2.168 10 10 CECE CCN1CCc2cc(N3CC[C@@H]4NCC[C@@H]4C3)ccc21 2163074082 OXSCYTRXIGGAAJ-ZBFHGGJFSA-N 271.408 2.257 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@](C)(O)C1(C)CC1 2163125091 AFOCFEJCILMZCN-WBVHZDCISA-N 274.408 2.491 10 10 CECE COc1nc(OC)c([C@@H](N)c2ccc(N(C)C)cc2)s1 2163130708 KAJKOHAZBKUELU-NSHDSACASA-N 293.392 2.274 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@]1(O)CS[C@@H](C)C1 2163137224 AVQZKYDLQYXJOI-IUIKQTSFSA-N 292.448 2.196 10 10 CECE CCN1CCc2cc([C@H](NN)[C@H]3C[C@H]3C(F)F)ccc21 2163161533 XMOKLBPDMHTYOF-SCRDCRAPSA-N 281.350 2.475 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N1C[C@H]2COC[C@H]2C1 718636676 LHXIRCKJXQLCKP-DRYSKOCLSA-N 273.332 2.175 10 10 CECE CN(C)c1ccc(/C=C/CNCCSCCCO)cc1 835037738 MJFZAVMPZMJXFB-HWKANZROSA-N 294.464 2.471 10 10 CECE CC(=O)C(=O)COC(=O)C1(c2ccc(C)cc2)CCC1 830326102 BTLZMJBOFMKBKC-UHFFFAOYSA-N 274.316 2.118 10 10 CECE CC[C@H]1COC[C@H]1N(C)Cc1cc(OC)ccc1O 688193249 NPASOGCIRFUKJY-SMDDNHRTSA-N 265.353 2.258 10 10 CECE CCOc1cccc(CN[C@@H]2CCCCNC2)c1O 841091336 VQDVKICDKYCHLY-CYBMUJFWSA-N 264.369 2.023 10 10 CECE COCC1(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)CC1 848561016 NVDXKKIMSNSSSO-SNVBAGLBSA-N 280.324 2.378 10 10 CECE CC[C@H](NS(=O)(=O)Cc1ccc(N)cc1)C(C)C 42585378 KRLXGVMFVMHNMZ-ZDUSSCGKSA-N 270.398 2.123 10 10 CECE C[C@H](N[C@@H]1C[C@@H](C)n2ncnc21)c1cc(F)ccc1O 850499349 NRIAQZKTCCNVKK-VDDIYKPWSA-N 276.315 2.479 10 10 CECE CCCn1ncc(OC)c1[C@@H](O)Cc1ccc(N)cc1 696595949 QVAOWPQWUOUYEV-ZDUSSCGKSA-N 275.352 2.160 10 10 CECE CC(C)(C)OC(=O)N[C@@]1(c2ccc(F)cc2O)CCNC1 1952173616 ZTGGOQMTLPEBHR-HNNXBMFYSA-N 296.342 2.245 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cccnn1 858826951 SHWCSGCERVPJFL-UHFFFAOYSA-N 284.363 2.205 10 10 CECE Cc1ccc(O)c(CNC(=O)Cc2cnn3c2CCCC3)c1 869411770 ZQNWIATWOACNNX-UHFFFAOYSA-N 299.374 2.092 10 10 CECE CN[C@@H](COC)c1cccc(Br)c1O 1951971923 XAHVLHFZDCGBAD-VIFPVBQESA-N 260.131 2.062 10 10 CECE CCN(CCCS(=O)(=O)C(C)C)c1ccc(N)cc1 697138706 ZXWXCKOZSTXQOJ-UHFFFAOYSA-N 284.425 2.308 10 10 CECE CC[C@H](C)CS(=O)(=O)N1Cc2cccc(O)c2C1 867691048 QFLNNVLZGSGYJQ-JTQLQIEISA-N 269.366 2.084 10 10 CECE COC(=O)[C@H]1C[C@@]1(N)c1cc(Cl)cc(Cl)c1O 1952769213 WIKWQJDHQXYVDG-RDDDGLTNSA-N 276.119 2.046 10 10 CECE CC(C)(O)C[C@@H](O)CNc1ccccc1OCC1CC1 872211793 RLJDNFVHWXZUDM-CYBMUJFWSA-N 279.380 2.409 10 10 CECE CN(CCCCO)Cc1cc(Cl)cc(F)c1O 788268436 CDEXNPKOUJMAQR-UHFFFAOYSA-N 261.724 2.389 10 10 CECE COc1ccc(O)c(CNC2CCC3(CC2)COC3)c1 895694762 JWGZEPYOGNAGSP-UHFFFAOYSA-N 277.364 2.450 10 10 CECE C[C@@H]1C[C@@]2(CC[C@H](CNCc3cc(F)ccc3O)O2)CO1 895820279 NEAQFVLZAMEJAV-XFJVYGCCSA-N 295.354 2.348 10 10 CECE N[C@@H](c1nnc(C2CC=CC2)o1)c1ccccc1O 83420689 LXORQNHMDXGFJG-GFCCVEGCSA-N 257.293 2.257 10 10 CECE COc1cccc([C@@H]2NCCc3cc(O)ccc32)c1O 83593545 FJPDQJUCUQEISC-OAHLLOKOSA-N 271.316 2.342 10 10 CECE Oc1cccc2c1[C@H]([C@H](O)Cc1ccccc1)NCC2 83659977 VRWIWBPQLNRFIV-WBVHZDCISA-N 269.344 2.183 10 10 CECE COc1cc([C@@H]2NCCc3cccc(O)c32)ccn1 83660225 RMCLACBUNWEOGK-HNNXBMFYSA-N 256.305 2.031 10 10 CECE CCC1(CC)CN(C)c2cc(N3CCNCC3)ccc2O1 77016958 NBIVMFPCWOMVTA-UHFFFAOYSA-N 289.423 2.484 10 10 CECE CC1(C)CO[C@@H](CCNC(=O)c2c(F)ccc(O)c2O)C1 899454543 AKNQPBHDBCCWKZ-VIFPVBQESA-N 297.326 2.172 10 10 CECE Oc1c(CNCCCn2ccnc2)ccc(F)c1F 703417735 PAWJKRGBEFMZIB-UHFFFAOYSA-N 267.279 2.047 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)c(F)c1 709844943 ROPQIWYICRHKHU-OXHZDVMGSA-N 278.371 2.456 10 10 CECE CCOc1cccc(CN(C)[C@@H](CN)C(F)(F)F)c1O 710764741 PSEDZVGMTPWHQS-NSHDSACASA-N 292.301 2.112 10 10 CECE CC1(C)CC[C@H](CNCc2cccc(O)c2O)OC1 711247487 FMHUWGZQSQQSFF-GFCCVEGCSA-N 265.353 2.393 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2CC(CO)C3)cc1 719228183 PNQDPOTYYBNVIA-UVBJJODRSA-N 261.365 2.480 10 10 CECE CCN1CC[C@@H]1CNCc1cc(Br)ccc1O 712608884 UHEVMKXCQGNHDE-GFCCVEGCSA-N 299.212 2.339 10 10 CECE Cc1ccc([C@@H](C)N[C@H]2CCCS(=O)(=O)CC2)c(O)c1 694816298 HUSJGYBKOVKXFO-OLZOCXBDSA-N 297.420 2.319 10 10 CECE Nc1ccc(CCCN2[C@H]3CC[C@@H](C3)[C@@H]2CO)cc1 2122173130 LEBGNYSZDBMASQ-BPUTZDHNSA-N 260.381 2.047 10 10 CECE O=C1C[C@H](CCNCc2cc(Cl)ccc2O)CCN1 2125784114 CSFSNQNDNDWYOG-SNVBAGLBSA-N 282.771 2.052 10 10 CECE COC(=O)c1occc1CN1CCC[C@@H]1CN=[N+]=[N-] 2123019739 RUBYDRSCBCJZGD-SNVBAGLBSA-N 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10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](N)CC1CCC1 2183007155 XKSDFAPTWLCPII-SMDDNHRTSA-N 276.380 2.429 10 10 CECE CCOc1ccc(N2C[C@H]3CC[C@H]2[C@@H]3N)cc1OCC 2184065314 DIXIKQTYVFMSAP-PVXIVEMSSA-N 276.380 2.410 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](CO)C23CC3)c(F)c1 2190356980 BQQCRHZVOMXFOT-AAEUAGOBSA-N 278.371 2.457 10 10 CECE CN1C[C@@H]2CN(c3ccc4c(c3)CCC[C@@H]4N)C[C@H]2C1 2184687424 RKALVEHLFMCGTM-CPUCHLNUSA-N 271.408 2.021 10 10 CECE CN[C@@H]1CCCc2cc(N3CC[C@](F)(CO)C3)ccc21 2184682777 SCTFBMUTVOYIPN-HZPDHXFCSA-N 278.371 2.194 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](O)[C@H]3C(C)C)ccc21 2184724062 UWJLYIIPECFEDA-IXDOHACOSA-N 274.408 2.489 10 10 CECE CC(C)[C@@H]1CN(C)CCN1c1ccc2c(c1)CC[C@@H]2N 2184741871 POZDVAQBAAOSJD-IRXDYDNUSA-N 273.424 2.409 10 10 CECE O[C@H]1CCc2cc(N3CCN(C4CCC4)CC3)ccc21 2184741267 HFPWSBRZPVDEJD-KRWDZBQOSA-N 272.392 2.341 10 10 CECE CN(C)C1CC2(C1)CN(c1ccc3c(c1)CC[C@H]3N)C2 2184721138 IQSSTFUHOYOYKC-MRXNPFEDSA-N 271.408 2.163 10 10 CECE 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CC(F)(F)[C@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3O)C1 2160119487 CHPIITGMYPTYAX-QPUJVOFHSA-N 282.290 2.154 10 10 CECE CNCc1ccc(N2CC(F)(F)C[C@@]2(C)CO)cc1C 2159050700 GMTUHORZHKMKTK-AWEZNQCLSA-N 284.350 2.311 10 10 CECE COc1cccc(O)c1CN1CC[C@H]2[C@@H]1CCCN2C 2160733717 LHMDYMZQFSTDJJ-KBPBESRZSA-N 276.380 2.069 10 10 CECE CN(Cc1ccccc1O)[C@H]1CCC[C@H](S(C)(=O)=O)C1 2160744664 VYNZGXUBPVUBDN-KBPBESRZSA-N 297.420 2.180 10 10 CECE CNCc1ccc(N2CC[C@@H](CCN(C)C)C2)c(C)c1 701427578 WMBCNYAKBUINAV-OAHLLOKOSA-N 275.440 2.492 10 10 CECE COC[C@H]1CCOCCN1[C@@H](C)c1cc(C)ccc1O 2161189259 ZESBFSRJGDOFDJ-UONOGXRCSA-N 279.380 2.499 10 10 CECE CNCc1ccc(N2CCC[C@@H]2[C@H]2CCCN2C)cc1 2171531207 KAMPKNIRGPWGAW-IAGOWNOFSA-N 273.424 2.469 10 10 CECE NCc1ccc(N2CCO[C@H]([C@@H]3CCOC3)C2)cc1Cl 2171757265 SOXDVMOFZDRMPD-DOMZBBRYSA-N 296.798 2.040 10 10 CECE Nc1ccc(OCCC(=O)N2CC[C@H](C(F)F)C2)cc1 706392525 VFTNBAVAMNNEGD-JTQLQIEISA-N 284.306 2.151 10 10 CECE C[C@H](N[C@H](CN(C)C)C(F)(F)F)c1c(O)cccc1O 2177720293 UGCCOJIPGGYXAY-GZMMTYOYSA-N 292.301 2.241 10 10 CECE CCSC[C@H](C)N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 707120509 ISGFQFSEKKNIJH-IINYFYTJSA-N 293.436 2.241 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3CC34CC(N)C4)ccc21 2163093692 DUEYRHYGRBVXDX-OBKBAYEDSA-N 272.392 2.230 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CNCCSC3)ccc21 2163113207 JFYLVPIXEOHBHA-ZBFHGGJFSA-N 292.448 2.055 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)[C@@H]3CCCSC3)ccc21 709740685 ACJONMFXXISNFK-RISCZKNCSA-N 291.420 2.231 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)[C@@]1(O)CCSC1 2163231619 VJXNVANABAJLIA-HZPDHXFCSA-N 292.448 2.415 10 10 CECE CS[C@@H]1CCCN(CC(=O)N(C)c2ccc(N)cc2)C1 383282603 WHFZICIMBQUUNE-CQSZACIVSA-N 293.436 2.059 10 10 CECE CC(C)C[C@H]1C[C@H]1NS(=O)(=O)Cc1ccc(N)cc1 385312321 NUHKCKSZYFESRA-GXTWGEPZSA-N 282.409 2.123 10 10 CECE CC[C@H](O)[C@H](C)N[C@@H](C)c1ccc(OC)cc1O 386709263 PBKURKXOXDONFX-KWBADKCTSA-N 253.342 2.211 10 10 CECE C[C@@H](c1cc(O)ccc1O)N(C)CCCCC(=O)O 719387855 BQQAPSRBYMLFGN-JTQLQIEISA-N 267.325 2.346 10 10 CECE CN(C[C@H]1C[C@@H]1C1CC1)C(=O)COc1ccc(N)cc1 698244722 JPZTVRXKPQUENY-IUODEOHRSA-N 274.364 2.152 10 10 CECE Nc1ccc(NC(=O)N2CCO[C@H](C(F)(F)F)C2)cc1 698842533 NPVSIWGNIAAVQN-JTQLQIEISA-N 289.257 2.064 10 10 CECE COc1ccc(CN[C@@H]2COC[C@@H]2C(C)C)c(O)c1 699456927 MCWOUWJMELUVBP-ZIAGYGMSSA-N 265.353 2.161 10 10 CECE C[C@@H]1CN(C)C[C@@H]1NCc1ccc(Br)cc1O 722254669 UETQSJJABXXLBS-SKDRFNHKSA-N 299.212 2.194 10 10 CECE COCC1(COC(=O)COc2ccc(N)cc2)CCC1 394310624 ZRNSDFHXMHYFFS-UHFFFAOYSA-N 279.336 2.008 10 10 CECE CCCSCCNC(=O)CCc1ccc(N)cc1 397287655 JWPNTWCLKMAROX-UHFFFAOYSA-N 266.410 2.461 10 10 CECE CN[C@@H](c1ccccc1O)[C@@](C)(O)c1ccc(C)nc1 2174171505 NCVDEVWYIPDOAG-HOTGVXAUSA-N 272.348 2.264 10 10 CECE CCO[C@H](C(=O)Nc1ccc(O)c(O)c1)C(C)C 2063505879 UBJDAEGDFVXYRP-LBPRGKRZSA-N 253.298 2.097 10 10 CECE CCNCc1ccc(OC)c(CN2CC3(F)CC2C3)c1 2167655916 LBFQQCHTINVJTJ-UHFFFAOYSA-N 278.371 2.491 10 10 CECE COC[C@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)CC1 2175061959 JWZHITIIVZRWBB-OTVXOJSOSA-N 276.380 2.133 10 10 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2.442 10 10 CECE O[C@]1(CNCc2ccc3c(c2)CCO3)C[C@H]2CCC[C@@H]21 2197547785 PKDFEWLLDZSDAA-VYDXJSESSA-N 273.376 2.262 10 10 CECE CN[C@H]1CCCc2cc(N3CCN(C)C[C@H]3C)ccc21 2184693972 YJASCAKCVVBROY-DYVFJYSZSA-N 273.424 2.424 10 10 CECE Cc1cc(N2CC[C@@H]3CCO[C@H]3C2)ccc1C[C@@H](C)N 2184833703 OIQLQHDKINCRSV-CPUCHLNUSA-N 274.408 2.500 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@H](O)c2cnns2)cc1 2190665234 ZZKWYZHUWZPEMF-KBPBESRZSA-N 292.408 2.118 10 10 CECE C[C@@H](NCC(F)(F)[C@@H]1CCOC1)c1c(O)cccc1O 2185209835 KKUNYIYDJDFVBA-NXEZZACHSA-N 287.306 2.420 10 10 CECE CCC[C@@H]1COC[C@H]1NCc1c(O)cccc1F 2042599789 RFMWJLIVLSFOLZ-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE CCN(Cc1c(C)cccc1O)C(C)(C)C(=O)O 2042625332 JYPUCZAOZHMNQR-UHFFFAOYSA-N 251.326 2.386 10 10 CECE C[C@H]1C[C@@H](CN)CCN1Cc1c(O)cccc1F 2042626005 ICQBTIDZGVODIU-QWRGUYRKSA-N 252.333 2.091 10 10 CECE OCCC1(NCc2c(O)cccc2F)CCCC1 2042603753 XBUUGJBPWWQPDV-UHFFFAOYSA-N 253.317 2.316 10 10 CECE Oc1cc(Cl)ccc1CN[C@]12COC[C@H]1C2(F)F 2043609103 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C[C@@H](c1ccc(F)cc1O)N1C[C@@H]2CN(C)C[C@]2(C)C1 2353926395 ILJYEKZQWCVCTD-MQIPJXDCSA-N 278.371 2.476 10 10 CECE CCN([C@@H](C)COC)[C@@H](CN)c1ccc2c(c1)CCN2C 50287333 MKIZKNXZFVFEGQ-GUYCJALGSA-N 291.439 2.036 10 10 CECE CCN(Cc1ccncc1)c1ccc2c(c1)NC(=O)[C@H]2N 105001288 SUIQNJMFKGMUSO-HNNXBMFYSA-N 282.347 2.060 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@@H]2C[C@H]2COC)cc1O 2356999198 YIBBXRFFKVSAAM-AVGNSLFASA-N 278.396 2.391 10 10 CECE CO[C@]1(CNCc2c(O)ccc3ccccc23)CCOC1 122922012 FSXLTZKSAFKRKF-KRWDZBQOSA-N 287.359 2.441 10 10 CECE COCC[C@](C)(O)CNCc1cc(Cl)cc(C)c1O 182211173 TXJUGXQBSNDNRX-AWEZNQCLSA-N 287.787 2.231 10 10 CECE CC[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(N(C)C)cc1 180493280 RJQXSRVKIDXEJD-DLBZAZTESA-N 291.439 2.124 10 10 CECE Cc1cccc(CN2CCC[C@H](n3cncn3)C2)c1O 180066641 MNXBLGJKWUHEEN-AWEZNQCLSA-N 272.352 2.129 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1 44660766 TYPZLPVBOREYJE-CVEARBPZSA-N 282.343 2.320 10 10 CECE CC(C)N(CCC(=O)O)[C@H](C)c1ccc(O)cc1O 86748307 MRMXQGXUEZSUSV-SNVBAGLBSA-N 267.325 2.344 10 10 CECE CCNC(=O)CN(CC)c1ccc(CNC2CC2)cc1F 42370535 FGANCTQHFSGXPC-UHFFFAOYSA-N 293.386 2.040 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(F)ccc1[N+](=O)[O-] 42013161 XKQPBSUQOVBLJF-UHFFFAOYSA-N 267.220 2.164 10 10 CECE CC[C@@H]1CN(c2cc(OC)c(OC)c(OC)c2)[C@H](C)CN1 86178686 OSCHRURIFHOGNP-VXGBXAGGSA-N 294.395 2.289 10 10 CECE C[C@@H](c1cc(Br)ccc1O)N1CCN(C)CC1 131884635 OWBCNLRKLYTJHD-JTQLQIEISA-N 299.212 2.463 10 10 CECE CC1C[C@@H]2C(=O)N(CCCc3ccc(N)cc3)C(=O)[C@H]2C1 229911805 ONZFRQLSRLTDSH-GJZGRUSLSA-N 286.375 2.233 10 10 CECE [N-]=[N+]=NC[C@H](Nc1ccccc1Br)C(N)=O 85621895 DGTBQRMTYBQICN-QMMMGPOBSA-N 284.117 2.025 10 10 CECE C[C@@H](N)c1cc(Br)c(F)c([N+](=O)[O-])c1O 238416885 IYOTWVJLKCBXQI-GSVOUGTGSA-N 279.065 2.222 10 10 CECE CCCNC(=O)CCN[C@H](C)c1ccc(F)c(F)c1O 191212647 KVEAIWSXIYUARE-SECBINFHSA-N 286.322 2.237 10 10 CECE Cc1ccc(C)c([C@@H](NCCCN=[N+]=[N-])C(N)=O)c1 90260563 VQFVSBMLZKUZLX-GFCCVEGCSA-N 261.329 2.120 10 10 CECE C[C@H]1COC[C@H](C)N1Cc1ccc(N2CCOCC2)cc1 93606974 YMRVBUZUNZWVBV-GJZGRUSLSA-N 290.407 2.132 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(N)=O)c1cccc2cccnc12 90260544 QTQKPTPVDAIQGZ-ZDUSSCGKSA-N 284.323 2.051 10 10 CECE C[C@@H](c1ccccc1O)N1CCSC[C@@H]1CC(=O)O 91133734 RQNKUTIHZQZNFS-QWRGUYRKSA-N 281.377 2.345 10 10 CECE O=C(O)/C=C/c1ccc(N2CCS(=O)CC2)cc1Cl 236467358 NKPUHYPPVWDMRI-DUXPYHPUSA-N 299.779 2.007 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H](C)[C@H](C)C1 251866058 QEVHQSVKUNEASA-UMNHJUIQSA-N 254.334 2.254 10 10 CECE Cc1ccc([C@H](C)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c(O)c1 368331294 JCAVBSZALRJZPK-COMQUAJESA-N 288.391 2.361 10 10 CECE CCNCc1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)c(Cl)c1 703502685 XPCJCOBEHCAICD-TXEJJXNPSA-N 295.814 2.150 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N(C)[C@H]1CCN(C)C1 380635331 LODPZMMBQXTUOW-VSKVDJIOSA-N 274.364 2.233 10 10 CECE C[C@H]1Cc2cc(N3CCC[C@@H](C4CNC4)C3)ccc2O1 2162662683 SSJKXBJATPFYPM-QWHCGFSZSA-N 272.392 2.446 10 10 CECE NC[C@@H]1C[C@@H]2CCC[C@@H]2N1c1ccc2c(c1)OCCO2 2164802448 BYRHSCVZWBUOPV-UBHSHLNASA-N 274.364 2.164 10 10 CECE CN1CCc2cc([C@@]3(N)CCC[C@@H](N(C)C)C3)ccc21 2163071733 QVHOZSIWAAXCOY-NVXWUHKLSA-N 273.424 2.337 10 10 CECE CCN(CC)c1ccc([C@H](Cn2ccnn2)NC)cc1 2163099288 HOEBGNLXZMLIAT-HNNXBMFYSA-N 273.384 2.085 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@@]12CNC[C@@H]1C2 2163101146 YEPUETUWHBOJDX-UAGQMJEPSA-N 272.392 2.320 10 10 CECE COCC[C@@H](N)[C@H](O)c1ccc(N2CCCCC2)cc1 2163109644 AYXKOJFCITVUKX-HZPDHXFCSA-N 278.396 2.074 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)[C@@H]3C=CCCC3)ccc21 2163122977 GZFBGRBISWIVQH-DQYPLSBCSA-N 272.392 2.396 10 10 CECE Cc1cn(C)nc1CN[C@H](C)c1ccc(F)cc1O 723519596 MOBGRWGARQGLPL-SNVBAGLBSA-N 263.316 2.424 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2CCO[C@@H]2C)cc1 2163152459 TUPJNRXZAZMVNB-WQVCFCJDSA-N 277.412 2.462 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCCCC[C@H]1O 2165035133 UXZUJOGFTXOIHV-CHWSQXEVSA-N 278.352 2.161 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](O)CC[C@H]2C)c1 817415186 UBMNAFCUIFYCGH-YPMHNXCESA-N 265.353 2.136 10 10 CECE CC(C)(C)[C@H]1C[C@@H](NCc2cccc(O)c2O)CO1 2129160796 GYNJDGPLRSSMDR-DGCLKSJQSA-N 265.353 2.391 10 10 CECE C[C@H](NC(=O)[C@@H]1C[C@H]1c1cncn1C)c1ccccc1O 827964878 YQDZUWMQQVCRIO-CYZMBNFOSA-N 285.347 2.107 10 10 CECE Cc1cc(O)c(CNCCCN2CCCC2=O)cc1Cl 825058673 IDHOFCAQNHOOBD-UHFFFAOYSA-N 296.798 2.456 10 10 CECE COC(=O)[C@@H](C)N(C)C/C=C/c1ccc(N(C)C)cc1 835053176 TXCNFZWMUWPWPR-KTRBRXNASA-N 276.380 2.259 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@H]1CCn2ccnc21 834590563 XBMMQENNGVQTAP-HNNXBMFYSA-N 270.380 2.492 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H]1CCC[C@H]1c1ccccc1 837866257 OFHKHZXTKFULQI-UONOGXRCSA-N 274.316 2.272 10 10 CECE CO[C@@H](C(=O)NCc1ccc(O)cc1O)C1CCCCC1 910944861 XNXGSJUQSAFNOJ-OAHLLOKOSA-N 293.363 2.309 10 10 CECE C[C@@H]1CCNC[C@@H]1NCc1cccc(Cl)c1O 841059272 OYQJRYCULCYWPR-SKDRFNHKSA-N 254.761 2.133 10 10 CECE COc1cccc(CNCCC2(CO)CCC2)c1O 846101359 BCISROBOKHNAIA-UHFFFAOYSA-N 265.353 2.043 10 10 CECE Cc1cc(C)c2c(c1)N(C(=O)/C=C\c1cnn(C)c1)CCO2 844898404 VMXDRJNMCZPQQM-PLNGDYQASA-N 297.358 2.476 10 10 CECE CN(C)c1ccc(/C=C\CN2CCNC[C@H]2C(F)F)cc1 843124434 AGRQTPWIJWHIIU-JZIMQPMSSA-N 295.377 2.305 10 10 CECE C[C@@H]1COCC[C@H]1CNC(=O)NCc1c(O)cccc1F 922443288 BLIZROBDQVGRFE-MNOVXSKESA-N 296.342 2.003 10 10 CECE CC[C@H](NCC[C@]1(O)CCOC1)c1ccc(N(C)C)cc1 846193850 KTTQUKHOPRCZMU-IRXDYDNUSA-N 292.423 2.335 10 10 CECE Nc1ccc(CCC(=O)N[C@H](C(F)F)C2CC2)cc1 1893203427 BKKACYFOSPSIKV-ZDUSSCGKSA-N 268.307 2.361 10 10 CECE O=C(NCc1cc(Cl)ccc1O)[C@H]1[C@H]2OCCC[C@@H]21 846474016 QFNOXAMHSKPAPB-RTXFEEFZSA-N 281.739 2.087 10 10 CECE COC1([C@@H](C)NC(=O)NCc2c(O)cccc2F)CCC1 922904472 NIPPEQYXFACFGK-SNVBAGLBSA-N 296.342 2.288 10 10 CECE CN(C)c1cc(F)c(CNCc2cncc(O)c2)cc1F 922975750 KPORIISVMRZCCU-UHFFFAOYSA-N 293.317 2.421 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@@H]2C[C@@]23CCCOC3)CC1 1894279138 MIPDDMFEPHCLES-GXFFZTMASA-N 264.329 2.010 10 10 CECE CC(C)(C)OC(=O)N[C@@]1(c2cc(F)ccc2O)CCNC1 1952193929 GEPYGELKJVBMCJ-HNNXBMFYSA-N 296.342 2.245 10 10 CECE CN(C[C@@H]1C[C@@H]1C1CC1)C(=O)c1ccc(O)c(O)c1 698277027 QBJYSRNYIUMFMS-NWDGAFQWSA-N 261.321 2.216 10 10 CECE CCOC(=O)[C@@H](CC1CC1)NCc1cccc(OC)c1O 753572253 SQQQJBDXBUHTQK-CYBMUJFWSA-N 293.363 2.222 10 10 CECE Cc1ccc(C(=O)NC[C@@H]2CCC3(CCC3)O2)c(O)c1O 922222635 BXFNBWMLDXUWNV-NSHDSACASA-N 291.347 2.238 10 10 CECE COC(=O)C1(N)CC(c2c(C)n(C)c3ccccc23)C1 1952525165 BXUUYCISKJCYLI-UHFFFAOYSA-N 272.348 2.235 10 10 CECE O=C(CC1CSC1)NCc1ccc2cccnc2c1O 868937795 NKHXADXWPYNXSS-UHFFFAOYSA-N 288.372 2.310 10 10 CECE CN(C)Cc1cc(C(F)(F)C2(C(=O)O)CC2)ccc1O 1952964577 CXKAFGHSRFGYSP-UHFFFAOYSA-N 285.290 2.410 10 10 CECE CCC(C)(C)OC1CN(C(=O)c2cc(O)cs2)C1 862717660 RHCWQHPHAKJZTF-UHFFFAOYSA-N 269.366 2.483 10 10 CECE COC(=O)/C(C)=C/CN[C@@H](C)c1cc(OC)ccc1O 775372004 XMJYWHWPYPVDAF-HUYFXPKMSA-N 279.336 2.171 10 10 CECE O=C(C1CC1)[C@@H]1CN(Cc2cccc(Cl)c2O)CCO1 788834123 ZLAGDSQIKZJNCC-ZDUSSCGKSA-N 295.766 2.226 10 10 CECE Cn1cnc(/C=C\C(=O)N2CCc3cccc(F)c32)c1 1126987622 WAKWLJIUAICHND-WAYWQWQTSA-N 271.295 2.162 10 10 CECE Cc1cccc(NCc2ccc(O)c(O)c2O)c1N 83439612 VSNRSKBAUDMEJI-UHFFFAOYSA-N 260.293 2.306 10 10 CECE Oc1cc(F)ccc1[C@H]1NCCc2ccc(O)c(O)c21 83724143 APDDDVWDKZUUMY-CQSZACIVSA-N 275.279 2.178 10 10 CECE COc1cc(OC)c2c(c1)[C@@H](CCC(=O)O)CN2C 84165769 MXIAFELECHRAND-VIFPVBQESA-N 265.309 2.102 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CC[C@H]2C[C@@H]2C1 700102365 AFYJGNJJSTVALJ-IRCOFANPSA-N 266.345 2.254 10 10 CECE CN(C(=O)c1cscc1C(=O)O)c1ccc(N)cc1 702130182 ZSNSGACILYYGGT-UHFFFAOYSA-N 276.317 2.305 10 10 CECE CCN(C)CCNCc1c(O)cccc1Br 706863863 UNYWQWQPMUQJTJ-UHFFFAOYSA-N 287.201 2.196 10 10 CECE CN(C[C@H]1CCSC1)C(=O)CCc1ccc(N)cc1 718438265 NKFAXKUKGFFUAG-CYBMUJFWSA-N 278.421 2.413 10 10 CECE C[C@@H](O)c1ccc(N(C)CC2CSC2)cc1O 718414753 UXXDTRFCLKSJCK-SECBINFHSA-N 253.367 2.245 10 10 CECE CC(C)Cn1ccnc(Oc2ccc(N)cc2)c1=O 61766967 LBAPMQIKXPXIRZ-UHFFFAOYSA-N 259.309 2.274 10 10 CECE C[C@H](N[C@H]1CCCC12OCCO2)c1ccccc1O 715614742 PYYCFXPVAZAMBD-FZMZJTMJSA-N 263.337 2.338 10 10 CECE NCc1ccc(N2CCC[C@@H]3COC[C@H]32)cc1Cl 690292766 KNJAQENKBIDGQB-BXUZGUMPSA-N 266.772 2.414 10 10 CECE Oc1ccc(F)cc1CNCCO[C@@H]1CC1(F)F 690727116 PBIWEXKANGCGRH-LLVKDONJSA-N 261.243 2.045 10 10 CECE CC1(C)OCC[C@H]1c1noc(-c2cccc(O)c2O)n1 693308089 DZZNWDYCNDKPRH-VIFPVBQESA-N 276.292 2.430 10 10 CECE CNCc1ccc(N2CC[C@H](N(C)C)[C@@H](C)C2)cc1 693662032 PJDWWSXOTZLFPM-BBRMVZONSA-N 261.413 2.182 10 10 CECE COCc1nnc(NCc2ccc(N(C)C)cc2)s1 763322140 CRVWXHCHUXKZQV-UHFFFAOYSA-N 278.381 2.363 10 10 CECE CN(Cc1ccccc1O)C(=O)C(C)(C)C(C)(C)N 87628291 AWSLVJQOOFWDLT-UHFFFAOYSA-N 264.369 2.114 10 10 CECE CN1CCCc2cc(CNC[C@H]3CCC[C@@H]3O)ccc21 89165170 WUEXECKSFHWGSP-WBVHZDCISA-N 274.408 2.320 10 10 CECE CO[C@H]1CCC[C@H](CC(=O)NCc2c(O)cccc2O)C1 1304053783 RYODZYHTOHRCCK-RYUDHWBXSA-N 293.363 2.309 10 10 CECE C[C@@]1(C(F)F)C[C@@H]1CNC(=O)c1ccc(O)c(O)c1 2120899579 OTWVGRNRMIZKNE-AMIZOPFISA-N 271.263 2.119 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3CF)c(Cl)cc21 2126810503 NMRNZZXSROWCTM-MADCSZMMSA-N 283.734 2.101 10 10 CECE Cc1cc(CO)ccc1N1CC[C@](O)(C(C)(C)C)C1 2120982004 QRBMHYKFBIZNNT-MRXNPFEDSA-N 263.381 2.475 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@H]3CCO[C@H]3C2)cc1 2115444845 TWAPKZXYXOBGLP-OCCSQVGLSA-N 259.305 2.010 10 10 CECE COC[C@]1(F)CCN(c2ccc([C@@H](C)O)cc2F)C1 2123226800 FMKROHORJXVEPJ-YGRLFVJLSA-N 271.307 2.444 10 10 CECE O=C(NC1CCC(CF)CC1)c1cccc(O)c1O 2118429598 XZWRZCBQCIRUAN-UHFFFAOYSA-N 267.300 2.356 10 10 CECE CN[C@H](c1cc(C2CC2)n(C)n1)c1ccccc1O 2126746466 IADJNPFXOPXIHH-HNNXBMFYSA-N 257.337 2.312 10 10 CECE CCN(CC)[C@H](C)COCCOc1ccc(N)cc1 2119226656 ORGGTYARNCVITN-CYBMUJFWSA-N 266.385 2.395 10 10 CECE CCN[C@H](CC)c1ccc(N2CC=C[C@H]2CO)cc1 2119816711 VRGKORXATAIDKO-JKSUJKDBSA-N 260.381 2.484 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H]1[C@H]2OCCC[C@@H]21 2119908980 POOQCLRJYYGRAT-QXSJWSMHSA-N 260.381 2.438 10 10 CECE CN(C)CCOc1ccc(N(C)C[C@@H]2C[C@H]2F)cc1 2131831818 GQNADOQEIFXPSN-SWLSCSKDSA-N 266.360 2.421 10 10 CECE COc1ccc(N2CCN(C[C@@H]3C[C@H]3F)CC2)cc1 2131821846 MTAKZCVTVYPXNB-SWLSCSKDSA-N 264.344 2.175 10 10 CECE [N-]=[N+]=NCCCCN1C[C@H]2COC[C@@H](C1)C2(F)F 2223432892 CMVIPUVHFRJVNL-AOOOYVTPSA-N 260.288 2.290 10 10 CECE CC[C@]1(O)CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128279284 NYTWNTWWJOURTE-HOTGVXAUSA-N 260.381 2.374 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)CC[C@@H]3O)CCN1C 2128316213 BUMPJYQFNHBPFB-BBRMVZONSA-N 260.381 2.197 10 10 CECE COc1ccc(CNCC[C@H]2CC[C@@H]2OC)c(O)c1 2130376440 AHDJOINSJIPMBZ-ABAIWWIYSA-N 265.353 2.306 10 10 CECE NCc1cc(F)c(N2CC[C@@H](O)[C@@H]2C2CC2)cc1Cl 2130612141 QCNZYMNACJLIHK-KGLIPLIRSA-N 284.762 2.287 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(CC2COCCOC2)C1 2131434230 RPWZGZNZZZJTFE-LBPRGKRZSA-N 268.361 2.062 10 10 CECE CN[C@H](CC1[C@@H]2COC[C@@H]12)c1ccc(N(C)C)cc1 2132381222 IHKDAMUDBJGKKM-HRCADAONSA-N 260.381 2.296 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CC[C@H]2[C@H](C1)C2(F)F 1350936531 OSQPEFXZBRNHCJ-VWYCJHECSA-N 297.301 2.395 10 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CECE CC[C@@H](C(=O)O)N(C)Cc1c(O)cccc1Cl 128827298 UWSRZRSCUGZCTA-JTQLQIEISA-N 257.717 2.341 10 10 CECE CC[C@H]1CN([C@H](C)c2c(O)cccc2O)CCO1 300440843 JYAXVIAXQQMWTI-MNOVXSKESA-N 251.326 2.270 10 10 CECE COc1cccc(CC(=O)N(C)Cc2ccc(N)cc2)c1 35360128 GHCYRZCSATVRAV-UHFFFAOYSA-N 284.359 2.479 10 10 CECE C[C@H]1C[C@@H](N)CN(Cc2c(O)cccc2Cl)C1 128351744 NRQLWQLXZCVISN-VHSXEESVSA-N 254.761 2.215 10 10 CECE COC(=O)c1cnn(-c2ccc(N)cc2)c1C(F)(F)F 259892902 OCZGPHCSYCETIN-UHFFFAOYSA-N 285.225 2.260 10 10 CECE Nc1ccc(CCCn2cc(Cl)cnc2=O)cc1 122747044 HWNHBDBRGALESQ-UHFFFAOYSA-N 263.728 2.112 10 10 CECE COc1cc(N2CCCNC[C@H](C)C2)cc(OC)c1OC 49663189 GTAXAQVNXYYERS-LBPRGKRZSA-N 294.395 2.148 10 10 CECE CCN[C@@](C)(CN(C)c1ccc(OC)cc1)C(=O)OCC 49972059 RKIWPCCTJXFPQR-INIZCTEOSA-N 294.395 2.063 10 10 CECE CN(CCNCc1c(O)cccc1Cl)C1CC1 83552446 LWZNBSJGXOZQCK-UHFFFAOYSA-N 254.761 2.229 10 10 CECE Oc1ccccc1CNC[C@@H](O)COCc1cccs1 228415614 SIISMLUSSMKUDX-CYBMUJFWSA-N 293.388 2.121 10 10 CECE CCN(C[C@@H]1CN(C(C)C)CCO1)c1ccc(CN)cc1 80745545 YVPBSOQQLNLVMM-QGZVFWFLSA-N 291.439 2.081 10 10 CECE CN(C)c1ccc(CNC(=O)Cc2ccccn2)cc1 82270094 SOFKMMHPENFQCD-UHFFFAOYSA-N 269.348 2.007 10 10 CECE CC(C)C1(CNCc2ccc(O)c(O)c2O)CC1 226759681 QEVUYWDYFNHFGY-UHFFFAOYSA-N 251.326 2.329 10 10 CECE CC(C)[C@H](C)CNC(=O)COc1ccc(N)cc1 81039571 WRXXHYYQWJXMKZ-LLVKDONJSA-N 250.342 2.056 10 10 CECE Nc1ccc(CCn2cccc(Br)c2=O)cc1 97909160 ASXWZJMVPCOPAJ-UHFFFAOYSA-N 293.164 2.436 10 10 CECE Oc1ccc(-c2nnc(Br)s2)cc1O 236604288 DIAQTBCQVGHDIW-UHFFFAOYSA-N 273.111 2.379 10 10 CECE CCN(CC)[C@@H](CN)c1ccc2c(c1)CCCN2C 50287003 ANBDSMAKOZVIQA-INIZCTEOSA-N 261.413 2.411 10 10 CECE CCCNCc1nnc(-c2ccc(O)c(O)c2)s1 233107457 ZMOJUDOTBZSTNB-UHFFFAOYSA-N 265.338 2.116 10 10 CECE COc1cccc(CN[C@]23C[C@@H]2COC3(C)C)c1O 527766946 RKIBGKPQIXEXGH-IAQYHMDHSA-N 263.337 2.058 10 10 CECE O=C(O)/C=C\c1ccc(N2CCOCC2)cc1Cl 384810310 QPQUIOABQIEROX-RQOWECAXSA-N 267.712 2.274 10 10 CECE CCN[C@@H]1C[C@H]2C[C@H]1C[C@]2(O)c1ccc(N(C)C)cc1 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CN(CCc1ccncc1)Cc1cc(C=O)ccc1O 821294872 LSPYOGSJRNUOTM-UHFFFAOYSA-N 270.332 2.274 10 10 CECE Oc1ccc(OC(F)F)c(Br)c1O 575680994 VAEAAQSJAFARDN-UHFFFAOYSA-N 255.014 2.462 10 10 CECE CN(C)c1ccc(/C=C/CN2CC(=O)N(C3CC3)C2)cc1 835051072 BTKNBBFICBVIPH-ONEGZZNKSA-N 285.391 2.030 10 10 CECE CCC/C=C\[C@@H](O)C(=O)NCc1cc(Cl)ccc1O 911898404 QBFJCHBOBSGSIJ-DSYXLKISSA-N 283.755 2.379 10 10 CECE COCCN1CCN(Cc2c(O)cc(C)cc2Cl)CC1 840910941 XWUZIRKNQBLQDF-UHFFFAOYSA-N 298.814 2.118 10 10 CECE COCC[C@@H](COC)N[C@@H](C)c1cccc(OC)c1O 846172923 PPESYYTYJYQJFA-RYUDHWBXSA-N 283.368 2.103 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)C(C)C)C2)cc1 855230408 CYVVBWGBPKCBCH-LBPRGKRZSA-N 262.353 2.046 10 10 CECE CCN(c1ccc(/C=C\C(=O)O)cc1)[C@H]1CCN(C)C1 693438428 BPTPGCCHURUOJD-AJHXJQRKSA-N 274.364 2.315 10 10 CECE Cc1ccc(C(=O)N2CCC[C@](C)(F)C2)c(O)c1O 1117818273 KLNFCZFOHIKPIQ-AWEZNQCLSA-N 267.300 2.370 10 10 CECE C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)CC[C@@H]1O 779199528 CZLGFXCKJHLAOM-UFBFGSQYSA-N 273.735 2.387 10 10 CECE CN(C(=O)c1ccc(F)c(N)c1)c1ccc(N)cc1 1876479914 LWJHWEGCUBXSLM-UHFFFAOYSA-N 259.284 2.267 10 10 CECE CN(C)CCn1cc(NCc2cccc(Cl)c2O)cn1 776172484 YHNZZKRDBAJEET-UHFFFAOYSA-N 294.786 2.416 10 10 CECE CCOC(=O)C(F)(F)CN(C)Cc1ccccc1O 1877529636 UCTUMPOQTSSMRM-UHFFFAOYSA-N 273.279 2.022 10 10 CECE COc1nc(N(C)Cc2ccccc2O)ccc1N 1877533051 NVONKZZFNXXINY-UHFFFAOYSA-N 259.309 2.014 10 10 CECE O=C(COC(=O)C1[C@H]2CCCC[C@H]12)c1ccc(O)c(O)c1 784036600 DEPYZUAOAFDETD-QWRGUYRKSA-N 290.315 2.260 10 10 CECE COc1cccc(CN2CCC(C)(N3CCC3)CC2)c1O 895671612 RMIYCIPCWPQLKT-UHFFFAOYSA-N 290.407 2.461 10 10 CECE CCC[C@H](COC)[C@H](NN)c1ccc(N(C)C)cc1 1879039383 IXGRZMSXLYKQSG-UKRRQHHQSA-N 265.401 2.320 10 10 CECE CCCNC(=O)[C@H](C)NCc1cc(Cl)ccc1O 36959756 SCHSZIXWQOYJLV-VIFPVBQESA-N 270.760 2.050 10 10 CECE O=C(c1cc(O)cs1)N1CC[C@@H]2[C@@H](C1)C2(F)F 1148407842 RNEOCHNZCOFUMY-HTQZYQBOSA-N 259.277 2.181 10 10 CECE CN1CCC[C@@H]2CN(Cc3cc(F)ccc3O)CC[C@H]21 246005286 SGRJFCSVXHKMJN-IUODEOHRSA-N 278.371 2.447 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1C(=O)NCCCCN=[N+]=[N-] 1885563157 QCMMFQBBHZPSRY-NXEZZACHSA-N 297.359 2.106 10 10 CECE O=C(CCc1ccsc1)NCc1c(O)cccc1O 1156880829 CSVNNKRZBVDBDH-UHFFFAOYSA-N 277.345 2.408 10 10 CECE Oc1cc2c(c(O)c1O)CCN[C@H]2c1ccccc1F 83658184 RLNWFYKUBXZFDS-ZDUSSCGKSA-N 275.279 2.178 10 10 CECE CN(C)c1ccc(CNc2cccc(CO)n2)cc1 1963325336 ORHOAESJMWBUQJ-UHFFFAOYSA-N 257.337 2.252 10 10 CECE Cc1cc(Br)cc(C(=O)NCCN=[N+]=[N-])c1N 1963808734 DSVNNIOTJDLOJZ-UHFFFAOYSA-N 298.144 2.380 10 10 CECE CC[C@H](NCc1ccc(F)c(F)c1O)[C@H](O)CC 703379309 HETYKVUFVOSFDS-WDEREUQCSA-N 259.296 2.310 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCC[C@H](F)C1 1326596339 KJSQAHRBODPACG-NEPJUHHUSA-N 281.327 2.285 10 10 CECE NCC[C@H]1CCCCN1Cc1cc(F)cc(F)c1O 708485771 NNDCZYZLPCETDG-GFCCVEGCSA-N 270.323 2.374 10 10 CECE CNC(=O)[C@H](CC(C)C)N[C@@H](C)c1ccc(F)cc1O 62747604 HWMIQNPSRJXLSY-GWCFXTLKSA-N 282.359 2.343 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)N1CCCCCC1 63114488 LPDPSVXTYWNZPG-UHFFFAOYSA-N 297.424 2.216 10 10 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257.280 2.167 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@@H](O)C1CC(OC)C1 2148159853 BFUYSIZFUXQNPW-INCPQMAJSA-N 279.380 2.219 10 10 CECE COc1cc(N)c(N2C[C@@H]3CSC[C@]3(C)C2)cc1OC 2144751662 GIXXAQIJMZDREH-BMIGLBTASA-N 294.420 2.475 10 10 CECE CO[C@H](CCO)CN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1972504791 ZCGVVBBXJYWSID-YNEHKIRRSA-N 279.380 2.236 10 10 CECE C[C@@H](Nc1ccc(OCCO)nc1)c1ccccc1O 2144716709 JRSWXJBYZMQMPG-LLVKDONJSA-N 274.320 2.331 10 10 CECE CO[C@H]1C=CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 1974118953 KBXVDWVQOMNNGI-ZDUSSCGKSA-N 279.311 2.121 10 10 CECE Oc1c(F)cccc1CN[C@H]1CC[C@]12CCCO2 1974322262 VEAIFUUNCPOWJT-GXTWGEPZSA-N 251.301 2.333 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3CCN(C)C[C@H]3C2)c1 2148886585 AQPXEAWASDBXJQ-ZBFHGGJFSA-N 274.408 2.474 10 10 CECE COc1ncccc1CNCc1cccc(F)c1O 158720188 DHOZWNKTKRAGDK-UHFFFAOYSA-N 262.284 2.225 10 10 CECE CN[C@H](c1ccccc1O)[C@H]1COc2ccccc2O1 2146239647 BMCMEPYQOHWRBX-HZPDHXFCSA-N 271.316 2.493 10 10 CECE CN(C)C(=O)c1cc(Nc2ccc(N)cc2)ccn1 35672833 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C[C@]12CCO[C@H]1[C@@H](NCc1cc(F)ccc1O)C2 2036585769 DMLBPENPUKNCLK-FPMFFAJLSA-N 251.301 2.188 10 10 CECE CCNCc1ccc(N2CCCN(C)C[C@H]2C)c(F)c1 300556321 YWVPNUUYIILWPE-CYBMUJFWSA-N 279.403 2.466 10 10 CECE COc1ccc(N(C)[C@H]2CC[C@@H](C)OC2)c(N)c1 402008449 ATEIMSAOEVVHPP-MNOVXSKESA-N 250.342 2.281 10 10 CECE CN(C)c1ccc(CN2CC[C@@H]3CNC[C@@H]3CC2)cc1 312890807 WRKJCUKUTUENPU-IYBDPMFKSA-N 273.424 2.184 10 10 CECE Nc1ccc(NC(=O)CN2C[C@H]3CCCC[C@H]3C2)cc1 313431655 ZDHBIPWXVDPYPQ-BETUJISGSA-N 273.380 2.329 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H]2C[C@H](C(=O)O)[C@@H](C2)C1 2160894431 FUGRUSYPUXMHHT-UHXUPSOCSA-N 275.348 2.496 10 10 CECE Cc1cc(N2CC[C@@H]2CN(C)C)ccc1C=CC(=O)O 2160849838 KMTLMPXECQSJDQ-OAHLLOKOSA-N 274.364 2.233 10 10 CECE Nc1cc2c(cc1N(C1CCC1)C1CC1)NC(=O)CO2 2161345744 QQIRTIRSHRQZMV-UHFFFAOYSA-N 273.336 2.121 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CCOC(C)(C)C1 2161528299 OTZYVDKBPPZESQ-NSHDSACASA-N 279.336 2.127 10 10 CECE C[C@H](NC[C@]12COC[C@H]1C2(F)F)c1ccc(O)cc1O 2161890082 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OCc1cc(F)c(N2CC[C@@H]3OCCC[C@@H]3C2)c(F)c1 2170323514 NHOXMHBHGHWCCQ-RISCZKNCSA-N 283.318 2.462 10 10 CECE CC[C@@H](N)c1ccc(N(CC)[C@@H](C)CS(C)(=O)=O)cc1 2170402296 FVDKPAFZERVDQS-SWLSCSKDSA-N 298.452 2.356 10 10 CECE CN(C)c1ccc(CN[C@@H]2CN[C@H]3CCCC[C@@H]32)cc1 2179451898 FJCXMLKMXQGOQV-YESZJQIVSA-N 273.424 2.373 10 10 CECE CCc1cccc(CN2CC[C@@H]3CN(C)CC[C@@H]32)c1O 2170938906 KUBABLZFOZJDLP-ZBFHGGJFSA-N 274.408 2.481 10 10 CECE CCCOc1cc(N2CC[S@](=O)C(C)(C)C2)ccc1N 2170973720 PUHLBLFFLNBBHU-FQEVSTJZSA-N 296.436 2.405 10 10 CECE CN1CC[C@@H]2[C@H](CCN2CCCc2ccc(N)cc2)C1 2170949368 VYHKWLWJICCELH-NVXWUHKLSA-N 273.424 2.227 10 10 CECE C[C@H](c1ccccc1O)N(C)Cc1ccc(CN)nc1 2192595232 BAUYNSUYNSJRMC-GFCCVEGCSA-N 271.364 2.439 10 10 CECE CN=c1[nH]cc(CN(C)Cc2ccccc2O)cc1C 2192598416 OWVPPBCYHDGWOL-UHFFFAOYSA-N 271.364 2.191 10 10 CECE C[C@H](NC(=O)[C@H]1C[C@H](N)C12CCC2)c1ccccc1O 2192627185 LELKUUJYUWEVTF-SUHUHFCYSA-N 274.364 2.087 10 10 CECE C[C@@H]1OCC[C@H]1CCN(C)C(=O)Cc1ccc(N)cc1 2196310088 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CCc1ocnc1C(=O)NCc1c(O)cccc1F 1652295451 JQGUYXFHUTYVSX-UHFFFAOYSA-N 264.256 2.012 10 10 CECE COc1ccc([C@H](C)NCc2cnn(C)c2C)c(O)c1 230669651 YEADGALFQMRTFJ-JTQLQIEISA-N 275.352 2.294 10 10 CECE C[C@H](Nc1ccc2c(c1)C(=O)NC2=O)c1ccccc1O 19966463 KZNTYADZHBYJQA-VIFPVBQESA-N 282.299 2.449 10 10 CECE CSCC[C@H](C)N(C)CC(=O)N(C)c1ccc(N)cc1 161144630 KOYYOWGJFCCNTQ-LBPRGKRZSA-N 295.452 2.305 10 10 CECE CC[C@](NCCCN=[N+]=[N-])(C(=O)OC)c1ccc(F)cn1 161945411 AFFUCAPFIOITNN-CYBMUJFWSA-N 295.318 2.289 10 10 CECE CCOC(=O)CCCNCc1cccc(Cl)c1O 158780525 BIBSZGLKXFKNJQ-UHFFFAOYSA-N 271.744 2.479 10 10 CECE COc1cc(CN2CCC([C@@H](C)O)CC2)c(O)cc1C 160247165 IQOARYGINVDJLM-GFCCVEGCSA-N 279.380 2.302 10 10 CECE COc1cc(O)c(CN(C)CCSC)cc1OC 160386875 YSJNRDZLPAPLEP-UHFFFAOYSA-N 271.382 2.204 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(C)CCC[C@@H]1N 166067350 WWOHJTZWDOJJCH-DOTOQJQBSA-N 289.423 2.229 10 10 CECE C[C@@H](O)CN1C(=O)/C(=C\c2ccsc2)SC1=S 1858587096 SSOKPYREWBTERK-WDTYERQASA-N 285.415 2.330 10 10 CECE COc1cccc(/N=N/N2CCN(c3ncccn3)CC2)c1 1860484251 DYJIEJHARUZICF-VHEBQXMUSA-N 298.350 2.306 10 10 CECE CC(C)[C@H]1CN[C@@H](C)CN1c1ccc2c(c1)OCO2 225420669 ZDQNYXUCIHJZAD-WCQYABFASA-N 262.353 2.238 10 10 CECE Cc1cccc(=O)n1CCCC(=O)Nc1ccc(N)cc1 33512758 DYZMQNUEASHSLQ-UHFFFAOYSA-N 285.347 2.158 10 10 CECE CC[C@H]1CN([C@@H](C)c2c(O)cccc2O)CCN1C 234073462 LVKKEXIUGOWWLH-RYUDHWBXSA-N 264.369 2.185 10 10 CECE CCNCc1cnc(Sc2ncns2)s1 1934276270 JMLGHHRHFGAZBK-UHFFFAOYSA-N 258.397 2.255 10 10 CECE CC[C@H](CCOC)C(=O)NCc1cccc(C)c1O 2139759324 IIYVDBWHXLGTGS-GFCCVEGCSA-N 265.353 2.380 10 10 CECE CN(C)[C@H]1C[C@@H](CNCc2ccc3c(c2)CCO3)C1 848563493 SWZWRTBZTKGEEX-OTVXOJSOSA-N 260.381 2.051 10 10 CECE CN[C@H](C)c1ccc(N2CC(CO)C2)c(Br)c1 1944091375 BPDSTBHFKLWIBS-SECBINFHSA-N 299.212 2.158 10 10 CECE C[C@H](N[C@H](C)[C@H](O)C(F)(F)F)c1cc(F)ccc1O 866462968 FIXIJRHEODPGAY-CVJICSNFSA-N 281.249 2.494 10 10 CECE OCC1(NCc2ccc(Cl)cc2O)CCCC1 1942494177 LMZGHZCJUHUYJZ-UHFFFAOYSA-N 255.745 2.440 10 10 CECE CN(C)c1ccc([C@H](O)C(=O)C[C@H]2C[C@@H]2CF)cc1 1875912382 ANEXCZZULDXWSF-JMSVASOKSA-N 265.328 2.351 10 10 CECE Nc1ccc(CCC(=O)OCOCC(F)(F)F)cc1 236350741 MLNZPJPBNLGGFB-UHFFFAOYSA-N 277.242 2.281 10 10 CECE Nc1ccc(CCNC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1 892038152 APHHWNVFKHPTHZ-GASCZTMLSA-N 285.391 2.419 10 10 CECE C[C@@H]1CC[C@@H](CN(C)c2ccc(CN)c(F)c2F)O1 1885285431 UPBZEBVNWQCKNI-KOLCDFICSA-N 270.323 2.427 10 10 CECE CCc1cccc(CN[C@@H](C(=O)N(C)C)C(C)C)c1O 1963201915 NHOWQFVGBIAVOH-CQSZACIVSA-N 278.396 2.157 10 10 CECE C[C@@H](NC(=O)CCOc1ccc(N)cc1)C1CCC1 137618076 PPGILEAVNJJIEY-LLVKDONJSA-N 262.353 2.343 10 10 CECE Nc1ccc(CCNC(=O)[C@@H]2CCCSC2)cc1 1969320855 PTDIZMFPHASDKR-GFCCVEGCSA-N 264.394 2.071 10 10 CECE CCCOc1ccc(CN2CC[S@@](=O)C[C@@H]2C)c(O)c1 1970310297 LRQAJILLUFKBOH-FKIZINRSSA-N 297.420 2.134 10 10 CECE NC(=O)[C@@]12CCC[C@H]1CN(Cc1cc(Cl)ccc1O)C2 2144093760 PVRJLDVFZUBYIO-XHDPSFHLSA-N 294.782 2.133 10 10 CECE COC[C@@H](NCc1cc(OC)ccc1O)C(F)(F)F 1973152605 UUJNXBADDLZTAY-LLVKDONJSA-N 279.258 2.068 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC[C@]23CCCO3)c1 1974320355 NUVNTMLKKOCIBF-HUUCEWRRSA-N 263.337 2.202 10 10 CECE Cc1ccccc1C(=O)NCCOc1ccc(N)cc1 32118199 UKPBQLBCIKLKQP-UHFFFAOYSA-N 270.332 2.386 10 10 CECE CC(C)CN(c1cc2c(cc1N)OCC(=O)N2)C1CC1 42556646 HCUSPOYVHDOBAA-UHFFFAOYSA-N 275.352 2.225 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(C)c(C)c(O)c1O 260353303 XOFJTDKQPGCHDE-LLVKDONJSA-N 267.325 2.058 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1NCc1ccc2c(c1)CCN2C 159076094 UPRDYCZBORFNRC-CJNGLKHVSA-N 273.424 2.109 10 10 CECE C[C@@]12CC[C@@H](CN1c1cc3c(cc1F)[C@@H](O)C(=O)N3)C2 2145904223 TXMJNSMTTUQOPQ-YVILZHTOSA-N 276.311 2.190 10 10 CECE CN1CCCc2cc(CN[C@H](CO)CC3CC3)ccc21 2146594102 BEPZZOYDNZBPDJ-INIZCTEOSA-N 274.408 2.320 10 10 CECE CN(C)[C@H]1CC[C@H]1NCc1ccc(Cl)cc1O 1996063915 VCJCQVVRYQRMAF-NEPJUHHUSA-N 254.761 2.228 10 10 CECE C[C@H]1CNCCCN1Cc1c(O)cccc1Cl 1996995619 LUZMADYJUZYESB-JTQLQIEISA-N 254.761 2.229 10 10 CECE CN(C)c1ccc2c(c1)CCN2C[C@@H]1[C@H]2CCOC[C@H]21 2150100163 UUWIFQCBXJRXRR-BZUAXINKSA-N 272.392 2.398 10 10 CECE C[C@H](CNCc1cc(Br)ccc1O)N1CCC1 1997057162 LCPLNGYPRKAJSN-SNVBAGLBSA-N 299.212 2.339 10 10 CECE CSC(C)(C)[C@H](NN)c1ccc(N(C)C)cc1 1999528255 YUIHRQDORBCKJX-GFCCVEGCSA-N 253.415 2.399 10 10 CECE O=[S@@]1CC[C@@]2(CCCN2[C@H]2CCc3cccc(O)c32)C1 2158506656 PJNXXUVVXWCIDO-ZSOFBXJNSA-N 291.416 2.367 10 10 CECE Cc1nc(CN(C)C(=O)COc2ccc(N)cc2)cs1 44594980 LYBXZDRVWCZSMU-UHFFFAOYSA-N 291.376 2.071 10 10 CECE Cn1ncc(Br)c1CN1CCC[C@H]1CN=[N+]=[N-] 2009444585 BGYVMVZGVIGFTN-QMMMGPOBSA-N 299.176 2.457 10 10 CECE CC(F)(F)[C@@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 2160119559 IFNSZNJQFCWOFP-SNVBAGLBSA-N 283.322 2.184 10 10 CECE CN(C[C@H]1C=CCC1)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 2153102274 WAADJJFIWRYLAX-XHDPSFHLSA-N 271.364 2.065 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1CCOC[C@H]1F 2013768621 DRACMUULNIMSRD-MNOVXSKESA-N 259.708 2.262 10 10 CECE CC(C)(C)O[C@H]1CCN(C(=O)c2cccc(O)c2O)C1 2153953365 PPWFIYHAMUSDPY-JTQLQIEISA-N 279.336 2.127 10 10 CECE C[C@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)P(C)(C)=O 2019827280 MEEIBLKMOZLBDG-RKDXNWHRSA-N 258.262 2.299 10 10 CECE Cn1c(Cl)cnc1C=C[C@H]1CNCC12CCC2 2019918999 FLTCFWSIXCNBEF-JTQLQIEISA-N 251.761 2.476 10 10 CECE Cc1cccnc1N1CCN(c2ccc(N)cc2)CC1 51041300 WGWDFRRJJBEJAZ-UHFFFAOYSA-N 268.364 2.299 10 10 CECE CN(C[C@H]1OCCC1(C)C)C(=O)Cc1ccc(N)cc1 2154286332 ORQBRQFMAJLXKV-CQSZACIVSA-N 276.380 2.085 10 10 CECE C[C@@H](CNCc1ccc(F)cc1O)N(C)C1CC1 293632667 NHXANTYRFMXDRQ-JTQLQIEISA-N 252.333 2.104 10 10 CECE CNCc1ccc(N(C)C2(C)COC2)c(Cl)c1 2026721239 SHGTWBMIMYLYCY-UHFFFAOYSA-N 254.761 2.285 10 10 CECE CC1(C)C[C@@H](C(=O)O)CCN1Cc1ccc(O)c(O)c1 2155065888 SKFLWYSKAWBDCO-NSHDSACASA-N 279.336 2.173 10 10 CECE CN1CCCN(c2ccc(CN)c(Cl)c2)CCC1 2035151382 MYLYGVHRYRBBGL-UHFFFAOYSA-N 267.804 2.331 10 10 CECE COCCNCc1ccc(N2CCOCC2(C)C)cc1 62737019 HCMZGDCZKQOPFK-UHFFFAOYSA-N 278.396 2.038 10 10 CECE CC(C)NC[C@H]1CCCN(Cc2ccc(O)cc2O)C1 63136732 XULSMPNOVKYPSE-CYBMUJFWSA-N 278.396 2.308 10 10 CECE Nc1ccc(O)c(CN=c2[nH]cc(C(F)F)s2)c1 2037257851 YOONLHWSVZMJQV-UHFFFAOYSA-N 271.292 2.403 10 10 CECE C[C@@H]1CN(CCN2CC[C@@H](CN=[N+]=[N-])C2)C[C@@H]1C 2038476793 FQRFEDGQETWGCJ-XQQFMLRXSA-N 251.378 2.206 10 10 CECE CN1CCc2cc(CN(C)[C@H]3CCC[C@H](N)C3)ccc21 2156050853 AMRWJLKOKUJZBH-HOTGVXAUSA-N 273.424 2.381 10 10 CECE Nc1ccc(CNC(=O)[C@H]2C[C@@H]2C(F)(F)F)cc1 2039187407 SEXKNKNDBPVAKK-UWVGGRQHSA-N 258.243 2.083 10 10 CECE Nc1ccc(OCC(=O)NC2C[C@@H]3CCC[C@H]3C2)cc1 2156134215 XZRCFOXNMTXTGK-RYUDHWBXSA-N 274.364 2.343 10 10 CECE C[C@H]1C[C@H](CC(=O)N2CCC(N=[N+]=[N-])CC2)CO1 2041479198 OTSBWYFAKRPIMC-VHSXEESVSA-N 252.318 2.103 10 10 CECE Nc1ccc(F)c(NC(=O)c2cccc(O)c2O)c1F 2156423161 PORUVSSZBYCEOG-UHFFFAOYSA-N 280.230 2.211 10 10 CECE C[C@H]1CC[C@@H](N(C)c2ccc(CN)cc2F)CO1 401516901 KXUUJWQEEOUNHY-CMPLNLGQSA-N 252.333 2.288 10 10 CECE Nc1ccc(OCCNC(=O)c2cncc(Cl)c2)cc1 308004248 DSZQMOZZHYOUJD-UHFFFAOYSA-N 291.738 2.126 10 10 CECE CC(C)OC(=O)CNCc1cccc(Cl)c1O 308762309 FGWMWMVUIJGBQI-UHFFFAOYSA-N 257.717 2.087 10 10 CECE CN(C)C[C@@H]1CCCN(c2ccc(CN)cc2F)C1 405048929 UFEPDORLCAUUBI-ZDUSSCGKSA-N 265.376 2.062 10 10 CECE C[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(O)cc1O 311975078 ROXRCRCOYQZJND-NDLNZWKESA-N 263.337 2.316 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@@H]1[C@H]2CC[C@H]21 2160067403 RLRKZNDKFWIUPI-RABLLNBGSA-N 273.380 2.184 10 10 CECE CSC[C@H]1C[C@@H](NC(=O)CCOc2ccc(N)cc2)C1 2170793986 ZNBLRBCASCTPHF-BJHJDKERSA-N 294.420 2.296 10 10 CECE COc1cccc(O)c1[C@H](Nc1ccccc1)C(N)=O 2160725645 VWTAPYOIDQHXCE-AWEZNQCLSA-N 272.304 2.039 10 10 CECE CN(C)C[C@@H]1CCN1c1ccc(CN)cc1C(F)(F)F 2160889349 KIGGLFXTJKAIPE-NSHDSACASA-N 287.329 2.304 10 10 CECE CC[C@H]1CNCCN1c1ccc2c(c1)OCCCO2 86176901 SNZCUQRUYORCCF-LBPRGKRZSA-N 262.353 2.036 10 10 CECE CO[C@@H]1C[C@@H](C)CC[C@H]1NC(=O)c1cccc(O)c1O 2162072142 DOTCDLCRLVYPJK-UFGOTCBOSA-N 279.336 2.031 10 10 CECE C[C@H]1CCCCN(CC(=O)c2ccc(O)c(O)c2)C1 703277004 ZKRYFRIAKNIGSG-NSHDSACASA-N 263.337 2.403 10 10 CECE Oc1c(CN[C@H]2CO[C@@H](C3CC3)C2)ccc(F)c1F 703234460 RFOGQXGGNVAOFR-ZYHUDNBSSA-N 269.291 2.328 10 10 CECE CN1[C@H]2CC[C@H]1CN(Cc1ccc(F)c(F)c1O)CC2 703448698 VMGDEIFWXHLHSI-RYUDHWBXSA-N 282.334 2.339 10 10 CECE CCCN(Cc1cc(F)ccc1O)[C@@H]1CCCNC1=O 2171235194 GKJYWEKEVZCMLE-CYBMUJFWSA-N 280.343 2.022 10 10 CECE CN(C[C@H]1C[C@@H](O)C1)c1ccc(CN)cc1Cl 703795024 XCLRDXDZYJTKLC-PHIMTYICSA-N 254.761 2.006 10 10 CECE Oc1ccc(Cl)cc1CNCC1[C@H]2COC[C@H]12 368612365 GYGICJPFLBFYSP-VXGBXAGGSA-N 253.729 2.028 10 10 CECE Cc1ccc(O)c(CN2C[C@@H](C)[C@](C)(C(=O)O)C2)c1 710269928 XZNJIBPDJUMHIO-IAQYHMDHSA-N 263.337 2.243 10 10 CECE Cc1ccc(CCNC(=O)CCc2ccc(N)cc2)o1 689857150 BBTDQFRJJLIEGU-UHFFFAOYSA-N 272.348 2.462 10 10 CECE Nc1ccc(-n2ccc(C(=O)Nc3cnsc3)n2)cc1 690713864 HDGZSDMCCPAGRI-UHFFFAOYSA-N 285.332 2.163 10 10 CECE CN1CCC[C@@H](CN2CCCc3cc(CN)ccc32)C1 691530795 DKVASFIGMXKVOL-OAHLLOKOSA-N 273.424 2.240 10 10 CECE COCC[C@H](COC)N[C@H](C)c1ccc(N(C)C)cc1 381217085 VWMLVGVCYXOBAT-UKRRQHHQSA-N 280.412 2.455 10 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2.341 10 10 CECE CC[C@H]1CC[C@](Sc2nccs2)(C(=O)O)CN1 2306962903 SJBQDYQCRBUIFK-GZMMTYOYSA-N 272.395 2.221 10 10 CECE Oc1cccc2c1[C@H](N1CCOC[C@H](F)C1)CC2 2315073437 IBSPSWZXPSCCPZ-VXGBXAGGSA-N 251.301 2.050 10 10 CECE CC(C)[C@H]1C[C@@H](O)CN1c1ccc(CN)cc1Cl 2321377020 MCXJTWXYVZFWHI-BXUZGUMPSA-N 268.788 2.394 10 10 CECE CCOC(=O)CCN(C)N=Nc1ccc(O)cc1 2330146305 JNDGQTIMNLMSPG-UHFFFAOYSA-N 251.286 2.276 10 10 CECE CN(C)c1ccc([C@@]2(O)CC[C@@H]3NCC[C@@H]3C2)cc1 2329487145 XCOMTNPFNUGBLF-UHOFOFEASA-N 260.381 2.102 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@H]3C[C@@H]2CO)cc1F 2329629745 HGIPUYPSTFWEPR-ZBINZKHDSA-N 264.344 2.024 10 10 CECE Nc1ccc(OCCN2CC[C@@](F)(C(F)F)C2)cc1 2337724005 LHDNARAWYXLLSH-ZDUSSCGKSA-N 274.286 2.327 10 10 CECE CC(=O)N(C)CCN(C)c1ccc([C@H](C)O)cc1Cl 2339467021 XFPVQKVKKJBHIZ-JTQLQIEISA-N 284.787 2.308 10 10 CECE O=C(c1cccc(O)c1O)N1CC[C@@H](SC(F)F)C1 2340116765 FOMJWEVHLFAGBX-SSDOTTSWSA-N 289.303 2.268 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@H](F)[C@@H](CO)C2)c1C 2341069240 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254.761 2.321 10 10 CECE CC(C)[C@](C)(NCc1cc(Cl)ccc1O)C(N)=O 306089956 IVHWCFJAJHCFHD-ZDUSSCGKSA-N 270.760 2.035 10 10 CECE COc1ccc(O)c(CN(C)Cc2cccc(OC)n2)c1 188962857 MYHPYBQPJJBQRD-UHFFFAOYSA-N 288.347 2.436 10 10 CECE CNC[C@@H]1CCCN(C)[C@@H]1c1ccc2c(c1)CCN2C 70278513 NZKOCGKNTPSGSW-DOTOQJQBSA-N 273.424 2.281 10 10 CECE Cc1cc(O)ccc1NC(=O)Nc1cc(O)c(O)c(O)c1 217278687 SYZRKWRMNLSWKO-UHFFFAOYSA-N 290.275 2.461 10 10 CECE Nc1ccc(Cc2nc([C@@H]3C[C@H]4CC[C@@H]3O4)no2)cc1 70427673 KEWZLYVBIKWKBX-UPJWGTAASA-N 271.320 2.278 10 10 CECE CN(C)c1ccc([C@@H](N)c2noc(C(F)(F)F)n2)cc1 36764953 HBWAUDUEWKLOEM-SECBINFHSA-N 286.257 2.203 10 10 CECE CCO[C@H]1C[C@@](O)(CNCc2cc(C)ccc2O)C1(C)C 188924190 JKVSEKDIZIHYKX-DOTOQJQBSA-N 293.407 2.356 10 10 CECE CC(C)(O)CN(Cc1cc([N+](=O)[O-])ccc1O)C1CC1 189985368 FMGGMFOJZNCMFR-UHFFFAOYSA-N 280.324 2.036 10 10 CECE CCN(C(=O)c1cccc(O)c1O)[C@H]1CCCC[C@H]1CN 126697619 PBWFSUUUOQGTRW-AAEUAGOBSA-N 292.379 2.077 10 10 CECE N[C@H]1CCCN(c2ccc(OC[C@H]3CCOC3)cc2F)C1 87439575 CTJRCQWWACGTKQ-STQMWFEESA-N 294.370 2.169 10 10 CECE COc1ccc(N2CC[C@H](CN)C2)cc1Br 83869422 SZUYSQKRHQLYRD-SECBINFHSA-N 285.185 2.243 10 10 CECE Cc1cc(Br)cc(CN[C@H]2CCOC2)c1O 133490001 YKMQKTNYAMRMQT-NSHDSACASA-N 286.169 2.342 10 10 CECE C[C@@H](NC(=O)CCOc1ccc(N)cc1)c1ccncc1 40303559 KGISJKCQPFBUSQ-GFCCVEGCSA-N 285.347 2.310 10 10 CECE CCCNCc1ccc(N2CC[C@H](NC(C)=O)C2)cc1C 228305433 WBIZWPIIUNACCV-INIZCTEOSA-N 289.423 2.209 10 10 CECE Cc1cc([N+](=O)[O-])ccc1C(=O)NCCCN=[N+]=[N-] 44747993 ULIJUUOUWDKDIR-UHFFFAOYSA-N 263.257 2.333 10 10 CECE CCc1cc(COC(=O)Cc2ccc(N)cc2)n(CC)n1 89203086 QBADYTJVMPORLK-UHFFFAOYSA-N 287.363 2.334 10 10 CECE CN(CC(C)(C)O)c1ccc(CNC2CC2)cc1F 92970983 JHOMBTJSWOEJLU-UHFFFAOYSA-N 266.360 2.285 10 10 CECE CN(C[C@H]1CCCO1)c1ccc(CN)c(F)c1F 234292193 GQTYKEOEHWMWCG-SNVBAGLBSA-N 256.296 2.039 10 10 CECE CCN(CC)c1ccc(CN2CCC[C@H]2C(=O)NC)cc1 92100017 RBTAHGIOUGPBHE-INIZCTEOSA-N 289.423 2.243 10 10 CECE COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1cccc(C)c1O 248846960 PIEHNMUCQYYQEJ-CFVMTHIKSA-N 289.375 2.474 10 10 CECE CCOc1ccc(O)c(CN2C[C@H]3CCCN3C[C@H]2C)c1 245789164 VVADUHOSRKGTLZ-UKRRQHHQSA-N 290.407 2.459 10 10 CECE C[C@@H](N[C@H]1CCN2CCC[C@H]1C2)c1cc(O)ccc1O 383602406 ZTSAGJFKSYBBSB-XUJVJEKNSA-N 276.380 2.233 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@]3(COC)C2)c(F)c1 2165466579 CEOUKYKCWIZVBM-CZUORRHYSA-N 278.371 2.408 10 10 CECE CO[C@@H]1CCN(c2ccc(OC(C)C)cc2)[C@H](CN)C1 2162650087 NQHNZOCAEWXPKE-GOEBONIOSA-N 278.396 2.416 10 10 CECE CNCc1ccc(N(C)Cc2ccn(C)n2)cc1C 723493552 ROMFUHSEQICQHR-UHFFFAOYSA-N 258.369 2.084 10 10 CECE Cc1nscc1[C@](C)(O)[C@@H](N)c1ccc(N(C)C)cc1 2163124186 TYGRFYCPIRIEJF-GJZGRUSLSA-N 291.420 2.425 10 10 CECE CN(C)c1ccc([C@H](N)[C@@](C)(O)C[C@@H]2CCCO2)cc1 2163131918 WGOVSCYCVRFKBB-JYJNAYRXSA-N 278.396 2.073 10 10 CECE CCC[C@H](OCC)[C@@H](NN)c1ccc2c(c1)CCN2C 2163135048 GGWAEPBKANHAHA-HOTGVXAUSA-N 277.412 2.389 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)[C@H]3CCCSC3)ccc21 2163137772 GVEUNJMYEQTRHL-BPUTZDHNSA-N 292.448 2.183 10 10 CECE CCc1occc1[C@H](NN)c1ccc2c(c1)CCN2C 2163141982 AMOKUHHBSJGKFE-MRXNPFEDSA-N 271.364 2.387 10 10 CECE COc1ccc(N2CCN(C(=O)CC3CC3)CC2)cc1 298330810 GDNKVVPEWQHXRJ-UHFFFAOYSA-N 274.364 2.144 10 10 CECE CC(C)O[C@@H]1C=CCN(C(=O)Nc2ccc(N)cc2)C1 2165069225 NAWVCRVZVYEQDC-CQSZACIVSA-N 275.352 2.466 10 10 CECE CN1CC[C@@H]2CC[C@H](C1)N2Cc1cccc(F)c1O 718880789 GWICQOYLGKGSOD-QWHCGFSZSA-N 264.344 2.200 10 10 CECE CN(C)c1ccc([C@]2(O)CO[C@H](C(F)(F)F)C2)cc1 2129085983 LCMLMCPVOATOGJ-NWDGAFQWSA-N 275.270 2.291 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@H]2CCN(C)C2=O)cc1Cl 723191176 FIAVELCLHPQCRI-RNCFNFMXSA-N 281.787 2.027 10 10 CECE Cc1cc(Cl)cc(CN(C)CC2CN(C)C2)c1O 827125041 GXQSOHKOVZLXQW-UHFFFAOYSA-N 268.788 2.347 10 10 CECE CCCCN(CC(N)=O)c1ccc([C@H](N)CC)cc1 723198783 LESCYTFOWSNNBO-CQSZACIVSA-N 263.385 2.188 10 10 CECE COc1cc(N)c(N2CCCC[C@@]2(C)CO)cc1OC 722999738 GGNOOCSLFUFUFX-HNNXBMFYSA-N 280.368 2.027 10 10 CECE C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(N(C)C)cc1 828862661 WZNJLODQQMIBHP-FFKNIBCLSA-N 276.380 2.091 10 10 CECE CC[C@H](N)c1ccc(N2CCC(C(=O)NC)CC2)cc1 723152653 DPODCDNXFMYIOH-HNNXBMFYSA-N 275.396 2.059 10 10 CECE CN[C@@H](C)c1cnc(Sc2cnn(C)c2)s1 1976525872 KPTKSWBSUQCPNS-ZETCQYMHSA-N 254.384 2.308 10 10 CECE COc1cccc(CNC(=O)N[C@@H]2CC[C@H]3C[C@@H]3C2)c1O 828502668 OTTQTBNCNZUCOE-CYZMBNFOSA-N 290.363 2.389 10 10 CECE COc1cccc(O)c1CNCC1(CF)CCOCC1 824794300 CVAIMHFCGOIAPF-UHFFFAOYSA-N 283.343 2.257 10 10 CECE CCc1nnc(C(=O)N[C@@H](C)c2ccccc2O)s1 913763352 CXJHHUIVIOJQKW-QMMMGPOBSA-N 277.349 2.297 10 10 CECE OCc1ccc(N2CCSC2)c(Br)c1 1892133691 JUZHYZVFSSOUBM-UHFFFAOYSA-N 274.183 2.452 10 10 CECE CCc1cccc(CN2CCn3cc(C)nc3C2)c1O 848902150 LHRYGSYQOQAHGR-UHFFFAOYSA-N 271.364 2.475 10 10 CECE CC[C@H](NCC[C@@]1(O)CCOC1)c1ccc(C)cc1O 846193167 KJOPSIGJDBGFRJ-GOEBONIOSA-N 279.380 2.283 10 10 CECE Oc1cc2c(cc1CN[C@@H](C(F)F)C1CC1)OCO2 1893194214 CLOJPRCPVDHMKO-GFCCVEGCSA-N 271.263 2.254 10 10 CECE CC(C)(C)OC(=O)N[C@@](C)(C(=O)O)c1ccc(F)cc1O 1951728250 KXEKIPBWFRFTMV-CQSZACIVSA-N 299.298 2.356 10 10 CECE CN(C)c1ccc(CN[C@H]2CN3CCC[C@H]2C3)cc1F 924863185 WFJUOMQJNSYVBJ-ZFWWWQNUSA-N 277.387 2.076 10 10 CECE COC[C@@](C)(CN[C@@H]1CCc2cccc(O)c21)OC 1895281954 RODKFHLALXQUHT-IUODEOHRSA-N 265.353 2.021 10 10 CECE COc1cc(N2CC[C@H]2C(F)F)c([N+](=O)[O-])cc1OC 853650360 PAINVUQMKJGHKD-ZETCQYMHSA-N 288.250 2.456 10 10 CECE C[C@@H](O)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756765063 NHYWLOHTPRVLCN-FXPVBKGRSA-N 253.317 2.440 10 10 CECE O=C1CCCN[C@H]1c1c(O)cccc1Br 1952580679 ICXSJEYFXSCZGD-LLVKDONJSA-N 270.126 2.148 10 10 CECE CCC(F)(F)CC(=O)NCCc1ccc(N)cc1 697650437 OBNYSSHPKYBERD-UHFFFAOYSA-N 256.296 2.363 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4C[C@H]4C3)ccc21 699229169 IZDWUJKZKPQQDT-ZETOZRRWSA-N 271.364 2.136 10 10 CECE C[C@@H]1CCCN(CCc2ccc(N)cc2)[C@@H]1CCO 697213825 UDNLEACKXOZNAX-CZUORRHYSA-N 262.397 2.294 10 10 CECE COC(=O)[C@H]1CCN[C@H]1c1cc2ccccc2cc1O 1952826029 SWLQYXXCSFPTLD-SWLSCSKDSA-N 271.316 2.369 10 10 CECE O=C(OC[C@@H]1CCCO1)N1Cc2cccc(O)c2C1 867690588 JVAVXNSJOFSDLW-NSHDSACASA-N 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YCDBWUCEKRZYFY-STQMWFEESA-N 288.313 2.382 10 10 CECE Cn1ccnc1[C@@](C)(N)c1ccc(N2CCCC2)cc1 2163109563 AEVISBOZMKFEAP-INIZCTEOSA-N 270.380 2.243 10 10 CECE CCN1CCc2cc([C@H](NN)[C@](C)(CC)OC)ccc21 2163133346 MFKIUAWFHPUCJT-HOTGVXAUSA-N 277.412 2.389 10 10 CECE CN(C)c1ccc([C@H](N)[C@@](C)(O)Cc2ccco2)cc1 2163134421 YINXDVRLLMIBOV-HOTGVXAUSA-N 274.364 2.339 10 10 CECE Cc1nn(C)cc1[C@H](N)c1ccc(N2CCCC2)cc1 2163136320 RWGZZWPXFKEOMS-MRXNPFEDSA-N 270.380 2.377 10 10 CECE CCc1occc1[C@@H](NN)c1ccc2c(c1)CCN2C 2163141981 AMOKUHHBSJGKFE-INIZCTEOSA-N 271.364 2.387 10 10 CECE Cc1cc(N(C)[C@H](C)C[S@](C)=O)ccc1/C=C\C(=O)O 398823921 BBZMSOZFWUKBJV-XYDMBCJKSA-N 295.404 2.296 10 10 CECE CCN(CC)c1ccc([C@@](N)(CCOC)COC)cc1 2165960449 LMOQSRGKOYSAIM-MRXNPFEDSA-N 280.412 2.370 10 10 CECE CN1C[C@@H]2CCN(Cc3c(O)ccc(Cl)c3F)[C@@H]2C1 814173943 TVURJFXIDPQTCX-JOYOIKCWSA-N 284.762 2.321 10 10 CECE Nc1ccc(NC(=O)[C@H]2CCCN2c2nccs2)cc1 818556280 IINNNSMIWYSQMJ-GFCCVEGCSA-N 288.376 2.333 10 10 CECE CO[C@H](CNCc1cc(Cl)c(C)cc1O)[C@H]1CCOC1 826821714 BIYCXLQOZCDWPV-XHDPSFHLSA-N 299.798 2.495 10 10 CECE CCOc1ccc(O)c(CNCC[C@@H]2CNC[C@H]2C)c1 903975139 YCZMXVGRAICWNY-CHWSQXEVSA-N 278.396 2.126 10 10 CECE C[C@@H]1C[C@@H](N(C)C(=O)c2cc(O)cs2)CCN1C 743536496 KYBVIOOJAJVIST-ZJUUUORDSA-N 268.382 2.008 10 10 CECE CO[C@H]1COCC[C@H]1CNCc1c(O)cc(C)cc1Cl 840950800 ODCIXEABQKFUHF-NHYWBVRUSA-N 299.798 2.495 10 10 CECE COc1ccc(N(C)CCN(C)C[C@@H](N)CC(C)C)cc1 844902927 XXOOIMPJBQBAHM-HNNXBMFYSA-N 293.455 2.437 10 10 CECE Oc1cc2c(cc1CN[C@@H]1C[C@H]1C1CCC1)OCO2 818229845 FLNOXSAFWDOENA-NWDGAFQWSA-N 261.321 2.399 10 10 CECE C[C@@H]1O[C@@H](OCc2ccccc2)C[C@H](N=[N+]=[N-])[C@@H]1N 687770409 ADJKCJHUIKSBDQ-FTYKPCCVSA-N 262.313 2.344 10 10 CECE Oc1c(F)cc(Cl)cc1CN[C@@H]1CCCCNC1 841089509 HTAKUYNIWVCDGU-LLVKDONJSA-N 272.751 2.416 10 10 CECE C[C@H]1C(=O)N(C)CN1Cc1ccc(N2CCCCC2)cc1 843434849 DUVRENLOIMNULZ-AWEZNQCLSA-N 287.407 2.297 10 10 CECE CC[C@H](C)C(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759591182 ZQCGSMUORBEMCV-STUBTGCMSA-N 278.304 2.269 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@@H](O)C23CCC3)cc1F 850389461 XLYLINCOEYVARD-LSDHHAIUSA-N 278.371 2.285 10 10 CECE C[C@H]1C[C@@H]1NC(=N)NCc1ccc(N2CC=CC2)cc1 864462690 WQGZIGXCEMFWGH-WFASDCNBSA-N 270.380 2.085 10 10 CECE COc1ccc2c(c1)CCCN2C[C@@H](O)C(F)(F)F 763809178 KLSJYXHDLQPSEG-GFCCVEGCSA-N 275.270 2.371 10 10 CECE Cc1cc(O)c(CN2CCN3C(=O)OCC[C@H]3C2)cc1C 763313112 FZBXSLLKCWCJAZ-AWEZNQCLSA-N 290.363 2.036 10 10 CECE COc1ccc(N2CCCN[C@@H](C)CC2)cc1OC 49663654 XOHBEVAAELATOA-LBPRGKRZSA-N 264.369 2.282 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)cc1 1347061126 LVDYBOZTOFOANC-UPJWGTAASA-N 280.318 2.361 10 10 CECE COC(=O)c1cccnc1NCc1ccc(N)cc1 50046189 VLWRYDPUTKMXNL-UHFFFAOYSA-N 257.293 2.063 10 10 CECE CO[C@@H](C)c1noc(CN(C)Cc2cc(F)ccc2O)n1 779033136 OOKIXBQAPJZUQZ-VIFPVBQESA-N 295.314 2.254 10 10 CECE CCN1C[C@@H](C(C)C)NC[C@@H]1c1ccc(OC)cc1O 83587160 KQOASXSAWIBTMK-LSDHHAIUSA-N 278.396 2.392 10 10 CECE COC[C@H](NCc1cc(F)ccc1O)[C@@H]1CCCOC1 895853828 HXHZYVSZJLKWGA-RISCZKNCSA-N 283.343 2.063 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@H](C)CC[C@H]1C 90256930 CLYZDVCTBPZGLW-FOGDFJRCSA-N 254.334 2.254 10 10 CECE CCN(CC)C(=O)[C@H](C)NCc1ccc(F)c(F)c1O 700766082 VIXSXALSPJVNMC-VIFPVBQESA-N 286.322 2.017 10 10 CECE CC[C@H](O)[C@@H](CC)NCc1ccc(F)c(F)c1O 703379306 HETYKVUFVOSFDS-MNOVXSKESA-N 259.296 2.310 10 10 CECE O=C(Nc1cccc2c1CCN2)c1cccc(O)c1O 721208298 WIUNPZJDSHNTQI-UHFFFAOYSA-N 270.288 2.318 10 10 CECE c1cc2c(cc1N1CC[C@H](NC3CC3)C1)OCCCO2 71197820 BNTZLEHHHIJETM-ZDUSSCGKSA-N 274.364 2.179 10 10 CECE CCn1cc(CN[C@H](C)c2ccc(O)cc2O)cn1 688523825 MKRIBQQYGQXDKQ-SNVBAGLBSA-N 261.325 2.165 10 10 CECE COc1ccc(N(C)[C@H]2CO[C@H](C3CC3)C2)c(N)c1 691650637 QKYYEUGYDGTLIL-ABAIWWIYSA-N 262.353 2.281 10 10 CECE CCN(CC1=CSC2=NCCN12)Cc1ccc(N)cc1 699307425 KMEQGZGYUXKOSJ-UHFFFAOYSA-N 288.420 2.351 10 10 CECE CC[C@H](NCC(C)(C)S(C)(=O)=O)c1ccccc1O 93523142 UXRXZZNMXSHBMZ-LBPRGKRZSA-N 285.409 2.256 10 10 CECE Cc1ccc([C@](C)(NCCCN=[N+]=[N-])C(N)=O)cc1F 94838604 MATJDSFPHLJWHV-ZDUSSCGKSA-N 279.319 2.125 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2CC)C1COC1 2119979921 LXSQSDVJBNFFFF-INIZCTEOSA-N 260.381 2.366 10 10 CECE N[C@H](c1ccccc1O)[C@]1(O)CCCc2ccoc21 2126528567 OMZJJMWSXVMDMP-UKRRQHHQSA-N 259.305 2.209 10 10 CECE CC1(C)CO[C@@H](CNCc2c(O)cccc2Cl)CO1 2120126647 GHGJNQHKCSHQBD-JTQLQIEISA-N 285.771 2.329 10 10 CECE Cc1cc(N2CCOC[C@@H]2CF)ccc1C[C@@H](C)N 2126164186 KJIZKHZJTBQJSW-DOMZBBRYSA-N 266.360 2.059 10 10 CECE C[C@H]1C[C@H](CO)CCN1c1ccc([C@@H](C)O)cc1F 2115829266 BZNIZKMBTAZNSG-QJPTWQEYSA-N 267.344 2.476 10 10 CECE OCCC1(CNCc2ccc(Cl)cc2O)CC1 1621270205 OZZSKDCFBLLISY-UHFFFAOYSA-N 255.745 2.298 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC(=O)NCc1cccs1 2123021952 YZIWPJRSVJVBKT-SNVBAGLBSA-N 279.369 2.139 10 10 CECE CN(C[C@@]1(C)COCCO1)c1ccc(CN)cc1Cl 2117635394 PWIMMOHRSBPFBG-AWEZNQCLSA-N 284.787 2.040 10 10 CECE CCOc1cccc(CN(C)[C@@]2(C)CCOC2)c1O 2119020965 TXNYVCCMRKOQNA-HNNXBMFYSA-N 265.353 2.402 10 10 CECE O[C@H]1CCCCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128269584 UDQLINJSFPHCTH-HOCLYGCPSA-N 261.365 2.408 10 10 CECE CN1CC[C@@H](CN(C)c2ccc3c(c2)CC[C@H]3N)C1 2128324633 HWYBHRYMLLQUAX-MLGOLLRUSA-N 259.397 2.021 10 10 CECE N[C@@H]1CCc2cc(N3CCCCC[C@@H]3CO)ccc21 2128311318 SMYKKIGWEVJPSK-GDBMZVCRSA-N 260.381 2.374 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)[C@H]1COC2CC1C2 2128325823 YEALDRQLCHTKER-FQWOSJGLSA-N 258.365 2.246 10 10 CECE OC[C@H]1CCCCCN1c1ccc2c(c1)CC[C@@H]2O 2128322572 RPVDKOXIILFQEW-ZBFHGGJFSA-N 261.365 2.408 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@H](O)[C@@H]3C3CC3)ccc21 2130609087 XFAPSHBBKXWIKO-OAGGEKHMSA-N 259.349 2.016 10 10 CECE CC(F)(F)CCC(=O)NCc1cccc(O)c1O 1349078671 JBWONKWTONCLBK-UHFFFAOYSA-N 259.252 2.149 10 10 CECE CCn1c(C2=C[C@@H](O)[C@@H](N)C2)nc2ccc(Cl)cc21 2131477095 USGZHTTZTRPRRO-GXFFZTMASA-N 277.755 2.185 10 10 CECE C[C@H]1CC(F)(F)CN1c1ccc(CO)c([N+](=O)[O-])c1 2132054122 OJMRMBMAAJEBPC-QMMMGPOBSA-N 272.251 2.321 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1NCc1ccc(F)cc1O 1904362842 CIYJUWCJHBJPOY-RYUDHWBXSA-N 296.342 2.287 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1ccc([N+](=O)[O-])cc1F 1912184845 IRKFHOMIJNQILP-UHFFFAOYSA-N 267.220 2.116 10 10 CECE CN(C)c1ncc(CN2CC[C@H](N=[N+]=[N-])C2)s1 1912144680 WWSIUXVMYBDOKE-QMMMGPOBSA-N 252.347 2.094 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2ccc3c(c2)COCC3)C1 1912151760 LFSARGUMHCSCPE-CYBMUJFWSA-N 272.308 2.284 10 10 CECE Cc1ccc(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)c(C)n1 1912181105 KBRSVAMHXNRPCX-LLVKDONJSA-N 259.313 2.471 10 10 CECE CCC(C)(C)NC(=O)[C@@H](C)N1CCC[C@@H](N=[N+]=[N-])C1 1912186066 ZGCYWZQWJRHOQY-GHMZBOCLSA-N 267.377 2.454 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(=O)O)c1ccc2c(c1)CCCO2 1912211508 XMWBYVHGKPASKE-GFCCVEGCSA-N 276.296 2.037 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2134391807 QAIGVPZXGOPAHT-UZTGAATQSA-N 257.381 2.159 10 10 CECE C[C@@H](O)c1ccc(N(C)C2(CO)CCC2)c(F)c1 1914975056 PUBPHYSAPPYFEV-SNVBAGLBSA-N 253.317 2.230 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H](O)C23CCC3)c(F)c1 1914399168 SDQPPGKHGDNIMQ-YGRLFVJLSA-N 264.344 2.339 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2C[C@H]1[C@H]1C[C@@H]12 1917624811 HQMXUTRDEJVYCQ-QJCXCHQMSA-N 259.349 2.060 10 10 CECE CCC/C=C\[C@@H](O)C(=O)NCc1ccc(N(C)C)cc1C 1543309368 CJQAZKVURVOHTC-XITLMJRVSA-N 290.407 2.394 10 10 CECE C/C=C\[C@H](O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623549560 FOOFODAZCYMJPR-UYZDIKGJSA-N 288.391 2.182 10 10 CECE C/C(=C\c1ccncc1)C(=O)NCc1cccc(O)c1O 1637046371 PVHRDNHSQJHBKC-PKNBQFBNSA-N 284.315 2.213 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC(C2(N)CC2)C1 1924002203 GNXKJVWQHVBISD-GFCCVEGCSA-N 259.397 2.237 10 10 CECE CN(C)[C@@H]1CCC[C@@H]1CNCc1ccc2c(c1)CCO2 1924667829 BRMLPUJNXHFBSP-HZPDHXFCSA-N 274.408 2.441 10 10 CECE COc1ccc(N2CCC3(CC2)CNC3)c(F)c1F 2136975330 GYJBLMHCDUGKHO-UHFFFAOYSA-N 268.307 2.163 10 10 CECE CN(C)c1ccc([C@@H](O)[C@]2(CCF)CCNC2)cc1 2137493547 IELLRMSTSFYCRD-HUUCEWRRSA-N 266.360 2.125 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CCN2CCC[C@@H]2C1 161244738 VHZKHQBSYOYDDK-NWDGAFQWSA-N 289.379 2.094 10 10 CECE COc1cc(N2CCC23CC(CF)C3)ccc1CN 2139686274 JAPLUMRBLGPPJI-UHFFFAOYSA-N 264.344 2.482 10 10 CECE COc1cc(/C=C2/C(=O)N(C)N=C2C)cc(Cl)c1O 1865675066 MVHAPXPFOLLGJT-RUDMXATFSA-N 280.711 2.286 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1cc(F)cc(F)c1 233709580 DGBIXCCUNFHLAK-LLVKDONJSA-N 284.266 2.469 10 10 CECE COc1cc(N2CC(F)(F)C(F)(F)C2)ccc1CN 2139700720 NHZPVGYLZDRDEE-UHFFFAOYSA-N 278.249 2.245 10 10 CECE Cc1ccc(CN2CCC[C@H]3C[C@@]32C(=O)O)c(O)c1 2139770268 GMEGUFXLSMYIEH-WFASDCNBSA-N 261.321 2.140 10 10 CECE CN(C(=O)c1cccc2c1CCNC2)c1ccncc1 234271850 MZGJNQRPEAISJC-UHFFFAOYSA-N 267.332 2.004 10 10 CECE N[C@]12C[C@H]1CN(Cc1c(O)ccc3ccccc13)C2 1236030616 QJYDPQOMOITMLP-LRDDRELGSA-N 254.333 2.078 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)CC[C@H]3N)C[C@H]1CO 2140891926 UYGKAALNRSWKGN-DETPVDSQSA-N 260.381 2.087 10 10 CECE C[C@@H](NC(=O)[C@H]1CCCOCC1)c1ccccc1O 827946304 DAHURGOVCGGTPV-NEPJUHHUSA-N 263.337 2.386 10 10 CECE O=C(N[C@H]1C[C@H]1c1ccccc1)c1cccc(O)c1O 126354461 XKDBAXDMGYLPGW-STQMWFEESA-N 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2.216 10 10 CECE C[C@H](c1ccccc1O)N1O[C@@H]2CCC[C@@H]2[C@H]1C(=O)O 2149283625 BKHPNRNNNIHWGJ-MWQHPAIMSA-N 277.320 2.322 10 10 CECE CC(=O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 1952744359 PHJQREUMZALCHZ-GXSJLCMTSA-N 269.341 2.038 10 10 CECE CCn1cc(C(=O)N(C)Cc2ccc(N)cc2)c(C)n1 2143400467 OMIQATSQGREEBL-UHFFFAOYSA-N 272.352 2.066 10 10 CECE C[C@H](C(=O)O)N(Cc1ccc2c(c1)CCN2C)C1CC1 2143439797 KQNGRHBPPPLMCK-LLVKDONJSA-N 274.364 2.116 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CC[C@@H]2[C@@H](C1)C2(F)F 1971504541 CYWKNTAZHAKSOT-NXEZZACHSA-N 284.262 2.179 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@H]1C(=O)N(C)C 2143700524 NKPXORDIGNGKTF-MFKMUULPSA-N 280.343 2.145 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CC[C@@]12CCCO2 1974322264 VEAIFUUNCPOWJT-OCCSQVGLSA-N 251.301 2.333 10 10 CECE CO[C@@H]1CC[C@H]2CN(c3c(F)cc(CO)cc3F)C[C@H]21 2144202738 CVMYUBOSGWDYEN-MISXGVKJSA-N 283.318 2.318 10 10 CECE Cc1ccc(C(C)(C)C)c(O)c1[C@H](N)CC(=O)O 258786087 XOJBJHJIHCSTBF-SNVBAGLBSA-N 251.326 2.473 10 10 CECE C[C@H]1CCc2cc(N3C[C@@H]4OCCO[C@@H]4C3)ccc2N1 2149771367 LZYPAQOQFGROPM-KNXALSJPSA-N 274.364 2.037 10 10 CECE OCc1cc(F)c(N2CCO[C@H](C3CC3)CC2)c(F)c1 2144813749 YYALFHZUTWZYRT-AWEZNQCLSA-N 283.318 2.462 10 10 CECE CCC[C@@H]1C[C@](O)([C@H](NC)c2ccccc2O)CCO1 2148166003 ZZSQUFSPOFPGQI-WQVCFCJDSA-N 279.380 2.363 10 10 CECE C[C@H](O)[C@H]1C[C@H]1NCc1cccc(Br)c1O 1985622291 HQEHJTKOPDBTNK-JVUFJMBOSA-N 286.169 2.014 10 10 CECE CCN(c1ccc(CN)cc1)[C@@H](C)C(=O)NCC(C)C 34654543 ANEFMBNWMASLPO-ZDUSSCGKSA-N 277.412 2.132 10 10 CECE CN(CCc1ccccn1)Cc1cc(N)ccc1O 37272941 XTSIOUNRYVCAKI-UHFFFAOYSA-N 257.337 2.044 10 10 CECE CN(c1ccc(CO)cc1F)C1CCN(C2CC2)CC1 2145796658 ROXLZDWALCECEC-UHFFFAOYSA-N 278.371 2.381 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@H](C(=O)O)C2(C)CC2)c1 2150031105 YRZRFRJXPOHUFD-NOZJJQNGSA-N 279.336 2.305 10 10 CECE COCC[C@H]1CCCN(CCOc2ccc(N)cc2)C1 2150793601 QBRUDCLQZNSHQY-CQSZACIVSA-N 278.396 2.396 10 10 CECE C[C@]1(CNC(=O)c2cccc(O)c2O)C[C@@H]1C(F)(F)F 2158620491 HMOREPAELCQRHQ-JOYOIKCWSA-N 289.253 2.416 10 10 CECE Nc1ccc(OC[C@H](O)CSc2ccncc2F)cc1 2152908064 WZSVNDSIQMEERK-NSHDSACASA-N 294.351 2.335 10 10 CECE Cc1cc(N2C[C@]34CCC[C@]3(COC4)C2)ccc1CO 2153071012 BMLBLLVQQWYKTD-CALCHBBNSA-N 273.376 2.494 10 10 CECE C[C@H](C[C@@](C)(NCCN=[N+]=[N-])C(=O)O)C(F)F 2008554497 NUTUCJHGQLSEIT-HZGVNTEJSA-N 250.249 2.021 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3C4CCC3(C)CC4)ccc21 2153607144 MWAPUPOCRAKUDR-XHYCCTMSSA-N 271.364 2.421 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@@]3(C)CCO[C@@H]23)c1O 2154146717 SKNJBENAHRLDSJ-UHOFOFEASA-N 277.364 2.448 10 10 CECE Nc1ccc(CCCN2CCN3CCCC[C@H]2C3)cc1 2154252439 NTYAPFSRWHWFAP-KRWDZBQOSA-N 273.424 2.372 10 10 CECE CS[C@@H]1COC[C@@H]1NCc1cc(Cl)ccc1O 2026371561 NJKMRMOAPHCCCJ-CMPLNLGQSA-N 273.785 2.266 10 10 CECE C[C@H](O)c1ccc(N2CC(C)(C)[C@H]2CO)c(F)c1 2031674999 IVKGICVTURNMLT-TVQRCGJNSA-N 253.317 2.086 10 10 CECE COc1ccc(N2CCC=C[C@@H]2CO)cc1Cl 2214340803 XTQVEVUJMPIYOT-LLVKDONJSA-N 253.729 2.476 10 10 CECE CC1(C)C[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CO1 2041435493 PBSHBAVXHFPNBO-ZJUUUORDSA-N 252.318 2.103 10 10 CECE NCc1ccc(N2CCC(F)(F)[C@H](CO)C2)cc1Cl 404034623 UHAFWJFDAUSEID-JTQLQIEISA-N 290.741 2.253 10 10 CECE COc1ccc(N2CCN([S@@](=N)(=O)C(C)C)CC2)cc1 404622869 YPIPGYJLQWZYOD-HXUWFJFHSA-N 297.424 2.187 10 10 CECE COc1cc(Cl)cc(CN2C[C@H]3[C@H](N)CC[C@H]3C2)c1O 312657530 GREGGFPXDKIMMX-ZWKOPEQDSA-N 296.798 2.223 10 10 CECE CCNCc1ccc(N2C[C@H](OC)C[C@H]2CO)c(Cl)c1 312944064 GVROKIIDGRYCDC-QWHCGFSZSA-N 298.814 2.036 10 10 CECE CC(C)[C@@H](NCc1ccc2c(c1)CCCO2)C(=N)NO 2160562233 YVWNCWWQIGWINI-CQSZACIVSA-N 277.368 2.082 10 10 CECE COCC1CC2(CCN2C(=O)Nc2ccc(N)cc2)C1 2160734649 ZGTTVQZBOYHPPM-UHFFFAOYSA-N 275.352 2.302 10 10 CECE CC[C@H]1[C@@H](C(=O)O)CCN1Cc1c(O)cccc1OC 2160710972 BHCRYYPKDJERJY-JQWIXIFHSA-N 279.336 2.086 10 10 CECE CN(C[C@@H]1COC2(CCCC2)O1)c1ccc(CN)cc1 2161266023 JRQMBELZRKJREE-OAHLLOKOSA-N 276.380 2.267 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1CN(C)CCC(=O)Nc1ccc(N)cc1 2161548971 AFGYXEYNJICRAP-JYAVWHMHSA-N 275.396 2.431 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3OC(=O)N(C)[C@@H]3C2)cc1Cl 2176930454 KHRBSNZIICVTIP-CKLFPEKLSA-N 296.754 2.033 10 10 CECE [N-]=[N+]=NCCN[C@H](C(N)=O)c1ccc2ccccc2c1 90257928 MEXJYXICGIQASP-ZDUSSCGKSA-N 269.308 2.266 10 10 CECE CN1C[C@@H]2CN(Cc3cc(Cl)ccc3O)C[C@]2(C)C1 702415053 NNVUSNKKVFXKDC-DOMZBBRYSA-N 280.799 2.429 10 10 CECE CN1CCc2cc([C@@H](O)C(C)(C)[C@@H](N)C3CC3)ccc21 2179408119 HPRKYFKESIIVOP-JKSUJKDBSA-N 274.408 2.476 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCO[C@@H](CF)C1 2172041104 KLIWBQPBKIYUFQ-ZDUSSCGKSA-N 279.311 2.268 10 10 CECE CCN1CCc2cc([C@@]3(O)CCNC34CCC4)ccc21 2177297831 LQWPRSHHSHIUGT-KRWDZBQOSA-N 272.392 2.173 10 10 CECE O=C(O)[C@]12CCC[C@]1(F)CN(Cc1ccccc1O)C2 2172128124 OXCJTDJFDFBLET-CABCVRRESA-N 279.311 2.171 10 10 CECE C[C@@H]1[C@H](O)C[C@H]2CC[C@H]1N2CCc1ccc(N)cc1 686177659 OTSGVQXQYCODES-AEAUEXCSSA-N 260.381 2.045 10 10 CECE CO[C@H](C)CN(C(=O)CCc1ccc(N)cc1)C(C)C 708284738 ZLHMNIVUAVERDD-CYBMUJFWSA-N 278.396 2.473 10 10 CECE OCCN[C@H]1CCCN(c2ccc3c(c2)CCCC3)C1 2162653917 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CCOc1cccc(CN[C@H](CC)C[C@H](C)O)c1O 716798686 JJEIUTLLOLYURA-WCQYABFASA-N 267.369 2.430 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](CO)[C@@H]2C)cc1 385856163 YONLQQBOCCNHJY-DZGCQCFKSA-N 262.397 2.392 10 10 CECE C[C@H](N[C@H]1CC12CCOCC2)c1cc(O)ccc1O 387251691 KFWBDFCAVVHMFF-HZMBPMFUSA-N 263.337 2.318 10 10 CECE COc1ccc([C@@H](C)NC[C@](C)(O)C(F)(F)F)c(O)c1 698557478 PDAISSCLHHIIKD-PELKAZGASA-N 293.285 2.365 10 10 CECE CC[C@H](NCc1ccc(O)nn1)c1ccccc1O 391353590 JBJTXSHUVPCEPJ-LBPRGKRZSA-N 259.309 2.129 10 10 CECE C[C@@H](NCC1=CCN(C)CC1)c1cc(O)ccc1O 392254591 IBNPFVKEASMDBZ-LLVKDONJSA-N 262.353 2.010 10 10 CECE C[C@H]1C[C@@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C[C@@H](C)O1 724374767 JEORIXVQCVLHPM-QCNOEVLYSA-N 266.345 2.491 10 10 CECE CN(Cc1cccs1)C(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2179616053 LSWIOMBDKXPKQN-NSHDSACASA-N 293.396 2.481 10 10 CECE CC(C)COC[C@@H](NN)c1ccc(N2CCCC2)cc1 2165569896 PHZQWJWSEQOTMA-MRXNPFEDSA-N 277.412 2.464 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H]2[C@@H](C[C@H]2C(=O)O)C1 2174325705 METDABUWNPFSSV-DTVLGXAZSA-N 279.311 2.245 10 10 CECE CN1CCc2cc([C@@H](O)c3cc(C(F)F)n[nH]3)ccc21 2168505808 CYGMHJQKPQYBKS-CYBMUJFWSA-N 279.290 2.421 10 10 CECE CCOC(=O)CCCCOC(=O)Cc1ccc(N)cc1 2178601239 NYCXQRIWEKJIIS-UHFFFAOYSA-N 279.336 2.088 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCS(=O)(=O)[C@@H](C)[C@@H]2C)c1 2170446639 PRQWUAAMWCRYKJ-AVGNSLFASA-N 297.420 2.269 10 10 CECE CC(C)[C@@H]1CN(C)CCN1c1ccc([C@H](C)N)c(O)c1 2170575227 LMIKULYLXJEXMR-WFASDCNBSA-N 277.412 2.188 10 10 CECE Nc1ccc(CCN2CCC(n3cccn3)CC2)cc1 2170679155 DFDSXORFTJKFHR-UHFFFAOYSA-N 270.380 2.345 10 10 CECE C[C@@H](NC(=O)[C@H](CN)C1CCCC1)c1ccccc1O 2192629416 SAFANRWZIYAYEX-BXUZGUMPSA-N 276.380 2.335 10 10 CECE CNCc1ccc(N2CC(N3CCC[C@@H](C)C3)C2)cc1 2188384243 MUYHFMZBVQJWQV-CQSZACIVSA-N 273.424 2.327 10 10 CECE COc1cccc(O)c1CNC[C@H]1C[C@@H]2CC[C@H](C1)O2 2181507351 PHLOAHHLZKBECK-XYYAHUGASA-N 277.364 2.448 10 10 CECE CCOC(C)(C)c1noc(-c2cc(O)c(O)c(O)c2)n1 2188917247 VTNBTCPCCFWKDL-UHFFFAOYSA-N 280.280 2.125 10 10 CECE 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253.317 2.200 10 10 CECE CN(C[C@@H]1[C@H]2CCO[C@@H]12)c1ccc(CO)cc1Cl 2056361745 JTLWCZLOIDJMMW-JTNHKYCSSA-N 267.756 2.303 10 10 CECE Cc1nn[nH]c1CNCc1c(O)ccc2ccccc12 2186474704 BQYOHDOXFNTYHR-UHFFFAOYSA-N 268.320 2.262 10 10 CECE C[C@@H]1[C@H](O)CN1c1ccc(CNC2CC2)cc1Cl 2062259221 JROIKKPIYVTSKD-YMTOWFKASA-N 266.772 2.161 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@H](O)[C@H]3C3CC3)ccc21 2187175095 WVDNGFIESMBDJM-IXDOHACOSA-N 272.392 2.372 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3C[C@H]3[C@@H]2CO)c(F)c1 2198991672 CHYOMQJDDVULDA-ZENOOKHLSA-N 278.371 2.141 10 10 CECE CO[C@@]1(C)CCN(c2ccc(CO)cc2)C[C@]1(C)OC 2199613089 ONGJVFMVJGOOSD-HOTGVXAUSA-N 279.380 2.199 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN([C@H]2[C@H]3CC[C@@H](C3)[C@H]2O)CC1 2076506605 BWXFUPZRCKFPOT-IEECTRCBSA-N 250.346 2.311 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)C1(COC)CC1 2101802186 XOILZCZPXUKLMW-UHFFFAOYSA-N 262.353 2.044 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H](C)N2CCC2)c1 2102996427 JFLBPOFCBIGYQN-NEPJUHHUSA-N 264.369 2.146 10 10 CECE 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2.000 10 10 CECE CN(C)c1ccc([C@](C)(O)C2CCC(N)CC2)cc1 2106806543 YEJWOUZXUDGFDO-LDZOIKDWSA-N 262.397 2.478 10 10 CECE CCN(Cc1ccc(N)cc1)Cc1cn(C)nc1C 2087129606 RNFZHWGNRXXNFG-UHFFFAOYSA-N 258.369 2.333 10 10 CECE Oc1ccc(CN[C@H]2C[C@H]3C=C[C@H]2CC3)c(O)c1O 2087603440 IXKYMAULSAUWAY-NHCYSSNCSA-N 261.321 2.248 10 10 CECE CCCN[C@@H](c1ccc2c(c1)CCN2C)C1(N)CC1 2107953762 BIABBSOGPLFEQU-HNNXBMFYSA-N 259.397 2.211 10 10 CECE C[C@@H]1C[C@@H]1CS(=O)(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2108414590 ASUBKMMQRDJGLU-GRYCIOLGSA-N 286.401 2.385 10 10 CECE NN[C@H](c1csc(C(F)(F)F)n1)c1ccccc1O 2108964398 CQIKEANMTIPNNR-VIFPVBQESA-N 289.282 2.420 10 10 CECE C[C@H]1CCOCC[C@@H]1N(C)Cc1cc(N)ccc1O 2109094126 WSLUBICPAGVCRA-FZMZJTMJSA-N 264.369 2.221 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc([C@H](C)O)cc1F)C2 2109168651 HFNCGKMGIAZHPK-JVLSTEMRSA-N 265.328 2.352 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@]3(COC)C2)c(F)c1 2109178018 SLTBJJZJRLSXCF-IUODEOHRSA-N 264.344 2.018 10 10 CECE CNCc1ccc(N2C[C@H]3CC[C@@]2(CO)C3)c(Cl)c1 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COc1csc([C@@](C)(N)c2ccc(N(C)C)cc2)n1 2098582533 SOOPHDGOCCPUER-AWEZNQCLSA-N 277.393 2.440 10 10 CECE COc1csc([C@H](N)c2ccc3c(c2)CCN3C)n1 2098582878 BOTNPDQOBXQNTI-CYBMUJFWSA-N 275.377 2.192 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C1(C)CC(N)C1 2098942339 RZOFNTTVZIQCGA-NLTNOIMHSA-N 262.353 2.039 10 10 CECE Oc1ccc(CNC[C@H]2CCC3(CC3)C2)c(O)c1O 2099962845 ZQGQGHWXEHUDDQ-JTQLQIEISA-N 263.337 2.473 10 10 CECE Cc1cc(CN)ccc1N1CC[C@@H]2OCCC[C@H]2C1 2113890604 HHSCRFXBIAHKBD-HOCLYGCPSA-N 260.381 2.459 10 10 CECE CNCc1ccc(N2CC[C@H](OC(C)C)C2)cc1OC 2204540781 CUGSPQODVHNZSV-HNNXBMFYSA-N 278.396 2.418 10 10 CECE CCCO[C@@H]1C=CCN(c2ccc(CO)c(OC)c2)C1 2204559242 MPWCLKAUGGIIOW-OAHLLOKOSA-N 277.364 2.359 10 10 CECE CCNCc1ccc(N2C[C@@H]3COCC[C@@H]32)cc1OC 2204558584 FEEXPXMEGROLBJ-HIFRSBDPSA-N 276.380 2.030 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1CCc2nccn2C1 2204745935 AHAVVPNNDIGSLM-NSHDSACASA-N 275.327 2.080 10 10 CECE C[C@@H]1C[C@@H]2CN(c3cc4c(cc3Cl)[C@@H](O)C(=O)N4)C[C@@H]21 2206418248 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CCCN(Cc1ccc(N)cc1)c1nc(C(N)=O)cs1 2233892328 AYXLJGMTEHBXRP-UHFFFAOYSA-N 290.392 2.241 10 10 CECE CCCOc1ccc(N2CCC[C@](CO)(OC)C2)cc1 2235099307 PKQBWHYCCZOSFZ-INIZCTEOSA-N 279.380 2.453 10 10 CECE COc1ccc(N2CCC[C@H]2[C@H](O)CO)cc1C(C)C 2235140955 NXTPVDJUIYTXMT-LSDHHAIUSA-N 279.380 2.141 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@@H](C)[C@@H](O)C3)c(OC)c1 2235123219 XCJHDHXROYLQIB-MPXAEWJHSA-N 277.364 2.442 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@@H]2C[C@]3(C)O)c(F)c1 2225431562 TULGSZTTYHAURA-OKFJQDPLSA-N 264.344 2.195 10 10 CECE COc1ccc(N2CC[C@H](COC(C)C)C2)c(CN)c1 2235954475 MPYFUYUSBMJRGS-ZDUSSCGKSA-N 278.396 2.405 10 10 CECE COc1ccc(N2CCC[C@@H](OC)CC2)c(CCN)c1 2235979812 CLECCYUGUAAJHV-CQSZACIVSA-N 278.396 2.202 10 10 CECE OC[C@@H]1[C@@H]2C[C@H]2CN1c1ccc(OC2CCC2)cc1 2226521819 HFDCTMCGFYAJPJ-IUIKQTSFSA-N 259.349 2.435 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)OCCCO3)[C@@H]1CO 2226810087 GRPNEVHMTWANJC-WCQYABFASA-N 263.337 2.055 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)[C@H]1CC1(F)F 2227024212 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NCc1cnc(Sc2nc3nccnc3s2)s1 2248357570 PLKAJJHLBTVVHK-UHFFFAOYSA-N 281.391 2.153 10 10 CECE CCc1nsc(CNCCc2ccc(N)cc2)n1 2260321940 KCICTDGPRALJCO-UHFFFAOYSA-N 262.382 2.015 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c(C)c1 2270689056 CSVCPZDRNMZCJU-YYWXWVFPSA-N 260.381 2.092 10 10 CECE C[C@@H](O)CN(c1ccc2c(c1)OCCO2)C(C)(C)C 2272495845 HIMWWQLUVRLNGA-LLVKDONJSA-N 265.353 2.444 10 10 CECE C[C@H]1CCN(c2ccc(OCF)cc2)C[C@@H]1CO 2263940611 RPYNLVKHHOEGTI-NWDGAFQWSA-N 253.317 2.447 10 10 CECE c1cc2c(cc1CN[C@H]1CC[C@H]3C[C@H]1CO3)CCO2 2265677369 XXAJQLOMFPCEMS-KKUMJFAQSA-N 259.349 2.279 10 10 CECE NCc1ccc(NC(=O)c2cccc(O)c2O)cc1Cl 2281656005 DYNWALWFBGZCRU-UHFFFAOYSA-N 292.722 2.462 10 10 CECE C[C@@H]1COC(C)(C)CN1C(=O)CCc1ccc(N)cc1 2284151201 OZIQNHWNJSAZHR-GFCCVEGCSA-N 276.380 2.227 10 10 CECE CCN[C@@H](C)c1ccc(N2CC([C@@H](F)CO)C2)cc1C 2285124738 SHQBLZFEGXFCBK-LRDDRELGSA-N 280.387 2.432 10 10 CECE CCCN[C@H](C)c1ccc(N(C)[C@@H](C)C(N)=O)cc1C 2285144802 WZYOSFMVLRAORH-OLZOCXBDSA-N 277.412 2.366 10 10 CECE COc1ccc(N(C)[C@@H](CO)c2ccccc2)c(N)c1 2296485863 BKDFLSHKWXCPKL-INIZCTEOSA-N 272.348 2.447 10 10 CECE O=C(/C=C/c1cnccn1)N1CCSc2ncccc21 491938386 LMAVCBIJQZKEHR-ONEGZZNKSA-N 284.344 2.024 10 10 CECE Cn1c(-c2cc(O)c(O)c(O)c2)nc2cc(F)ccc21 1251244549 LMIIYSLAEWLVHQ-UHFFFAOYSA-N 274.251 2.496 10 10 CECE C[C@H](CCCC(=O)O)N(C)Cc1ccc(N)cc1 2318108450 DKJJHSKPUUKFBV-LLVKDONJSA-N 250.342 2.344 10 10 CECE CCO[C@H]1C[C@@H](NC(=O)N[C@@H](C)c2ccccc2O)C1 868693575 PDVRJDUECXIFOH-SDDRHHMPSA-N 278.352 2.320 10 10 CECE CN1CCc2cc([C@@H](NN)[C@@H]3CC[C@@H]4C[C@@H]43)ccc21 2329488821 JTMQIIHUHBUVKS-HPAJIGNASA-N 257.381 2.229 10 10 CECE COC[C@@H](NCc1c(O)cccc1OC)C(F)(F)F 2336560309 DSPVTFBHIQQMKR-LLVKDONJSA-N 279.258 2.068 10 10 CECE O=C(NC[C@H]1C[C@@H]2CC[C@H]1C2)c1cccc(O)c1O 2334290999 DVKDPEQCMOMZIF-OUAUKWLOSA-N 261.321 2.264 10 10 CECE CO[C@@H]1C[C@@H]1NCc1cc(OC(F)(F)F)ccc1O 2335908532 AXBKRRNKJOMDQS-GXSJLCMTSA-N 277.242 2.168 10 10 CECE COc1c(F)c(F)cc(C(=O)NCCN=[N+]=[N-])c1F 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Nc1ccc(CNC(=O)c2ccc3nccnc3c2)cc1 61411058 HERKTDHSQWJJGJ-UHFFFAOYSA-N 278.315 2.142 10 10 CECE CN(Cc1ccccc1O)C(=O)Cn1ncc2ccccc21 107346664 QBNUAWWVACUHJP-UHFFFAOYSA-N 295.342 2.401 10 10 CECE C[C@H]1CC[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)O1 178057930 NKMYOQQTNAIPBN-BBRMVZONSA-N 288.391 2.471 10 10 CECE Fc1cc(CNC2CC2)ccc1N1CCn2ccnc2C1 62254931 WPRABJPQSBTBDX-UHFFFAOYSA-N 286.354 2.294 10 10 CECE CN(C)[C@@H]1CCN(c2ccc(/C=C/C(=O)O)cc2F)C1 62967256 APQHIYVGRYRVSO-FVOPLDGLSA-N 278.327 2.064 10 10 CECE COc1ccc(O)c(CN(C)[C@H]2CCO[C@@H]2C)c1 211678501 CFPBJOKOXKZVBU-MFKMUULPSA-N 251.326 2.010 10 10 CECE CC(C)n1c(S)nnc1-c1cccc(O)c1O 126607242 JMRMHYPDINEXFZ-UHFFFAOYSA-N 251.311 2.226 10 10 CECE COc1ccc(N2C(=O)[C@H](C)SC2=S)cc1 32265722 LFOHTIRZXHBXJJ-ZETCQYMHSA-N 253.348 2.448 10 10 CECE Cc1ccc([C@@H](C)N[C@@](C)(C(N)=O)C(C)C)c(O)c1 311974652 KNAXFMQEPIMMBK-IAQYHMDHSA-N 264.369 2.251 10 10 CECE COC(=O)C(C)(C)N[C@H](C)c1ccc(N(C)C)cc1 37304403 IMXDBCRQRAWXPA-LLVKDONJSA-N 264.369 2.355 10 10 CECE CCc1cc(OC)c(O)c(CNC)c1Br 218857220 JQOXUYMFRPBODS-UHFFFAOYSA-N 274.158 2.445 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCO[C@@H]3CCC[C@@H]32)cc1 220973258 SVUYWENRDBEOMA-YESZJQIVSA-N 289.423 2.006 10 10 CECE CCN(CCO)Cc1cc(C)cc(Br)c1O 134753587 VHSKYYQJTRWEMB-UHFFFAOYSA-N 288.185 2.277 10 10 CECE CCNCc1ccc(N2CCC[C@H]2CO)c(Cl)c1 135193137 RWPXTKQGVCTHOS-LBPRGKRZSA-N 268.788 2.411 10 10 CECE CCC(CC)NC(=O)[C@H](C)OC(=O)Cc1ccc(N)cc1 41098645 QDENDEZUMWWWHK-NSHDSACASA-N 292.379 2.048 10 10 CECE C[C@@H](NCc1ccc(O)c(O)c1)c1nccs1 80264924 JJUJPIYQJIZFKN-MRVPVSSYSA-N 250.323 2.405 10 10 CECE COc1ccc(N2CCN(C[C@H](CN)C(C)C)CC2)cc1 87535175 XZWWAEHGMMEQGR-HNNXBMFYSA-N 291.439 2.048 10 10 CECE CCC[C@H](O)[C@H](N)c1c(F)ccc(Br)c1O 95805233 ALUQNLBMVMHHIU-WPRPVWTQSA-N 292.148 2.455 10 10 CECE Oc1c(F)cccc1CNCC[C@@H]1CCCOC1 529637207 PLDUFDJPKQXHFU-NSHDSACASA-N 253.317 2.438 10 10 CECE C[C@H](N[C@H]1CCCC[C@H]1O)c1ccc(O)cc1O 251512203 IQFDKVZZBPOZRR-TVYUQYBPSA-N 251.326 2.052 10 10 CECE 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2.266 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2cnsn2)c([N+](=O)[O-])c1 2167116767 PWQDTEMPYXXVAJ-QMMMGPOBSA-N 294.336 2.136 10 10 CECE C[C@@H](NC1CNC1)c1cccc(C(F)(F)F)c1O 817955799 IDAZGIAJQNJOJE-SSDOTTSWSA-N 260.259 2.033 10 10 CECE C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)[C@H]1C[C@H]1C 817940885 LWGVLZUMHYQXIA-GUYJKWIASA-N 261.413 2.387 10 10 CECE CNCc1ccc(N2CC=C(COC)CC2)c(C)c1 723161684 DZIFXEZPRCHOKU-UHFFFAOYSA-N 260.381 2.497 10 10 CECE Cc1ccc(O)c(CN2C[C@@H](C)[C@@H](CC(=O)O)C2)c1 722646118 SYXJPNHIUAJZLH-NEPJUHHUSA-N 263.337 2.243 10 10 CECE NC(=O)N[C@H]1CC[C@H](Nc2c(N)cccc2Cl)CC1 2129683731 YNFUFTQIVQFUQE-KYZUINATSA-N 282.775 2.314 10 10 CECE Nc1ccc(OCCCN2CC[C@@H]3OCC[C@H]3C2)cc1 724839482 VBNSNIUNCOUOIA-BBRMVZONSA-N 276.380 2.149 10 10 CECE Cc1cc(O)c(CN2CN(C)C(=O)[C@@H]2C)cc1C(C)C 842642608 VBJUVVJMRLTDJL-LBPRGKRZSA-N 276.380 2.444 10 10 CECE Cc1cc(N(C)C)ccc1CN(C1CC1)[C@@H]1CCNC1 843055663 MVQLKURKFHABSG-QGZVFWFLSA-N 273.424 2.387 10 10 CECE CCOC(=O)[C@](NCCN=[N+]=[N-])(C(F)F)C1CCC1 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CNC1CCN(Cc2cnc(SC)s2)CC1 2243832385 KBXFNYMQHYWLJW-UHFFFAOYSA-N 257.428 2.049 10 10 CECE C[C@@H]1O[C@H](C)[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)[C@H]1C 863003476 UKLJYUCDDHFTJD-DBLWCUDZSA-N 291.347 2.039 10 10 CECE CC[C@@H]1NCC[C@H]1NCc1c(O)ccc(Cl)c1F 863646296 ITVBPXJHNCRLAQ-WDEREUQCSA-N 272.751 2.415 10 10 CECE CC(C)(C)OC(=O)N1CCOC[C@H]1c1c(N)cccc1O 1953068312 VMEMMUBZCBGSON-NSHDSACASA-N 294.351 2.283 10 10 CECE CC(=O)N1CCN(Cc2cc(Cl)ccc2O)[C@H](C)C1 769447754 KWLPMHXQTNDLPB-SNVBAGLBSA-N 282.771 2.098 10 10 CECE CC(C)(C)/C=C\C(=O)OCC(=O)c1ccc(O)c(O)c1 783633237 JKXKRIXPTAHKPK-SREVYHEPSA-N 278.304 2.426 10 10 CECE Nc1ccc(OCCc2nc3ncccc3[nH]2)cc1 82556590 LTEYWDMAIKZCQJ-UHFFFAOYSA-N 254.293 2.162 10 10 CECE C/C=C/c1nnc([C@@H](N)c2ccc(N(C)C)cc2)o1 83430643 RLBXZVHGBLQLKY-IHVVCDCBSA-N 258.325 2.217 10 10 CECE Oc1cc2c(cc1O)[C@H](c1c(O)cccc1F)NCC2 83724132 NETDQZSHHXQARO-OAHLLOKOSA-N 275.279 2.178 10 10 CECE CCCOC(=O)CN1CC(C)(C)Oc2cc(CN)ccc21 74337550 WLLHCUXETQHLLM-UHFFFAOYSA-N 292.379 2.076 10 10 CECE COCC(COC)N(C)c1ccc([C@@H](C)O)c(Cl)c1 700619134 IAFMPFTUJITGNF-SNVBAGLBSA-N 287.787 2.491 10 10 CECE O=C(Nc1ccc(-n2cnnc2)cc1)c1cc(O)cs1 1138193825 QJKLTIIGGAMJJJ-UHFFFAOYSA-N 286.316 2.287 10 10 CECE C[C@H]1CCCCN(C[C@H](O)COc2ccc(N)cc2)C1 703252980 GHMFYJKUGHSIDM-ZFWWWQNUSA-N 278.396 2.131 10 10 CECE CCN(Cc1ccc(F)c(F)c1O)[C@H]1CCOC1 703583678 GUUOPRRHSAVTJS-JTQLQIEISA-N 257.280 2.281 10 10 CECE CC[C@@H](NC)c1ccc(N2CCO[C@@H](COC)C2)cc1 705785122 BNHNYWIQCGVNAG-HZPDHXFCSA-N 278.396 2.209 10 10 CECE Nc1ccc(NC(=O)CCCN2C[C@@H]3CCC[C@@H]32)cc1 706731143 JQDKQQXIHPNXMD-WFASDCNBSA-N 273.380 2.472 10 10 CECE CN1C[C@@]2(C)CN(c3ccc(CN)c(F)c3)C[C@@]2(C)C1 707086481 YKRUSMIJCCFVEV-IYBDPMFKSA-N 277.387 2.062 10 10 CECE Oc1ccc(Cl)cc1CN1C[C@H]2CC[C@H]1[C@@H]1CNC[C@@H]21 709965990 WYEFYBUSOSHEAB-KAOXEZKKSA-N 292.810 2.475 10 10 CECE CNC(=O)[C@@H](C)N(C)c1ccc(C=CC(=O)O)cc1Cl 1916239088 MGDAQWJJESONKD-SECBINFHSA-N 296.754 2.009 10 10 CECE O=C(O)C1CCC(CNCc2ccc(O)cc2O)CC1 93432206 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273.336 2.469 10 10 CECE CCOC(=O)C[C@@H](N)c1c(O)ccc2ccccc12 575439348 SCZPWTGCHRFENH-GFCCVEGCSA-N 259.305 2.498 10 10 CECE COCCN(Cc1cc(F)cc(F)c1O)[C@@H](C)COC 708383753 NPSGCCYFHXPOHX-JTQLQIEISA-N 289.322 2.154 10 10 CECE C[C@@H]1CNCCCN(c2ccc(CN(C)C)cc2)C1 689500522 LTACPQOKSUSTIQ-CQSZACIVSA-N 261.413 2.184 10 10 CECE C[C@@H]1CC[C@H](N(C)c2ccc3c(c2)NC(=O)[C@@H]3N)CS1 689516767 BFPMHAXAPOWYAT-OLUVUFQESA-N 291.420 2.359 10 10 CECE c1cc2c(cc1N(CC1CCC1)C1CNC1)COCC2 2162639435 FCNNYPOBQNKKJL-UHFFFAOYSA-N 272.392 2.338 10 10 CECE CC[C@@H](CN[C@@H](C)c1cc(OC)ccc1O)N(C)C 388653952 ASWUQAXIXDRYBH-RYUDHWBXSA-N 266.385 2.392 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC[C@@](C)(CO)C2)c1O 381753910 NUURBFQPUKLYQO-OAHLLOKOSA-N 297.782 2.453 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3CC34CC(N)C4)ccc21 2163062341 LVFIGSVSRFPKPD-HTUOJYHCSA-N 272.392 2.230 10 10 CECE CN1CCc2cc([C@H](NN)[C@@H]3C[C@]34CC4(F)F)ccc21 2172030437 AKRVJRZMFZTSIM-UBHSHLNASA-N 279.334 2.229 10 10 CECE Nc1ccc(CS(=O)(=O)N2C[C@H]3CCCC[C@@H]3C2)cc1 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[N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCCC12CCC2 394846368 CKFAIAGQXHJYFM-GFCCVEGCSA-N 252.318 2.454 10 10 CECE CN(c1ccc(CN)cc1F)[C@@H]1COC(C)(C)C1 396547050 RAZFVCPHJGPYJW-NSHDSACASA-N 252.333 2.288 10 10 CECE Oc1ccc(CN[C@@H]2CCCN(C3CCC3)C2)c(O)c1 2173055633 VLVWZAHVUVUEAL-CYBMUJFWSA-N 276.380 2.204 10 10 CECE CCNCc1ccc(N2CCC3(CC(O)C3)C2)c(C)c1 2174067068 JGASLCYUYRGPGA-UHFFFAOYSA-N 274.408 2.456 10 10 CECE C[C@H](N[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)O)c1cc(F)ccc1O 2174236055 WKVYPWXFOGQDBE-RCGNDRPLSA-N 279.311 2.291 10 10 CECE Cc1cnn([C@H](C)c2cc([N+](=O)[O-])ccc2O)c1O 2070221558 VSUZPZFENUWPPO-MRVPVSSYSA-N 263.253 2.120 10 10 CECE CCN1CCc2cc(C3(N)C[C@H]4C=C[C@@H](C3)O4)ccc21 2175072468 AFIXWKZIRYCOCB-FKEKPDDDSA-N 270.376 2.340 10 10 CECE CCC[C@@H](O)CN(C)Cc1ccc(N(C)C)cc1 1252789822 OGWNLYZSILNCQW-OAHLLOKOSA-N 250.386 2.345 10 10 CECE CCNC(=O)[C@H]1CCCN1c1ccc([C@H](C)N)cc1Cl 2169607301 MGYOZJHZHWVESA-IINYFYTJSA-N 295.814 2.465 10 10 CECE Oc1cccc(F)c1CN1CC[C@@H]2OCC[C@@H]2C1 1137838676 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10 CECE CN1CCCc2cc([C@H](N)[C@@H]3CNC(C)(C)C3)ccc21 2193395240 PPPUAMYTTWPANH-HOCLYGCPSA-N 273.424 2.457 10 10 CECE CC1(C)C[C@H](COc2ccc(N3CCNCC3)cc2)O1 2189587789 YVEBZMUDDDMDST-OAHLLOKOSA-N 276.380 2.043 10 10 CECE COc1ccc(N2C[C@H](N)CC[C@H]2C)cc1OC 2044350116 ZYWCISZXUINVJM-GHMZBOCLSA-N 250.342 2.020 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@@H](CO)C3(C)C)ccc21 2184721206 JQWHFYSLFNTTSN-XJKSGUPXSA-N 274.408 2.491 10 10 CECE CN1CCC2(CC1)CN(c1ccc3c(c1)CC[C@@H]3N)C2 2184739576 IYNCQQQKJXHZNV-INIZCTEOSA-N 271.408 2.165 10 10 CECE Cn1c(Cl)cnc1C(=O)CCc1ccc(N)cc1 2047442955 XVPHRJFFIJLMPF-UHFFFAOYSA-N 263.728 2.471 10 10 CECE O=C(O)C12CCC(NCc3c(O)cccc3F)(CC1)C2 2184953078 ICAMWWQRWCQQGW-UHFFFAOYSA-N 279.311 2.408 10 10 CECE Cn1ncc([C@H](O)Cc2ccc(N)cc2)c1C(C)(F)F 2190706082 SBPZADTYAGJOJH-GFCCVEGCSA-N 281.306 2.390 10 10 CECE CN1CCc2cc([C@H](N)[C@](C)(O)C3CC=CC3)ccc21 2190863037 YIKUPZXXWJHEJL-DLBZAZTESA-N 272.392 2.396 10 10 CECE C[C@H](N[C@H]1[C@H]2OCCC[C@@H]21)c1ccc(F)cc1O 2056356734 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Nc1ccc(CNC[C@H]2CC23CCC(O)CC3)cc1 2101305021 XSHWGUAFOICVIA-IUDNXUCKSA-N 260.381 2.300 10 10 CECE NCc1cc(F)c(N2Cc3ncsc3C2)c(F)c1 2081618059 BUVCUDQPBVWCFZ-UHFFFAOYSA-N 267.304 2.400 10 10 CECE Cc1ccc(CN(CCN(C)C)C(C)C)c(O)c1 2084087035 ZBENOWRZPJTPJE-UHFFFAOYSA-N 250.386 2.473 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1nc(C)sc1C 2104266742 PVSXDVUCHLGKDG-UONOGXRCSA-N 278.377 2.460 10 10 CECE COc1cccc(O)c1CNCc1ccc(C)nc1 2104433308 DTNWPSRKWIMDQO-UHFFFAOYSA-N 258.321 2.394 10 10 CECE Cc1cccc(O)c1CN1C[C@H](C(=O)O)CC[C@H]1C 2104506950 GMXXYQWLONPHLQ-VXGBXAGGSA-N 263.337 2.386 10 10 CECE C[C@@](CO)(NCc1ccc2c(c1)CCCO2)C(F)F 2105104615 NRNBUPYDVORVSH-AWEZNQCLSA-N 271.307 2.117 10 10 CECE NC[C@@]12CC[C@@H]1CCCN2c1ccc2c(c1)CCO2 2106393364 YMUVZFCHYJQZRA-BBRMVZONSA-N 258.365 2.329 10 10 CECE COC[C@@H]1CC[C@](N)(c2ccc3c(c2)CCN3C)C1 2106791595 UEMMCRMZHNFRJQ-MLGOLLRUSA-N 260.381 2.279 10 10 CECE C[C@](N)(C(F)F)[C@@H](O)c1ccc(N2CCCC2)cc1 2106823033 LDRPGYVLVLVOTI-GXTWGEPZSA-N 270.323 2.303 10 10 CECE C[C@H](O)c1ccc(N(C)CCN(C)C2CC2)c(F)c1 2089555557 HOKSQYBUVBXCBI-NSHDSACASA-N 266.360 2.409 10 10 CECE C[C@@H](c1ccccc1O)N(C)S(=O)(=O)c1cc[nH]c1 2089619086 UJEUHFRBXPNBQN-JTQLQIEISA-N 280.349 2.102 10 10 CECE CCOc1cccc(CN(CCN)CC(C)C)c1O 2090733304 XMODGSHAGRNYGK-UHFFFAOYSA-N 266.385 2.208 10 10 CECE CN1CCc2cc([C@@H]3N[C@H](CC4CC4)CO3)ccc21 2090430010 JXBGAISUOHCDIY-GDBMZVCRSA-N 258.365 2.466 10 10 CECE CCN1CCc2cc([C@](C)(O)CCCNC)ccc21 2111818444 WDRMWOJVOKSDDU-MRXNPFEDSA-N 262.397 2.276 10 10 CECE CCCNCc1ccc(N2CC(CCO)C2)c(F)c1 2095989354 RJAWICOKFVWTHV-UHFFFAOYSA-N 266.360 2.144 10 10 CECE CCN[C@H]1CCCN(c2ccc3c(c2)COCC3)C1 2096488782 VYMUNMMSHCVYSG-HNNXBMFYSA-N 260.381 2.338 10 10 CECE CCc1nnsc1C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2099337626 YGPXTHFPFBGQCY-QMMMGPOBSA-N 280.357 2.406 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c(C)c2)C[C@H]1N(C)C 2114125861 YNGOLJHKIMBEMB-CZUORRHYSA-N 262.397 2.264 10 10 CECE CCOC1CN(c2ccc(CNC(C)C)c(OC)c2)C1 2204552865 BGCOBNZWNCAEJH-UHFFFAOYSA-N 278.396 2.418 10 10 CECE COc1cc(N(C)[C@@H]2CCCCC[C@@H]2O)ccc1CO 2204551308 RLHSPVOLCBRYDS-CABCVRRESA-N 279.380 2.317 10 10 CECE CN1C[C@H]2[C@@H](NCc3ccc(F)cc3O)CCC[C@H]2C1 2204736152 OSFZVUCZNWTSFD-CFVMTHIKSA-N 278.371 2.351 10 10 CECE CCN(c1ccc(OC)c2c1CCC2)[C@@H]1CCNC1 2269114594 NCOKSKJKCGIETA-GFCCVEGCSA-N 260.381 2.372 10 10 CECE Cc1ncc2c(n1)CN(c1ccc([C@H](C)O)c(O)c1)C2 2206207093 CCUHUEYBAVXCOB-VIFPVBQESA-N 271.320 2.064 10 10 CECE [N-]=[N+]=NCCCCN1CC(OC(F)(F)CF)C1 2215949473 LEPPSZVLQGHCAT-UHFFFAOYSA-N 252.240 2.340 10 10 CECE Cc1cc(N(C)Cc2nccn2C)ccc1[C@@H](C)O 2269687647 KIUCVZKDZQNYOR-GFCCVEGCSA-N 259.353 2.418 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H]2COC3CC2C3)c1 2208483582 ZZPLLROMUXKYQK-WDBLDGLGSA-N 277.364 2.476 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC=C[C@H](O)C2)cc1 2231459429 BOVLXCOOZRYVNH-CJNGLKHVSA-N 260.381 2.312 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H](CO)C2)c(C)c1 2232033106 JUUCKOVDAWHVEP-KGLIPLIRSA-N 262.397 2.484 10 10 CECE COc1cc(C)c(N2CC[C@@](C)(O)[C@](C)(O)C2)cc1C 2235105109 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10 10 CECE OCc1ccc(N2C[C@H](O)C[C@H]3CCCC[C@H]32)cc1 2264944477 IOZHSXYIQNKNLS-FVQBIDKESA-N 261.365 2.309 10 10 CECE C[C@H](NCc1ccc(O)c(O)c1O)[C@H]1CC12CCC2 2268409087 AQWAEGJOYSAMHC-GXSJLCMTSA-N 263.337 2.472 10 10 CECE CSc1ncc(CNC(=O)C[C@H]2CC[C@@H](N)CC2)s1 2269089080 YZSFSABILRHKIO-AOOOYVTPSA-N 299.465 2.389 10 10 CECE CSc1ncc(CNC(=O)[C@]2(C)CCCC[C@@H]2N)s1 2269096346 SNGFYVAGPOIULS-GXFFZTMASA-N 299.465 2.389 10 10 CECE Cc1cc(N2CCS[C@@H](CCO)C2)ccc1[C@H](C)O 2269676596 LUERZXMIZFSXCT-JSGCOSHPSA-N 281.421 2.353 10 10 CECE Cc1cc(N(C)CCn2cccn2)ccc1[C@@H](C)N 2269657647 BWZFWLBSTAMQJI-CYBMUJFWSA-N 258.369 2.348 10 10 CECE Cc1cc(N2CC(O)(C(F)(F)F)C2)ccc1[C@@H](C)O 2269681526 NJFLKNSIOOPNJW-SECBINFHSA-N 275.270 2.162 10 10 CECE Cc1cc(N2C[C@H](O)C3(CCC3)C2)ccc1[C@@H](C)O 2269680013 WJIAYMYZKHCPED-DOMZBBRYSA-N 261.365 2.400 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@H](F)C2)cc1C 2269660415 KZMFXMXFWUJNBN-DFBGVHRSSA-N 266.360 2.185 10 10 CECE CN(C)c1ccc(CN[C@]2(CO)C[C@H]3CC[C@H]2C3)cc1 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10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H]2CC(=O)N(C)C2)cc1 2188491165 KNYMGUOEMIKZAA-IUODEOHRSA-N 275.396 2.024 10 10 CECE CNCc1ccc(N(C)Cc2cncn2C)cc1Cl 2093346715 XXLIIJUGXFICNF-UHFFFAOYSA-N 278.787 2.429 10 10 CECE C[C@H]1CC[C@H](N(C)C(=O)c2cc(O)c(O)c(O)c2)CS1 2188868004 KNLXJDDKGOHUER-WPRPVWTQSA-N 297.376 2.160 10 10 CECE COc1cc2c(cc1OC)N([C@H](C)[C@H](C)C(=O)O)CC2 2195425323 DXXYJBIFOAOELC-VHSXEESVSA-N 279.336 2.176 10 10 CECE Cc1nc(Cl)c(C)c(=NCc2ccc(N)cc2)[nH]1 2044037362 AUZYOBOWMCCQLS-UHFFFAOYSA-N 262.744 2.363 10 10 CECE CCN(Cc1nc(C)no1)c1ccc2c(c1)CC[C@H]2N 2184718774 IVWMMIJVBIIQFG-CQSZACIVSA-N 272.352 2.351 10 10 CECE O[C@@H]1CCc2cc(N3CCO[C@@H](C(F)(F)F)C3)ccc21 2184729719 MJYBIRPIDPWJMK-CHWSQXEVSA-N 287.281 2.434 10 10 CECE CNC[C@H](C)N(C)[C@H](C)c1cc(OC)ccc1O 2049152589 DPQMBDIJSYYIJP-WDEREUQCSA-N 252.358 2.002 10 10 CECE CN1CC[C@H]2[C@@H](CCCN2CCCCN=[N+]=[N-])C1 2051522428 FBHYMIXCCVBYLD-STQMWFEESA-N 251.378 2.493 10 10 CECE Nc1ccc(OCCN2CCCC[C@H]2CF)cc1 2051806403 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2.225 10 10 CECE CN(C[C@]12CCOC[C@@H]1C2)c1ccc2c(c1)CC[C@@H]2N 2194551106 MBEWWPUFSMJFAB-RRQGHBQHSA-N 272.392 2.495 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](O)CC3(CC3)C2)c(F)c1 2194521083 WNQAQXNNSLWTIL-ONGXEEELSA-N 283.318 2.369 10 10 CECE Nc1ccc(NC(=O)NCC2CCC(CO)CC2)cc1 2191503319 QEPAAPFZYQYJDS-UHFFFAOYSA-N 277.368 2.189 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H]1C1CC1 2071806982 XLJYAORJZMGENG-JQWIXIFHSA-N 252.318 2.008 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1S(=O)(=O)N[C@H](C)c1ccccc1O 2072485406 GTGUNXYSHICUPE-COMAGPEQSA-N 269.366 2.027 10 10 CECE CCCCN(CC(N)=O)c1c(F)cc([C@@H](C)N)cc1F 2194693070 XIBKLJQUOWKBKJ-SECBINFHSA-N 285.338 2.076 10 10 CECE CO[C@@H]1CCN([C@@H](C)c2cc(C)ccc2O)C[C@H]1OC 2199566418 JETIYBRQMJDIOJ-APHBMKBZSA-N 279.380 2.497 10 10 CECE Cc1cc(N2CCC[C@]3(C)COC[C@H]23)ccc1CO 2103587810 GNHMCAWPEQSWTL-JKSUJKDBSA-N 261.365 2.493 10 10 CECE CC1(CN)CCN(Cc2ccc(F)cc2O)CC1 2084071624 IBYGATSICXPLJG-UHFFFAOYSA-N 252.333 2.092 10 10 CECE CCC[C@@H](C(=O)O)N(C)Cc1c(O)cccc1OC 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CN[C@H](c1ccccc1O)c1cnc2ccccn12 2107776105 KZAFVSXGZSACHZ-OAHLLOKOSA-N 253.305 2.349 10 10 CECE CN(C)c1ccc([C@H](CN)N2CC[C@@H]2C2CC2)cc1 2088633208 KNRSKTQEHGWYJP-CVEARBPZSA-N 259.397 2.237 10 10 CECE CNCc1ccc(N2CC[C@H]3COCC[C@H]32)c(F)c1 2088749471 BFXMTSKNUQLASG-GXTWGEPZSA-N 264.344 2.160 10 10 CECE CO[C@]1([C@H](NN)c2ccccc2O)CCC[C@@H](C)C1 2090036899 HWRJTFCSIVWNKK-KCPJHIHWSA-N 264.369 2.492 10 10 CECE CCCN[C@H](CCn1cncn1)c1ccccc1O 2090042478 MEBHUQPAEYBLJP-CYBMUJFWSA-N 260.341 2.115 10 10 CECE Cc1nc([C@@](C)(O)[C@H](N)c2ccccc2O)sc1C 2091860347 UJKLRJWSVZBSMC-OCCSQVGLSA-N 278.377 2.373 10 10 CECE CC(C)NCc1ccc(N2CCN(C)[C@@H]3C[C@@H]32)cc1 2112078573 NNJGWQHIGHKDGB-CVEARBPZSA-N 259.397 2.077 10 10 CECE CCN[C@H](c1ccccc1O)[C@](C)(O)c1cnsc1 2092405253 FABCZUVLLWIGAM-ZIAGYGMSSA-N 278.377 2.407 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H]2CO)cc1C(F)(F)F 2092536314 MWBWWHGFBNBKGK-WPRPVWTQSA-N 275.270 2.330 10 10 CECE Cc1cc(=NCCc2ccc(O)c(O)c2)c(C)c[nH]1 2092602417 QNKNYZVGPFYPNW-UHFFFAOYSA-N 258.321 2.186 10 10 CECE CO[C@@H]1CN(c2ccc(CN)c(F)c2F)CC1(C)C 2093326759 IJPOXBTYFWTXKL-LLVKDONJSA-N 270.323 2.285 10 10 CECE CNCc1ccc(N2CC[C@](C)(N(C)C)C2)c(F)c1 2093541939 BSEDQAZZOIJCKZ-HNNXBMFYSA-N 265.376 2.076 10 10 CECE Cc1cnn(C)c1[C@@H](C)NCc1cc(F)ccc1O 2094115784 MLPVRTWXQLXPGL-SNVBAGLBSA-N 263.316 2.424 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)C3)c(F)c1 2098694395 KVFNJXHVGJHRLC-ITGUQSILSA-N 264.344 2.037 10 10 CECE CC(C)[C@@H](C)NC(=O)CN1CCC[C@@H](N=[N+]=[N-])CC1 2099330506 XNXDCVZSWZRQMQ-VXGBXAGGSA-N 267.377 2.312 10 10 CECE CCCCOC[C@H](O)CN1CCC[C@@H](N=[N+]=[N-])CC1 2099337799 ADIBWXLAYGJDKV-CHWSQXEVSA-N 270.377 2.329 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](O)CCC2(C)C)cc1O 2099877565 CWOKMOMMAMGHCG-CMPLNLGQSA-N 265.353 2.185 10 10 CECE CCC(CC)N1CC(NCc2cccc(O)c2O)C1 2113002529 YJOCECHQSQPVCW-UHFFFAOYSA-N 264.369 2.060 10 10 CECE COc1cccc(O)c1CN1C[C@H](C)CC[C@@H]1C(=O)O 2201058304 ARCBVRJQMGBHSC-ZYHUDNBSSA-N 279.336 2.086 10 10 CECE O=C(O)[C@@H]1[C@H]2C[C@@H](NCc3ccc(Cl)cc3O)C[C@H]21 2112935974 YQMATJKYOLSVCG-DNSLJTBWSA-N 281.739 2.244 10 10 CECE CNCc1ccc(N(C)[C@H]2CCN(C)C[C@H]2C)cc1 2113999328 OPNOKEOFEOAOBX-CJNGLKHVSA-N 261.413 2.182 10 10 CECE CC(C)[C@@H]1CN(C)CCN1c1ccc(CO)cc1F 2114159316 KBCCZCVFYUGHMX-HNNXBMFYSA-N 266.360 2.094 10 10 CECE COc1cc(Cl)cc(CN(C)c2cnn(C)c2)c1O 2114354912 KUKMAKVZWLIKJI-UHFFFAOYSA-N 281.743 2.424 10 10 CECE CC[C@@H](c1ccccc1O)N(CC)[C@@H]1CCNC1=O 2114764623 OTCNXBCGSSHRQW-QWHCGFSZSA-N 262.353 2.054 10 10 CECE Cc1c(CN2C[C@@H](C)[C@@H]2C(=O)O)n(C)c2ccccc12 2201103754 DCOJUJYWGAFWPW-MEBBXXQBSA-N 272.348 2.392 10 10 CECE C[C@H](c1ccc(Cl)cc1O)N1CCN2CCOC[C@H]2C1 2203339436 LCZJYTPQVWTJHO-DGCLKSJQSA-N 296.798 2.123 10 10 CECE C[C@H](c1ccc(Cl)cc1O)N1C[C@H]2OC(=O)N(C)[C@@H]2C1 2203345975 IAUOHIDNYMMSGG-XTWCZFFVSA-N 296.754 2.241 10 10 CECE C[C@H]([C@@H]1C[C@@H]2CCO[C@H]12)N(C)Cc1cc(N)ccc1O 2203749776 YDPTTYVSDDBIPU-AZLWOZFGSA-N 276.380 2.220 10 10 CECE COc1cc(N(C)[C@@H](C)CO)ccc1CNCC(C)C 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CN1CCSC[C@H]1[C@H](N)c1ccc(N2CCCC2)cc1 2163095400 SBPFVVNRRCQOQU-JKSUJKDBSA-N 291.464 2.334 10 10 CECE C[C@H](NC[C@@H]1C[C@H]2OCC[C@H]2O1)c1ccc(F)cc1O 2163199266 IAMNLKQQEUJLPX-YZENIEGJSA-N 281.327 2.128 10 10 CECE CC(C)CNCc1ccc(N2CC(C[S@@](C)=O)C2)cc1 2166647683 BSBASMASGKQDRA-HXUWFJFHSA-N 294.464 2.247 10 10 CECE CC[C@H]1CCNC[C@@]1(O)c1ccc2c(c1)CCCN2C 2163643733 UHQNEEIHZHCSNI-YOEHRIQHSA-N 274.408 2.276 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@H]2CC3(CC3)CO2)cc1O 2166393905 KCEBAFWWUPTNSK-WCQYABFASA-N 276.380 2.417 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)c1ncc(Cl)n1C 2164081748 VJSMLRLBSAASOO-AWEZNQCLSA-N 290.798 2.375 10 10 CECE CC1(C)CCCN(c2ccc(CN)cc2F)[C@H]1CO 2129320133 HCWLZAQGNXWCGA-AWEZNQCLSA-N 266.360 2.272 10 10 CECE Cc1ccc(O)c(CNC[C@H]2CC[C@H](C(N)=O)CC2)c1 817412016 BEWFLNZMSFADKR-JOCQHMNTSA-N 276.380 2.082 10 10 CECE COC(=O)c1cc(/C=C\C(=O)O)cc2c(O)csc12 725409901 ZJYMDTJGUPAREX-IHWYPQMZSA-N 278.285 2.491 10 10 CECE Cc1cnc(CNCc2ccc(O)cc2O)c(C)c1 724045376 QKAGPGPJEZAOPL-UHFFFAOYSA-N 258.321 2.399 10 10 CECE COC(=O)c1ccc2c(O)c(CC(=O)O)sc2c1 725308912 KDGRERPRNVLINW-UHFFFAOYSA-N 266.274 2.021 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NCC[C@H]1CCCCO1 588413635 QOQDAVNOLCQEHJ-SCXUMTSISA-N 291.347 2.186 10 10 CECE COc1cc(O)c(CN2CC3(CCOCC3)C2)cc1OC 839141320 PLEYEMCLFPBOFH-UHFFFAOYSA-N 293.363 2.022 10 10 CECE CCC(C)(C)C(=O)C(=O)N1Cc2cccc(O)c2C1 913726649 UOACZPSHIBKYCZ-UHFFFAOYSA-N 261.321 2.240 10 10 CECE CC(=O)c1cc(F)cc(CN(CCO)C(C)(C)C)c1O 690030048 CEXVAXJMFBJSMU-UHFFFAOYSA-N 283.343 2.327 10 10 CECE CCO[C@@H](COC(=O)/C=C/c1ccc(O)c(O)c1)C1CC1 859601202 RNPQUDLAIRNSQC-LWUPOJRFSA-N 292.331 2.469 10 10 CECE CC1(C)COCC[C@]1(C)NCc1ccc(O)c(O)c1 1895876585 WAEBUIOHDZQSDQ-HNNXBMFYSA-N 265.353 2.393 10 10 CECE CC[C@H](C)CCNC(=O)[C@H]1CNc2ccccc2N1 696217451 OIEHOPDJIHMZBJ-SMDDNHRTSA-N 261.369 2.445 10 10 CECE COC[C@H](CCNCc1c(O)cc(C)cc1Cl)OC 850345745 JKQHLOMVSUNHGW-NSHDSACASA-N 287.787 2.495 10 10 CECE CC[C@H](N[C@H]1C[C@H](C(N)=O)C1)c1cccc(Cl)c1O 858494170 FIIBALDYUBPKLV-AUTRQRHGSA-N 282.771 2.350 10 10 CECE COCCNC[C@@H]1CCN1c1ccc(OC)c(Cl)c1 696344505 BCZIOXSIIVXMLW-LBPRGKRZSA-N 284.787 2.163 10 10 CECE CCC1CN(c2cc3c(cc2Cl)[C@@H](N)C(=O)N3)C1 697489041 PZWRYWOSKKXTIT-GFCCVEGCSA-N 265.744 2.138 10 10 CECE Nc1ccc(-n2nncc2-c2ccc3c(c2)OCCO3)cc1 62428828 OTKIMZANTYSOEY-UHFFFAOYSA-N 294.314 2.288 10 10 CECE COc1ccc(O)c(CN[C@]23CCC[C@H]2OCC3)c1 872262906 FHKCSVDVQRRIAI-CABCVRRESA-N 263.337 2.202 10 10 CECE CC(C)(C)OC(=O)N[C@]12C[C@@H]1CN(c1ccc(N)cc1)C2 1955944014 WSSJUIZAMDPPLX-BZNIZROVSA-N 289.379 2.372 10 10 CECE COc1ccc2c(c1)[C@@H](CN)N(c1ccc3c(c1)OCO3)C2 82700978 HXFYZWIULATTHM-OAHLLOKOSA-N 298.342 2.444 10 10 CECE CCCCCCNC(=O)[C@H](N)c1ccccc1O 83383124 ULNVHDVNGPKZDJ-CYBMUJFWSA-N 250.342 2.089 10 10 CECE Nc1cc(F)cc2c1CCN[C@H]2c1cc(F)ccc1O 83628142 NKEQTIWMOWIERE-OAHLLOKOSA-N 276.286 2.488 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(N)=O)C1CCCCC1 90260611 QXUOYZGIQHQEQW-GFCCVEGCSA-N 253.350 2.101 10 10 CECE Cc1nnc(C[C@H](N)c2ccc(N(C)C)cc2)s1 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C[C@@H](N)c1ccc(N2CCC(C(N)=O)CC2)cc1Cl 78902449 ODIXWEXRPLMPKD-SECBINFHSA-N 281.787 2.061 10 10 CECE Nc1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1 688327160 BDOYCCGYRLQWGZ-GFCCVEGCSA-N 261.325 2.102 10 10 CECE CN(C)C[C@@H]1CCN(c2ccc(CO)c(Cl)c2)C1 688535461 WKNRMANVTSYUKI-NSHDSACASA-N 268.788 2.220 10 10 CECE COc1ccc([C@H](O)CCc2ccc(N)cc2)cn1 695796996 JMSVVWPDGQICAP-CQSZACIVSA-N 258.321 2.339 10 10 CECE C[C@@H]1CC[C@@H](C)N(CC(=O)Nc2ccc(N)cc2)C1 88699690 UJQYISURTJDSCN-VXGBXAGGSA-N 261.369 2.328 10 10 CECE O=C(NCc1cc(O)ccc1O)C1CC2(CCC2)C1 1153886102 WJRUAPVWFRBKSL-UHFFFAOYSA-N 261.321 2.294 10 10 CECE COc1ccc(N2CCN(CC(=O)C(C)C)CC2)cc1 92998848 ZKVLFBBWXDMGNR-UHFFFAOYSA-N 276.380 2.042 10 10 CECE CCN(CC1CCNCC1)[C@@H](C)c1ccc(O)cc1O 94011388 XLRNPTXJBULLNB-LBPRGKRZSA-N 278.396 2.480 10 10 CECE C[C@]1(C(=O)N(Cc2ccc(N)cc2)C2CC2)CCCO1 94786525 BWQRGUUOUYEYIA-MRXNPFEDSA-N 274.364 2.329 10 10 CECE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cccnn1 1160598833 ARIJEICASOUFIG-UHFFFAOYSA-N 298.129 2.419 10 10 CECE 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10 CECE Cc1ccc(O)c(CN2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c1 824653790 IASOXGULSFDJQS-NUEKZKHPSA-N 291.391 2.062 10 10 CECE COC(=O)C[C@@](C)(N)c1cc2ccccc2cc1O 1951845865 VZPAVQPECHLYIQ-OAHLLOKOSA-N 259.305 2.282 10 10 CECE Nc1ccc(CN2C3CCC2(CC(=O)O)CC3)cc1 1891832568 XZLUDIPPTCQHPE-UHFFFAOYSA-N 260.337 2.241 10 10 CECE Cc1cc(N(C)C)ccc1CN1CC[C@@H]2CNC[C@@H]2CC1 843125826 AKNFRZCIDUJQKP-IYBDPMFKSA-N 287.451 2.492 10 10 CECE Cc1cc(O)c(CNCCOC[C@H]2CCOC2)c(Cl)c1 840898964 YTIBSQZSDJZAEW-LBPRGKRZSA-N 299.798 2.497 10 10 CECE Oc1c(F)cccc1CN1CCC[C@@H]([C@@H]2CCCN2)C1 843046344 XCUASCRFQZALRG-DOMZBBRYSA-N 278.371 2.495 10 10 CECE COc1ccc(N(C)C[C@H](O)C(C)C)c(OC)c1C 2278058244 APKOGUVEZKOSLO-ZDUSSCGKSA-N 267.369 2.465 10 10 CECE NC[C@@H](NCc1cc(Cl)ccc1O)C(F)(F)F 848716057 SNLHITAPLZAUTO-SECBINFHSA-N 268.666 2.025 10 10 CECE C[C@@H]1O[C@H](OCc2ccccc2)C[C@H](N=[N+]=[N-])[C@H]1N 687769792 ADJKCJHUIKSBDQ-BQUFFADESA-N 262.313 2.344 10 10 CECE CN1CC[C@@H](N)[C@@H]1c1cc(Cl)cc(Cl)c1O 1952222588 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2.160 10 10 CECE Cc1nccn1[C@@H](C)CNCc1ccc(F)cc1O 2139882757 RJAAYCVSQNFRNH-JTQLQIEISA-N 263.316 2.387 10 10 CECE Cc1ccc(O)c([C@@H](C)NC2CCS(=O)CC2)c1 157951117 WJCUMANKYQSDOU-VQQRXRCHSA-N 267.394 2.262 10 10 CECE CC[C@](C)(O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 154459250 XDAOSZPGRXDFBU-PBHICJAKSA-N 292.423 2.335 10 10 CECE CCn1ncc(Cl)c1/C=C1/SC(S)=NC1=O 2573463 RMNYJLRNSINPHS-XVNBXDOJSA-N 273.770 2.457 10 10 CECE CC[C@@H](CO)CN(C)c1ccc2c(c1)CCC(=O)N2 258883058 CHWBWAFBWAVWLJ-LLVKDONJSA-N 262.353 2.026 10 10 CECE CCCOc1ccc(N2CC[C@H](CNC[C@H](C)O)C2)cc1 250220937 VYRKVTZRIPHMRE-LSDHHAIUSA-N 292.423 2.272 10 10 CECE COc1cc(F)c(N(C)[C@@H]2CCC[C@@H]2N)cc1F 259053904 PYLCMRVTACCSRW-WDEREUQCSA-N 256.296 2.289 10 10 CECE Oc1cccc2c1[C@H](N[C@H]1CC3(CCC3)[C@H]1O)CC2 2140680825 GPFNWGUNDMMHPE-XUJVJEKNSA-N 259.349 2.273 10 10 CECE CO[C@H](CN[C@H](C)c1cc(F)ccc1O)[C@H]1CCOC1 850485099 XESFUPZXZCFOKE-JRPNMDOOSA-N 283.343 2.233 10 10 CECE COc1ccc(O)c(CN(C[C@@H]2CCCN2)C(C)C)c1 234965304 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2.079 10 10 CECE O=[N+]([O-])c1ncccc1NCc1c(O)cccc1O 1612969741 LXHZQYKDXHXYCV-UHFFFAOYSA-N 261.237 2.013 10 10 CECE Cc1nc(Cl)cc(NCc2c(O)cccc2O)n1 1472887041 KMNMRNNOMVVTCX-UHFFFAOYSA-N 265.700 2.462 10 10 CECE CN(C(=O)Cc1ccc(O)c(O)c1)C(C1CC1)C1CC1 1626176140 YVLGDRDSZCXIMD-UHFFFAOYSA-N 275.348 2.287 10 10 CECE Nc1cc(Cl)ccc1C(=O)NCc1ccc(O)c(O)c1 1631438418 DZUHWFUUQRYEHK-UHFFFAOYSA-N 292.722 2.263 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCSC[C@@H]1C(=O)O 2136340878 PUFYKOUPKPGKKS-LDYMZIIASA-N 285.340 2.094 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccc(Cl)nc1F 1635847955 XTACNPSTKOSNFK-UHFFFAOYSA-N 296.685 2.215 10 10 CECE COc1ccc([C@H](C)N2C[C@@H](N(C)C)[C@H](C)C2)c(O)c1 228120560 KZJMOQPSRUXXHV-TYNCELHUSA-N 278.396 2.344 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@@H](O)C3(C)C)ccc21 2136628693 DZGRRVABEBHINM-HUUCEWRRSA-N 260.381 2.243 10 10 CECE CC1(C)C[C@H](N)CN1Cc1c(O)cccc1Cl 1925245827 GXCSHVCJXPEKNG-VIFPVBQESA-N 254.761 2.357 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H](N)CC1(C)C 1925255962 FVZVLLYPAWDITB-GXSJLCMTSA-N 252.333 2.404 10 10 CECE CCNCc1ccc(N2C[C@H](O)CC3(CC3)C2)c(C)c1 1926434120 IOJGYYXFQYWXEW-OAHLLOKOSA-N 274.408 2.456 10 10 CECE C[C@H](NCC(=O)Nc1ccccn1)c1ccccc1O 1659815434 JFMYLUACRVBBOF-NSHDSACASA-N 271.320 2.077 10 10 CECE CC[C@@]12CC[C@@](C(=O)N3CC[C@H](N=[N+]=[N-])C3)(CO1)C2 2137180231 ZIHZCCVNSZIEOJ-DRZSPHRISA-N 264.329 2.247 10 10 CECE CC(=O)c1ccc(NC(=O)NCc2ccccc2O)nc1 1660644291 BBEFENOIXJWKMP-UHFFFAOYSA-N 285.303 2.312 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)c1ccn(C)n1 231890489 FDZFEQVATMSORA-UHFFFAOYSA-N 272.352 2.053 10 10 CECE CNCc1ccc(OC)c(CN(CCOC)C(C)C)c1 122981416 POCOCZBMXXZPRQ-UHFFFAOYSA-N 280.412 2.271 10 10 CECE CCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCC1 5098052 ABFMIJKPWJHNBQ-MRXNPFEDSA-N 289.423 2.416 10 10 CECE CC(C)(C)[C@@]1(C)NC(=O)N(c2ccc(N)cc2)C1=O 2139101771 KWIFIWDBKZTYQR-AWEZNQCLSA-N 261.325 2.130 10 10 CECE CC[C@H](CSC)N(C)CC(=O)c1ccc(O)c(O)c1 167792244 VWBGLSJSSUSAKJ-LLVKDONJSA-N 283.393 2.354 10 10 CECE C[C@@H](NCCCN(C)C)c1ccc(N2CCOCC2)cc1 151898848 QAELDMDVHRNACU-OAHLLOKOSA-N 291.439 2.126 10 10 CECE Nc1ccc(OCCC(=O)N2C[C@H]3CCC[C@@H]3C2)cc1 157920125 RUUFCLWXBSQOGB-CHWSQXEVSA-N 274.364 2.296 10 10 CECE O=C1c2ccc(O)cc2OC[C@@H]1Cc1ccc(O)c(O)c1 13481927 KCUXSQJYIWEGRG-JTQLQIEISA-N 286.283 2.237 10 10 CECE biogenic,in-vitro CCN(C[C@@H]1CCCN1)[C@@H](C)c1c(O)cccc1O 233518922 KTTHZMZNQXFGDF-RYUDHWBXSA-N 264.369 2.233 10 10 CECE Cc1cc(N(C)c2ccc3c(c2)CC(=O)N3)ncc1N 258912481 VNXSLEHRBAWOTC-UHFFFAOYSA-N 268.320 2.235 10 10 CECE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@]1(N)c1ccccc1O 1933871767 MSBJRJROJRVVBC-BDJLRTHQSA-N 292.379 2.433 10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)[C@](C)(N)c1ccccc1O 1933869087 IXYBZSPRGWWHRY-BMIGLBTASA-N 280.368 2.479 10 10 CECE COc1cc(N2CCC(C)(OC)CC2)ccc1CO 2139712161 SSPQTBCRCWZZLH-UHFFFAOYSA-N 265.353 2.193 10 10 CECE Cc1cc(=NCc2cccc(C)c2O)c(N)c(C)[nH]1 2139744483 XWWYYBKZJVAAFV-UHFFFAOYSA-N 257.337 2.329 10 10 CECE CN(C[C@@H]1CCCCO1)c1ccc(CN)c(F)c1F 234271858 RMYFIFNSIICPCH-NSHDSACASA-N 270.323 2.429 10 10 CECE Cc1cccc(CN2CCN3CCCC[C@@H]3C2)c1O 124576650 MBVGRPONJFNYSP-OAHLLOKOSA-N 260.381 2.371 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@]2(C)CCO)c(F)c1 2140573104 SPPAIOHMKAGNLU-YMTOWFKASA-N 271.307 2.369 10 10 CECE COc1cccc(O)c1CNCC[C@@H]1CCCOC1 858205840 CSMGKSFOSZDMRC-LBPRGKRZSA-N 265.353 2.307 10 10 CECE Cc1cc(N(C)Cc2ccc(N)cc2)ccc1C(N)=O 126502170 KDVXNQKBBRPOLL-UHFFFAOYSA-N 269.348 2.313 10 10 CECE NCc1ccc(N2CCCC[C@H]2C2OCCO2)c(F)c1 1941974834 KHGWVEGUIZETGY-AWEZNQCLSA-N 280.343 2.016 10 10 CECE C[C@H]1C(S(=O)(=O)Nc2ccc(O)cc2Cl)[C@@H]1C 1945737822 INYCIPGZMZNAOU-RNFRBKRXSA-N 275.757 2.442 10 10 CECE C[C@@H]1C[C@@H](N)CCN1Cc1ccc(Cl)cc1O 1942497902 RLFWWTISIJXTGL-SKDRFNHKSA-N 254.761 2.357 10 10 CECE Cc1cccc(O)c1CN1CCN(CC(F)F)CC1 876642663 IPNCOTDGNUDZMY-UHFFFAOYSA-N 270.323 2.083 10 10 CECE CO[C@@H]1CN(c2ccc(CO)c(Cl)c2)C[C@H]1F 1942647883 MTJLQVMTDGXLQA-VXGBXAGGSA-N 259.708 2.005 10 10 CECE CCOc1cccc(CNC[C@@H]2C[C@H]3C[C@H]3CO2)c1O 1875644648 UJBMAQGMIMPUQX-RDBSUJKOSA-N 277.364 2.306 10 10 CECE CN(C(=O)c1ccc(N)cc1F)c1ccc(N)cc1 1876480663 TVSNXLOTSPWGMT-UHFFFAOYSA-N 259.284 2.267 10 10 CECE C[C@H](N[C@H](C)c1ccn(C)n1)c1cc(O)ccc1O 1876943099 KQSAROBDJPXYBT-VHSXEESVSA-N 261.325 2.243 10 10 CECE CCCC[C@H](N)CC(=O)N[C@H](C)c1ccccc1O 1877590720 WYGKAVCRXJNIRA-NEPJUHHUSA-N 264.369 2.477 10 10 CECE Oc1cc(Cl)ccc1CNCCOC1CCOCC1 1183949617 MIYYRGKEBCVAEB-UHFFFAOYSA-N 285.771 2.331 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1C[C@H]2OCC[C@@H]12 1946506640 HCCSSBHLRDQBCB-RLCGTCKNSA-N 253.729 2.313 10 10 CECE Cc1nc([C@H]2CCCN2Cc2ccc(N)cc2)no1 1964642823 LNNRZAIPCGTYGH-CYBMUJFWSA-N 258.325 2.297 10 10 CECE CC(=O)NCCN[C@H](C)c1ccc2ccccc2c1O 20148824 UNEMLWWSWCTNFI-LLVKDONJSA-N 272.348 2.332 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCO2)C12CC(CO1)C2 1966042516 UVMVVOXXMLWVGC-FFKNIBCLSA-N 259.349 2.279 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@H]2CCNC[C@H]2C1 1967988670 SMQGNMYVWDJESF-NEPJUHHUSA-N 280.799 2.477 10 10 CECE N[C@@H]1CC[C@H]2CN(Cc3cc(F)ccc3O)C[C@@H]2C1 1969034590 NVGYLPIKDFIFQM-COPLHBTASA-N 264.344 2.091 10 10 CECE CC[C@@H](C)[C@@H](NCc1ccc(OC)cc1O)C(=O)OC 40906499 DPZDVGLFBVLCAF-QMTHXVAHSA-N 281.352 2.078 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@H]2C[C@]21C(=O)O 2143925031 AWXVOXZZRGIFOM-HFBDOXOYSA-N 277.320 2.098 10 10 CECE COc1cc2c(cc1OC)N(C[C@@H]1CCCOC1)CC2 1970280679 KBDUXEVJUQYWFT-LBPRGKRZSA-N 277.364 2.493 10 10 CECE CCOCCN1CCc2cc(OC)c(OC)cc21 1970282821 YDHCMWLSFQNIAS-UHFFFAOYSA-N 251.326 2.103 10 10 CECE COc1ccc(O)c(CN2C[C@H]3[C@@H](OC)CC[C@H]3C2)c1 2144217944 FJWAFNPNTFGKGE-PEYYIBSZSA-N 277.364 2.258 10 10 CECE Nc1ccc(-n2nc(C(=O)O)cc2C(F)(F)F)cc1 258484712 JXYKTHAWMAIKSY-UHFFFAOYSA-N 271.198 2.172 10 10 CECE COC(=O)CC[C@H](N)c1c(C)c(F)c(C)c(OC)c1O 260297612 DLHYVMDKGGHMBS-VIFPVBQESA-N 285.315 2.110 10 10 CECE COC(=O)C1(c2cc(F)cc(CN(C)C)c2O)CCC1 260774169 YREDPBDSXKBQFI-UHFFFAOYSA-N 281.327 2.188 10 10 CECE CCCNC(=O)[C@H](C)N(CCC)c1ccc(CN)cc1 34654729 SLCRBFCDYKHNIS-ZDUSSCGKSA-N 277.412 2.276 10 10 CECE Cn1ncc(COCc2ccc(N)cc2)c1Cl 2002824045 CJZLFHTVQHSDAW-UHFFFAOYSA-N 251.717 2.373 10 10 CECE CO[C@H]1C[C@H]1CNCc1c(O)cccc1Br 1987749578 GGLLGSVSYWCANX-UFBFGSQYSA-N 286.169 2.279 10 10 CECE CN(C)c1nc(CNC(=O)Nc2ccc(N)cc2)cs1 2149559400 FHYIVXVETYIEDD-UHFFFAOYSA-N 291.380 2.113 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@](C)(O)C2)cc1O 163260843 YHHXOWRGZGPHFS-IAQYHMDHSA-N 264.369 2.024 10 10 CECE Cn1cc(Br)nc1-c1cccc2c1CCNC2 1997875060 PLYWGLVWXPLGLZ-UHFFFAOYSA-N 292.180 2.495 10 10 CECE COc1ccc(N2CC[C@H](C)[C@@H](CN)C2)c([N+](=O)[O-])c1 163973177 DVZGCGNUSHEDHR-QWRGUYRKSA-N 279.340 2.025 10 10 CECE CCCC(=O)NCCCN[C@@H](C)c1cc(F)ccc1O 2158724580 WIZDNUZQMPTAAA-NSHDSACASA-N 282.359 2.488 10 10 CECE CC(C)CN1CCN(c2ccc(CO)cc2Cl)CC1=O 2158784596 INBGEYRCDDTSKG-UHFFFAOYSA-N 296.798 2.137 10 10 CECE CC(C)C[C@H](C)N(C)S(=O)(=O)Cc1ccc(N)cc1 40317764 HOBKXIFMKKWRFL-LBPRGKRZSA-N 284.425 2.465 10 10 CECE CN1CC(C)(C)CC[C@H]1CNCc1cccc(O)c1O 2150655907 YMKTZGSWBHNFDD-ZDUSSCGKSA-N 278.396 2.308 10 10 CECE OC[C@@H]1C[C@@H]1CNCc1cc(Cl)cc(Cl)c1O 2005986759 SENQPNNAJXZJSV-APPZFPTMSA-N 276.163 2.417 10 10 CECE [N-]=[N+]=NCCCCN1C[C@@H](C(F)(F)F)CC1=O 2006143591 UFUFZAFOXCLKQD-ZETCQYMHSA-N 250.224 2.488 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C[C@H](O)CC(F)(F)F 2009442646 FKYKNDRJCNKUCM-HTQZYQBOSA-N 252.240 2.074 10 10 CECE CN1CC[C@@H](Nc2c(N)cccc2Br)CC1=O 2014842587 HMWVHBISIRBMLV-MRVPVSSYSA-N 298.184 2.064 10 10 CECE COc1cc(N)c(N(C)C[C@@H]2OCC[C@H]2C)cc1OC 2152420124 GNVLKHSYIHLJOJ-BMIGLBTASA-N 280.368 2.147 10 10 CECE CCNCc1ccc(N(C)CC(=O)N(CC)CC)cc1 49038333 NBKPUAQKLRRDDZ-UHFFFAOYSA-N 277.412 2.101 10 10 CECE CCCc1nc([C@H](N)c2ccc3c(c2)CCN3C)no1 50287929 OLNRRXAALZYSDF-CQSZACIVSA-N 272.352 2.063 10 10 CECE Oc1cc(Cl)ccc1CN[C@H]1C[C@]12CCOC2 2021238216 QPCQJBHLQHKZLC-STQMWFEESA-N 253.729 2.314 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1C[C@]12CCOC2 2021244223 UEEXXPINHSRDDI-STQMWFEESA-N 253.729 2.314 10 10 CECE CN(CCOc1ccc(N)cc1)CP(C)(C)=O 2021439565 QRXAKDRRTIRIEB-UHFFFAOYSA-N 256.286 2.160 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H](CC(=O)O)[C@H]1C 2153496691 WWPMINYFLCNFJD-GMTAPVOTSA-N 279.336 2.344 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CC(C4CC4)C3)ccc21 2153704852 MQWOMILCEDDOMC-OAHLLOKOSA-N 271.364 2.136 10 10 CECE C[C@H]([C@@H]1CCCCO1)[C@@H](NN)c1ccccc1O 2029556523 TUGLHORBDQHREF-DDTOSNHZSA-N 250.342 2.102 10 10 CECE CN1CCc2cc([C@@H](O)c3cnn(C(F)F)c3)ccc21 2154541253 ZHPNNNNGMBZKTP-CYBMUJFWSA-N 279.290 2.352 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1ncc(C)s1 2031153350 JRINHXRNMJPXMA-RYUDHWBXSA-N 264.350 2.151 10 10 CECE CO[C@H](CNc1ccc(N)cc1)[C@@H]1CCCOC1 2032831363 WFNZSIUNDINQGZ-BXUZGUMPSA-N 250.342 2.122 10 10 CECE CCOC[C@@H](O)COc1ccc(CNC(C)C)cc1C 2155011762 ZDVJDMWFHHTHLR-OAHLLOKOSA-N 281.396 2.269 10 10 CECE CC[C@@H]1CN(C)CCCN1CCc1ccc(N)cc1 300542508 SGZNGWAVIAEOCZ-MRXNPFEDSA-N 261.413 2.227 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H](N(C)C)[C@H](C)C2)cc1 300508067 QVFIFUKRKHUSTP-DAXOMENPSA-N 261.413 2.483 10 10 CECE CO[C@H](C1CC1)C(F)(F)CNCc1cccc(O)c1O 2155495244 OOUNQIJVZWFSQU-CYBMUJFWSA-N 287.306 2.248 10 10 CECE C[C@H](N[C@@H]1CC[C@H]1N(C)C)c1cc(F)ccc1O 2039961156 ZAZKIVPFQRBUOS-ZWKOPEQDSA-N 252.333 2.275 10 10 CECE COCCOC[C@H]1CCN([C@H](C)c2ccccc2O)C1 2159075992 YEWDLDGHGCMSFH-KGLIPLIRSA-N 279.380 2.438 10 10 CECE COc1ccnc([C@@H](O)c2ccc3c(c2)CCN3C)c1 2159092450 FFTSEQNRGCRGNK-INIZCTEOSA-N 270.332 2.164 10 10 CECE CN(Cc1cncs1)c1cc2c(cc1N)OCCO2 400167831 LLGQTTWTLGJPBW-UHFFFAOYSA-N 277.349 2.133 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CO[C@H](C)C2)c(F)c1 401589464 VTIJFWPRQDXPHJ-JFGNBEQYSA-N 252.333 2.459 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2Cc1cncn1C 401639461 GHYFEVOKDHHZMU-LBPRGKRZSA-N 270.380 2.393 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC[C@@]3(CCNC3)C2)c1 311330199 CNAGLLPMTYHFAP-XJKSGUPXSA-N 260.381 2.447 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](O)C2(C)C)c(F)c1 311593799 BBMMUNFMMSYTNY-GFCCVEGCSA-N 270.323 2.034 10 10 CECE CN1CCCc2cc(CNC[C@@H](O)C3CCC3)ccc21 315829429 ZWQRWCNUZWEYTB-QGZVFWFLSA-N 274.408 2.320 10 10 CECE Cn1nc(C(=O)Nc2ccc(N)cc2)cc1C(F)(F)F 2158696262 FIUBKXSAQPBMHG-UHFFFAOYSA-N 284.241 2.273 10 10 CECE C[C@H](C1CCC1)N(C)S(=O)(=O)Cc1ccc(N)cc1 324633289 AYASLVPUZUSXPS-LLVKDONJSA-N 282.409 2.219 10 10 CECE CN(C[C@@H]1C[C@H]1C(F)F)c1ccc2c(c1)NC(=O)[C@H]2O 2159777045 RIRRXNHCJOKZPA-KOLSJAJHSA-N 282.290 2.010 10 10 CECE CC(C)CN1CC[C@H](N[C@@H](C)c2cc(O)ccc2O)C1 2160041610 VSUDLROEAOQXTB-STQMWFEESA-N 278.396 2.479 10 10 CECE CC[C@H](CN)c1cncn1Cc1ccc(N(C)C)cc1 2160480290 LGELGPLZKKMHFO-CQSZACIVSA-N 272.396 2.450 10 10 CECE COC(=O)N1CCC(NCc2cccc(Cl)c2O)CC1 701687392 JTFATCSKYLDHBQ-UHFFFAOYSA-N 298.770 2.366 10 10 CECE CN(C)c1ccc(CNC[C@@]23COC[C@H]2C3(F)F)cc1 2161886938 LYVWQUMLNYTBMG-ZIAGYGMSSA-N 282.334 2.124 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(N)=O)[C@@]12CCCC[C@H]1C2 709091940 ZRFYOWIADZQWQC-WCFLWFBJSA-N 265.361 2.101 10 10 CECE CC(C)O[C@@H]1CCN(c2ccc(CN)cc2F)C1 706489369 YUZYTERAHJIIPW-GFCCVEGCSA-N 252.333 2.288 10 10 CECE CCNCc1ccc(N2C[C@H]3CN(C)C[C@@H]3C2)cc1C 706984737 ZYQJJAACIHZHFS-HZPDHXFCSA-N 273.424 2.102 10 10 CECE CC[C@H]1COC[C@@H]1N(C)Cc1cccc(OC)c1O 688192694 LSSCIBTVPHUKOQ-AAEUAGOBSA-N 265.353 2.258 10 10 CECE CC[C@H](NC)c1ccc(N(C)C[C@@H](C)CO)cc1 688387851 NUVGMZFKBCWPDS-DOMZBBRYSA-N 250.386 2.422 10 10 CECE Oc1ccc(Cl)cc1CNC[C@]12COC[C@H]1C2 689247971 HLKXPSQDZFVRAV-ZWNOBZJWSA-N 253.729 2.172 10 10 CECE CN(C)c1ccc([C@@H](C[C@H]2CCCOC2)NN)cc1 689503322 HJUIDSNRXCLSPO-IUODEOHRSA-N 263.385 2.074 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)[C@@H](O)C2)cc1Br 388242996 CWBPILWLOPMXAR-RVBZMBCESA-N 299.212 2.286 10 10 CECE C[C@@H]1COC[C@@H]1N(C)c1ccc(CN)c(Cl)c1 711153778 KBRGGNYMMLUKRD-RNCFNFMXSA-N 254.761 2.270 10 10 CECE CC(=O)c1ccc(O)c(CN2CC[C@@H](CF)C2)c1 711450043 DFMZEHZRISSJAE-NSHDSACASA-N 251.301 2.386 10 10 CECE C[C@@H]1CSCCN(CCc2ccc(N)cc2)C1 379526921 UMNJIUVMORGGMO-LBPRGKRZSA-N 250.411 2.496 10 10 CECE CNCc1ccc(N2CCC[C@H](n3ccnc3)C2)cc1 2171259240 YERLQRAQQNZHPO-INIZCTEOSA-N 270.380 2.444 10 10 CECE COc1ccc(O)c([C@H](C)N(C)CC(C)(C)N)c1 692059036 NEQCRMFICSNYRF-JTQLQIEISA-N 252.358 2.131 10 10 CECE CNCc1ccc(N2CC[C@](C)(COC)C2)c(F)c1 381445104 FXSPGRCZRWDGOQ-HNNXBMFYSA-N 266.360 2.408 10 10 CECE CCS[C@@H]1CCN(c2cc3c(cc2N)NC(=O)CC3)C1 382904548 UYQWFXBNWASYJG-LLVKDONJSA-N 291.420 2.485 10 10 CECE CN(c1ccc2c(c1)OC(F)(F)O2)[C@H](CN)C(F)(F)F 2162671295 DXOVLVUBRICJTL-SECBINFHSA-N 298.211 2.334 10 10 CECE CNCc1ccc(N2CC[C@H](N(C)C)[C@@H]2C)cc1C 389173509 MFDUKJZMNOFZJG-BBRMVZONSA-N 261.413 2.243 10 10 CECE CSc1ccccc1C(=O)N1CCS[C@@H](C(=O)O)C1 699318039 MUMRLHBUAMPAES-LLVKDONJSA-N 297.401 2.051 10 10 CECE CN(c1ccc(CN)cc1F)C1C[C@@H]2CC[C@H](C1)N2C 394121796 MBOGCJCHNVPGQJ-PBWFPOADSA-N 277.387 2.346 10 10 CECE CCN1CCc2cc([C@]3(N)CCN(C)[C@@H](C)C3)ccc21 2163063085 OZYYFZWGLSTESW-GUYCJALGSA-N 273.424 2.337 10 10 CECE NCc1ccc(N2CC[C@@H]3OCC[C@H]3C2)cc1Cl 724835297 KAKGVGXCURVTLK-FZMZJTMJSA-N 266.772 2.414 10 10 CECE CCN1CCc2cc(N3C[C@@H](N)[C@@H](C(F)F)C3)ccc21 2163065502 AVGIDJOKBHVMRG-QWHCGFSZSA-N 281.350 2.098 10 10 CECE 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2.160 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2CC[C@H](F)C2)cc1 2044751934 GPILJYUXWKXZMV-DYEKYZERSA-N 251.349 2.395 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3N)CC[C@H]1N(C)C 2184739406 GNCJDGCJMOFJDR-OAUYIBNBSA-N 273.424 2.409 10 10 CECE Cc1cnn(C)c1CN(C)c1ccc2c(c1)CC[C@@H]2O 2184730528 WVXOGLBHUYPGRK-INIZCTEOSA-N 271.364 2.345 10 10 CECE CN[C@H]1CCc2cc(N3[C@H]4CC[C@H]3[C@H](CO)C4)ccc21 2184729334 ICIDZAVLFXJRLR-CSFVBSKPSA-N 272.392 2.243 10 10 CECE N[C@H]1CCc2cc(N3C[C@H]4CCC[C@@]4(CO)C3)ccc21 2184735044 AZUUHWNJQHOJQM-COXVUDFISA-N 272.392 2.231 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)c(Cl)c1 2052053743 NNHASEFKYOMXRL-GJTWSCIVSA-N 266.772 2.319 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CC[C@]2(CCCOC2)C1 2185135993 WPOCNDOXGOGVKE-BZUAXINKSA-N 277.364 2.104 10 10 CECE CN(Cc1ccccc1O)C(=O)C(F)(F)[C@H]1CCOC1 2185256549 HGZYVPDKTUKELG-NSHDSACASA-N 285.290 2.022 10 10 CECE CCO[C@@H]1CC[C@@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2054441968 XZVMFOQWDIODJP-OUAUKWLOSA-N 252.318 2.103 10 10 CECE 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C[C@H](CO)CN(C)c1ccc([C@H](C)N)c(Cl)c1 688387557 KJTFSRHIAREHGT-UWVGGRQHSA-N 256.777 2.424 10 10 CECE CC(=O)N1CCC(Nc2c(N)cccc2Cl)CC1 689583800 IQQBRWYVAWKQBV-UHFFFAOYSA-N 267.760 2.345 10 10 CECE CC1(C)[C@@H]2CN(C(=O)CCOc3ccc(N)cc3)C[C@H]21 379516490 WXUGDCVYNKJYAG-ZIAGYGMSSA-N 274.364 2.152 10 10 CECE COC(=O)N(C)CCN(C)Cc1cccc(Cl)c1O 690816967 PUTVDWKRNSYVAL-UHFFFAOYSA-N 286.759 2.176 10 10 CECE CCCNCc1cc(F)c(N2C[C@@H](C)[C@@H](O)C2)c(F)c1 388212360 VLARMLJUXXNJGM-YGRLFVJLSA-N 284.350 2.281 10 10 CECE Nc1ccc(OCCC(=O)NC[C@@H]2CCCSC2)cc1 384099018 DQVDTMAQJFDQFJ-LBPRGKRZSA-N 294.420 2.297 10 10 CECE CCNCc1ccc(N2CCC[C@H](O)[C@@H]2C)cc1C 384917297 ZGRJPVNGRGAXSH-BBRMVZONSA-N 262.397 2.454 10 10 CECE CCCNCc1ccc(N(C)CCCCO)c(C#N)c1 385164358 SQLAFDLYQRZZDY-UHFFFAOYSA-N 275.396 2.267 10 10 CECE CCOC(=O)[C@H](CC(C)(C)SC)NCCN=[N+]=[N-] 385200172 FLXTUSDPXZJNIW-VIFPVBQESA-N 274.390 2.350 10 10 CECE C[C@H]1CNCCN(Cc2cc(Cl)ccc2O)C1 385223651 KJAKAHMBULSBNK-JTQLQIEISA-N 254.761 2.087 10 10 CECE NCc1ccc(N2C[C@@H]3COC[C@H]3C2)c(C(F)(F)F)c1 718257135 KZAGJOYSKZDLLI-GHMZBOCLSA-N 286.297 2.247 10 10 CECE C[C@@H](NCCN1CC=CC1)c1ccc(F)cc1O 392761706 LJGNDKHHUJPKDW-LLVKDONJSA-N 250.317 2.054 10 10 CECE CCN(Cc1cc(F)cc(C(C)=O)c1O)[C@@H]1CCOC1 394312945 DPRUTGPGPAHXTP-CYBMUJFWSA-N 281.327 2.345 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)C[C@@H](CO)C2)c(F)c1 398905870 HKEPXVGXPOVOHW-GRYCIOLGSA-N 266.360 2.300 10 10 CECE C[C@@H]1CC[C@@H](O)CN1c1ccc(CNC2CC2)cc1 399475442 NYYWTBKQTAYAGU-MLGOLLRUSA-N 260.381 2.288 10 10 CECE Cc1cc(N)ccc1N1C(=O)[C@H]2CC=CC[C@H]2C1=O 821935261 KPWBQNDHXJKJSN-TXEJJXNPSA-N 256.305 2.033 10 10 CECE CO[C@H]1C[C@H](CN(C)Cc2ccccc2O)C[C@H]1OC 2174912943 QRXHSHRKMVZBBB-DVSIDAKKSA-N 279.380 2.264 10 10 CECE CN(C[C@H](O)COc1ccc(N)cc1)[C@@H]1CC=CCC1 2175130410 NKUDYNXDTZOBHE-CABCVRRESA-N 276.380 2.049 10 10 CECE CC[C@@H](N)c1ccc(N2CC(C(=O)NC(C)C)C2)cc1 2168047360 LKFNVRSOSKDHBR-OAHLLOKOSA-N 275.396 2.057 10 10 CECE C[C@@](O)(c1ccc(N2CCCC2)cc1)c1cccnn1 2168574415 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OCc1ccc(N2C[C@@H]3CCO[C@H]3C2)c(C(F)(F)F)c1 2172075275 YMGMDZLOVZEIML-GWCFXTLKSA-N 287.281 2.423 10 10 CECE COc1cc(N)c(N2[C@H]3CCC[C@H]2COC3)cc1OC 2198663208 FMQPTROMFDFQTK-QWRGUYRKSA-N 278.352 2.044 10 10 CECE C[C@H](c1cc(O)ccc1O)N1C[C@H]2CC[C@@]1(C(=O)O)C2 2198622626 KEGTUEHJXBILAB-FTGAXOIBSA-N 277.320 2.098 10 10 CECE Cc1cc(N2CC3(C=CCO3)C2)ccc1C=CC(=O)O 2183724637 KRHAFCUMCAJASA-UHFFFAOYSA-N 271.316 2.238 10 10 CECE Oc1c(Cl)cccc1CNC[C@@H]1[C@@H]2CCO[C@@H]21 1907560960 SEDAQZQQECYIDT-CWSCBRNRSA-N 253.729 2.170 10 10 CECE CN1C[C@H]2CN(c3ccc4c(c3)CCC[C@H]4N)C[C@H]2C1 2184693467 RKALVEHLFMCGTM-JKIFEVAISA-N 271.408 2.021 10 10 CECE Nc1ccc(CS(=O)(=O)NC23CCC(CC2)CC3)cc1 2184897467 DKOJVAAVQKKKTH-UHFFFAOYSA-N 294.420 2.411 10 10 CECE CCN[C@H](C)c1cnc(SCC(=O)NC(C)C)s1 2041814001 WGRZTYCWDQBQFB-SECBINFHSA-N 287.454 2.430 10 10 CECE CCn1nc([C@@H](O)c2ccc3c(c2)CCN3C)cc1C 2185728944 ICRVHOKOKYYWEH-INIZCTEOSA-N 271.364 2.285 10 10 CECE CON(CCOc1ccc(N)cc1)C1CCCC1 2046217268 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10 CECE C[C@H](NCc1ccc2c(c1)CCN2C)c1ccn(C)n1 2192163342 ATVGGICNYNOKOC-LBPRGKRZSA-N 270.380 2.263 10 10 CECE CP1(=O)CCN(c2ccc3c(c2)CC[C@H]3O)CC1 2065086294 IKNOYJZMNRUVNN-CQSZACIVSA-N 265.293 2.479 10 10 CECE CO[C@@H]1CC[C@H]1CN[C@@H](C)c1c(O)cccc1O 2066805612 FHSYZPQBJZFXBL-OUJBWJOFSA-N 251.326 2.173 10 10 CECE CO[C@@H]1CCN(c2ccc(CN)c(F)c2F)[C@H]1C1CC1 2195389028 WZPXNJNUXGKWCN-DOMZBBRYSA-N 282.334 2.427 10 10 CECE NN[C@H](c1csc(C2CC2)n1)c1ccccc1O 2068532816 CJVFPPPJKZFIQS-LBPRGKRZSA-N 261.350 2.279 10 10 CECE C[C@@H](NC(=O)c1ccnn1C1CC1)c1ccccc1O 2192610498 BQBQKSIJXVTFKI-SNVBAGLBSA-N 271.320 2.415 10 10 CECE CC(C)[C@H]1NCC[C@]1(O)c1ccc2c(c1)CCCN2C 2188251726 HQPKRESTZZLTJA-SJORKVTESA-N 274.408 2.275 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2C[C@H]2CF)cc1O 2071416947 IHYDZBORVHQLRE-DCAQKATOSA-N 253.317 2.487 10 10 CECE Cc1cccc(CNCCCc2nncs2)c1O 2072649685 WSHXZXOQJLKFSC-UHFFFAOYSA-N 263.366 2.275 10 10 CECE Cc1cc(N(C)[C@H]2C3CCN(CC3)[C@@H]2C)ccc1CO 2192787212 QVLMTMCOUWMZFH-CXAGYDPISA-N 274.408 2.406 10 10 CECE CCC[C@](O)(COC)[C@@H](NCC)c1ccccc1O 2109689216 DYBWAGUTZKFKPT-GJZGRUSLSA-N 267.369 2.220 10 10 CECE COc1ccc(N(C)[C@H]2C3CCN(CC3)[C@@H]2C)c(N)c1 2192761186 ABVUVXIBVOFYGU-BDJLRTHQSA-N 275.396 2.196 10 10 CECE CCNCc1ccc(N(C)Cc2c(C)ncn2C)cc1 2188588819 LPKVZLQBBBHPSO-UHFFFAOYSA-N 272.396 2.474 10 10 CECE CCc1cccc(CNC2(C(F)F)COC2)c1O 2074763326 UIGOOGSZUZLKLR-UHFFFAOYSA-N 257.280 2.078 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H](O)CC2(C)C)c(Cl)c1 2188635825 KDDHBVZHPFBXPQ-HERUPUMHSA-N 298.814 2.070 10 10 CECE CN(CP(C)(C)=O)c1cc2c(cc1N)OCCO2 2077874529 XGWHVIVEQXYNEA-UHFFFAOYSA-N 270.269 2.056 10 10 CECE COCC(COC)CN(C)[C@@H](C)c1ccc(F)cc1O 2199393308 FKYGIPMNDCZAMB-NSHDSACASA-N 285.359 2.433 10 10 CECE C[C@H](N)c1ccc(N(C)Cc2cnnn2C)cc1Cl 2100243972 NCZLLYYSEKWKOO-VIFPVBQESA-N 279.775 2.125 10 10 CECE CCC[C@H](NC)c1nc(-c2ccc(O)c(O)c2)no1 2102208503 OEALWOKDUVAJOI-VIFPVBQESA-N 263.297 2.208 10 10 CECE CN(c1c(F)cc(CN)cc1F)C1CCC(O)CC1 2103872045 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C[C@H](O)c1ccc(N2CC[C@H]3COCC[C@@H]32)cc1O 2088740197 LVMGNTMMGHVJAR-MJVIPROJSA-N 263.337 2.061 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc([C@@H](C)N)cc1F)C2 2109177869 RLLXBCJBOGYQLY-IXPVHAAZSA-N 264.344 2.318 10 10 CECE Cc1ccc(CN(C)c2ccc(CO)cc2C)nn1 2089554211 OAHRQZGIHMNQNS-UHFFFAOYSA-N 257.337 2.222 10 10 CECE CC(C)(C)c1nnsc1[C@@H](NN)c1ccccc1O 2090042153 IWALJUXXRJPPND-JTQLQIEISA-N 278.381 2.094 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCN2C)C(C)(C)CO 2090538460 MUIZUECCXUXIRK-GFCCVEGCSA-N 262.397 2.176 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1[C@H]2CCCCC[C@H]21 2111133791 YPSSZESPCDEXHM-NOOOWODRSA-N 266.345 2.254 10 10 CECE C[C@@H](C[C@H]1CCCO1)NCCc1ccc(O)c(O)c1 2091760487 SDEDQSIZGOUTND-WCQYABFASA-N 265.353 2.188 10 10 CECE CNCc1ccc(N2CC3(CCC3)C[C@@H]2CO)cc1 2095172988 KKTSVUPLTNGPRE-OAHLLOKOSA-N 260.381 2.147 10 10 CECE OCc1ccc(N2CC[C@H]([C@H]3CCOC3)C2)c(F)c1 2096736290 QRVJCZYVBLFXGV-STQMWFEESA-N 265.328 2.181 10 10 CECE CNCc1cc(F)c(N2C[C@@H](O)CC2(C)C)c(F)c1 2098609754 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SHXXLLUVVGWPSZ-MXWKQRLJSA-N 254.334 2.395 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1cnc(Cl)cn1 2218743118 TVZPIOCVQXIFLE-BQBZGAKWSA-N 266.692 2.091 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)[C@@H]1CCCOCC1 2218743899 HCIDPEZWDMGVBI-GMTAPVOTSA-N 252.318 2.151 10 10 CECE COc1ccc(N2CCC(F)(F)[C@@H]2C)c(CO)c1 2220433397 ZRKFZLXPKREFPZ-VIFPVBQESA-N 257.280 2.421 10 10 CECE OCc1ccc(N2[C@H](CO)C[C@H]3CCCC[C@H]32)cc1 2231988147 MTJCBHWJADFECW-VNQPRFMTSA-N 261.365 2.309 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@H](CF)C2)c(C)c1 2232092438 SWXVREFTGHASAU-GXTWGEPZSA-N 266.360 2.450 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@@H]1OC[C@@H]2CCCC[C@H]21 2233185771 MTWQGGMLCABUKU-UMSGYPCISA-N 278.356 2.493 10 10 CECE CC[C@]1(C(=O)O)C[C@@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2234171744 OFMXEDDXDQRBIY-BREBYQMCSA-N 280.328 2.179 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1csc2cncn12 2225791810 HPNUBDFQABCTJM-HTQZYQBOSA-N 276.325 2.357 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1 2225794258 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CCCc1cc(NCc2cc(N)ccc2O)ncn1 40765822 XJDKOQBFUGJWOU-UHFFFAOYSA-N 258.325 2.329 10 10 CECE C[C@@H]1CCN([C@H](C)C(=O)Nc2ccc(N)cc2)C[C@@H]1F 2152255379 MHJKUZXYVLCSDB-GYSYKLTISA-N 279.359 2.276 10 10 CECE C[C@H](O)c1ccc(N2CC=C[C@H]2CO)c(Cl)c1 2007531952 QTCAHEGMMAAKNA-ONGXEEELSA-N 253.729 2.130 10 10 CECE COc1cccc(CN2[C@H]3CC[C@H]2CC(CN)C3)c1O 2159197582 CZIUFHFBANUJPL-KBPBESRZSA-N 276.380 2.103 10 10 CECE COc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H](CN)C3)c(O)c1 2159183810 GAIMDZPPSVPRFA-DEZZGGKRSA-N 276.380 2.103 10 10 CECE COc1ccc([C@@H](C)N[C@@H](C)CCN(C)C)c(O)c1 49553707 HUFGIVYVARKWTN-NWDGAFQWSA-N 266.385 2.392 10 10 CECE C[C@H](O)CC(C)(C)CNCc1ccc(F)cc1O 293768679 ZQRJZCPALJBCGP-JTQLQIEISA-N 255.333 2.418 10 10 CECE Nc1ccc(CNc2nncc3ncsc23)cc1 2029187397 YMWDYBSTTFKYSJ-UHFFFAOYSA-N 257.322 2.281 10 10 CECE CCNCc1ccc(N(C)CC(C)(C)CO)cc1 2033572144 MVWUOQARNRNQDT-UHFFFAOYSA-N 250.386 2.251 10 10 CECE CN1CCc2cc(CNCC34COC(C)(C3)C4)ccc21 2156676925 HMQLWTHDONCQOE-UHFFFAOYSA-N 272.392 2.338 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCO[C@H]2CCC[C@H]21 300439388 DMUGDBKIYJARDQ-GYSYKLTISA-N 263.337 2.412 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CC[C@@H](C)C1 2040174513 BJBQEVODZZWFNM-GMTAPVOTSA-N 254.334 2.254 10 10 CECE O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NCc1c(O)cccc1F 2160795268 VGOPDIKGQSEVLE-WBRVRECLSA-N 279.311 2.120 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1c(F)cccc1Cl 313484308 HPHVIOUEAHYXJG-GFCCVEGCSA-N 299.737 2.470 10 10 CECE CNCc1ccc(OC)c(CS(=O)(=O)C(C)(C)C)c1 81924406 VZYGORWULYSJGD-UHFFFAOYSA-N 285.409 2.128 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@@H](CCN(C)C)C1 701494598 PBEJBIZGBIFKDW-CHWSQXEVSA-N 278.396 2.432 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@H]2CC[C@H]1[C@H](N)C2 700887294 NKHYJYQBNYFVNH-ZNIXKSQXSA-N 264.344 2.404 10 10 CECE Oc1c(CN2CC[C@]3(CCOC3)C2)ccc(F)c1F 703481494 GRBGBETVZLOQSA-AWEZNQCLSA-N 269.291 2.283 10 10 CECE CNCc1ccc(N2C[C@H](CO)CC(C)(C)C2)c(F)c1 2172571603 IXQMQBKBNSYRMM-CYBMUJFWSA-N 280.387 2.390 10 10 CECE CN1C[C@@H]2CN(Cc3cc(Cl)ccc3O)C[C@H]2C1 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2.061 10 10 CECE CS[C@H]1CCN(c2cc3c(cc2Cl)[C@@H](N)C(=O)N3)C1 382908597 WFTWFTHUWRVQGU-JVXZTZIISA-N 297.811 2.234 10 10 CECE C[C@H](N[C@@H]1CCCC12OCCO2)c1ccc(O)cc1O 715601060 XYFYJBMWVYADLL-IINYFYTJSA-N 279.336 2.044 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)CCO3)[C@H](C)[C@@H]1C 383664615 UCXOEZFWWWGREG-YWPYICTPSA-N 260.381 2.444 10 10 CECE CC[C@H](O)[C@@H](C)NCc1cc(Cl)cc(OC)c1O 386840271 XOSIPKNWDGALKP-KCJUWKMLSA-N 273.760 2.303 10 10 CECE COc1ccc(N2CCN[C@@H](C)C[C@H]2C)c([N+](=O)[O-])c1 2164450968 BCBVJXXHCZSUCO-WDEREUQCSA-N 279.340 2.180 10 10 CECE CC(C)(F)[C@](C)(F)CNC(=O)COc1ccc(N)cc1 2173027973 HIYOMHLQUXTPHH-CQSZACIVSA-N 286.322 2.240 10 10 CECE C[C@H](CCC1CC1)NCc1ccc(O)c(O)c1O 398086080 PZZUXVXICJKAEI-SECBINFHSA-N 251.326 2.472 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H](O)c1cnco1 2177834596 DBZNZKBQTBRBGV-CABCVRRESA-N 273.336 2.008 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@@H]1CCOC1 398860337 XLNNWRRCHUMVBK-MNOVXSKESA-N 251.326 2.127 10 10 CECE 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CN(C)CC[C@](C)(O)c1ccc(N2CCCC2)cc1 2106827535 DSAHWVULALOIRM-INIZCTEOSA-N 262.397 2.446 10 10 CECE CN(C)c1ccc([C@H](N)c2cncn2C2CC2)cc1 2106848304 GVSODLCYDGKALL-HNNXBMFYSA-N 256.353 2.332 10 10 CECE CC(C)[C@@H](N)C[C@@H](O)c1ccc2c(c1)CCCN2C 2106826345 SCRWYJOROFWHIB-GOEBONIOSA-N 262.397 2.476 10 10 CECE C[C@@H]1CCN[C@@H]1[C@@H](O)c1ccc(N2CCCC2)cc1 2106834008 QAVYQBKLZWZSQP-KCXAZCMYSA-N 260.381 2.318 10 10 CECE CC1(C)[C@H]([C@@H](O)c2ccc(N3CCCC3)cc2)[C@H]1N 2106828138 JUHYOEAYPZMWCP-QLFBSQMISA-N 260.381 2.304 10 10 CECE C[C@H](N[C@H]1COC[C@@H]1C1CC1)c1c(O)cccc1O 2088401200 ANVKGXFRGYJVRJ-WCQGTBRESA-N 263.337 2.173 10 10 CECE CNCc1ccc(N2C[C@H]3CC[C@@]2(CO)C3)c(C)c1 2089731316 VWEKEBIAXKROJK-HOCLYGCPSA-N 260.381 2.066 10 10 CECE CC(C)(C)n1nccc1[C@H](O)Cc1ccc(N)cc1 2090779728 OMGKWLSMONWCII-CQSZACIVSA-N 259.353 2.496 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC[C@H]2C(C)=O)c1 2092973762 VMYCPVXVPZHPOX-AWEZNQCLSA-N 261.321 2.148 10 10 CECE COC[C@H]1[C@H]2CN(c3ccc(CN)c(F)c3)CC[C@H]21 2093140648 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2.198 10 10 CECE CC[C@]1(O)CCCN(c2ccc(OC)cc2C=O)C1 2227702887 OHELROBTBYMMOD-HNNXBMFYSA-N 263.337 2.249 10 10 CECE CO[C@H]1CC[C@@H]1CN(C)c1ccc2c(c1)CC[C@@H]2N 2227840232 BCRGKKPJWOJQQV-KCXAZCMYSA-N 260.381 2.494 10 10 CECE NCc1cc(F)c(N2CC(OC(F)(F)F)C2)c(F)c1 2229329447 FIMFBOCIXJOLNW-UHFFFAOYSA-N 282.212 2.149 10 10 CECE CN(C)c1ccc(OC2(C(=O)O)CC(F)(F)C2)cc1 2229373038 JBKNEVXIWAEGSC-UHFFFAOYSA-N 271.263 2.384 10 10 CECE CC[C@H](C)NCc1ccc(N(C)CCS(C)(=O)=O)cc1 2240043403 KGKUCOMIMFYSDC-ZDUSSCGKSA-N 298.452 2.056 10 10 CECE COC12CCC(NC(=O)Nc3ccc(N)cc3)(CC1)C2 2240277175 YSEOEWCFFLYHGN-UHFFFAOYSA-N 275.352 2.492 10 10 CECE CCS(=O)(=O)C[C@@H](C)N(C)c1ccc([C@@H](C)N)cc1C 2240743577 LCKGFPLQXQIBAN-CHWSQXEVSA-N 298.452 2.274 10 10 CECE COCCN(c1ccc([C@@H](C)O)cc1C)[C@H]1CCOC1 2240844446 PVTGTXUYHXQPQA-HIFRSBDPSA-N 279.380 2.290 10 10 CECE COCCO[C@@H]1CCN(c2ccc([C@H](C)O)cc2C)C1 2240833879 SXCFVBUWRKCWQS-DZGCQCFKSA-N 279.380 2.290 10 10 CECE COc1ccc(N(C)[C@@H]2CCC(F)(F)[C@H]2N)cc1 2253398313 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2.023 10 10 CECE COCCNCc1ccc(N2CCC[C@H]2CCCO)cc1 62738185 DJICSQCMFDLEAE-INIZCTEOSA-N 292.423 2.164 10 10 CECE COc1cc(C[C@@H](N)c2ccc(N(C)C)cc2)sn1 400458041 REQSAJUQNLTYGQ-CYBMUJFWSA-N 277.393 2.460 10 10 CECE CCc1nn(C)cc1/C=C1\C(=O)N(C)c2ccccc21 179725021 QMUNRAFUMONCDQ-LCYFTJDESA-N 267.332 2.500 10 10 CECE C[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCS1 171606460 RAKQFHNCULYSNI-VIFPVBQESA-N 267.350 2.058 10 10 CECE CCCN(C(=O)CCOCC)c1ccc(N)cc1 63115362 CKJMUDHKLRIZGI-UHFFFAOYSA-N 250.342 2.438 10 10 CECE CC(C)n1ncnc1CC(=O)CCc1ccc(N)cc1 124658312 DSIJSARUQOEIRO-UHFFFAOYSA-N 272.352 2.186 10 10 CECE Nc1ccc(CCC(=O)[C@@H]2CCO[C@@]3(CCOC3)C2)cc1 124618182 UESQABFBKUZTRA-PBHICJAKSA-N 289.375 2.356 10 10 CECE CN(Cc1ccncc1)c1cc2c(cc1N)NC(=O)CC2 36776218 XZFYIAVTLZHWFO-UHFFFAOYSA-N 282.347 2.185 10 10 CECE COc1cc(O)c(CN(C)O)c(F)c1Br 218799666 AYZNDRHIFGCWKF-UHFFFAOYSA-N 280.093 2.123 10 10 CECE CCCCN(CC)CC(=O)c1ccc(O)c(O)c1 34989980 CCJVQGZRHJBEDB-UHFFFAOYSA-N 251.326 2.403 10 10 CECE 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2.233 10 10 CECE C[C@@H]1CCC[C@@]1(N)c1nc(-c2ccc(O)c(O)c2)no1 2149458622 GZLUYJVUISVLIF-CLAHSXSESA-N 275.308 2.122 10 10 CECE CC(C)Oc1ccc(N2CCC(CN)(CO)CC2)cc1 2202901550 DLMIGHDCBDFVMD-UHFFFAOYSA-N 278.396 2.011 10 10 CECE CCNCc1ccc(N(C)C[C@H]2COCCCO2)cc1 2153985844 BBYSLGCGBWZZJH-INIZCTEOSA-N 278.396 2.038 10 10 CECE Cc1cnn(C)c1CN(c1ccc(CN)cc1)C1CC1 2154330165 NYRGZXPKENSOFE-UHFFFAOYSA-N 270.380 2.356 10 10 CECE CCc1nc([C@@](C)(N)c2ccc(N(C)C)cc2)cn1C 2154770595 LXZCVQMIYFANOZ-INIZCTEOSA-N 272.396 2.271 10 10 CECE CCCc1nc(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)n[nH]1 2155554325 SKTVYAZOTHJFKZ-VIFPVBQESA-N 277.332 2.062 10 10 CECE COc1ccc(N2C[C@@H](O)CC23CCC3)c([N+](=O)[O-])c1 2155606268 JCIZPYUFHSQYHO-JTQLQIEISA-N 278.308 2.097 10 10 CECE CC(C)(O)[C@H]1CCN1c1ccc(CO)cc1Cl 2016613326 BKNNGDXOZUMIDW-GFCCVEGCSA-N 255.745 2.182 10 10 CECE C[C@@H](c1cncs1)N(C)CC(=O)Nc1ccc(N)cc1 2155718576 WLNVFEFLVLBUTR-JTQLQIEISA-N 290.392 2.357 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CO)c(Cl)c1 2018121718 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CO[C@@H]1COCC[C@@H]1N[C@@H](C)c1cc(C)ccc1O 312090401 PLHXZUNNWIOBBA-CORIIIEPSA-N 265.353 2.155 10 10 CECE Nc1ccc(CCC(=O)OC[C@@H]2CCC[C@@H](O)C2)cc1 312474376 HHIVCTVNJDHYQK-UKRRQHHQSA-N 277.364 2.296 10 10 CECE CN(CCn1cc(Cl)cn1)c1ccc(N)cc1 312825872 DLMUZNOKIXSMFT-UHFFFAOYSA-N 250.733 2.255 10 10 CECE COc1cccc(O)c1CN[C@@H]1CCC[C@@H]2OCC[C@H]21 2160735025 CQQYFRRDKMWEIT-GHJWDPDVSA-N 277.364 2.448 10 10 CECE CC[C@@H](NCc1ccc(O)c(O)c1O)C1CCC1 324642884 DGFQLYROUPPKRD-LLVKDONJSA-N 251.326 2.472 10 10 CECE COc1cccc(O)c1CNc1cccc(C(N)=O)c1 2160733679 KPSALCXLHZVDMB-UHFFFAOYSA-N 272.304 2.112 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cnc(Cl)nc2)C1 701315969 JBEYAOOZICBATB-QMMMGPOBSA-N 266.692 2.045 10 10 CECE Cc1cccnc1[C@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2161642948 QJVMDLNQIBMJPC-HOCLYGCPSA-N 271.364 2.189 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1CCOC(C)(C)C1 2161702484 MGCCQNWAZSBXHL-MNOVXSKESA-N 284.360 2.023 10 10 CECE C[C@@H](O)[C@H]1CCCCN1c1ccc(CO)cc1F 688076209 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C[C@@H](CNCc1cccc(O)c1O)c1ccccn1 692761240 LWGZVJVULLPOJQ-NSHDSACASA-N 258.321 2.386 10 10 CECE FC(F)(F)[C@H]1CNCCN(c2ccc3c(c2)CCO3)C1 383573570 FGIZRLJBGXUISY-NSHDSACASA-N 286.297 2.210 10 10 CECE COc1ccc([C@H](C)NCC23CCN(CC2)C3)c(O)c1 715682389 RDHSPUISSRRRKM-LBPRGKRZSA-N 276.380 2.147 10 10 CECE C[C@@H]1[C@H](CO)CCN1c1ccc(CN)c(Br)c1 385755437 WVRPPEUSPSLSSP-KOLCDFICSA-N 299.212 2.115 10 10 CECE O=C(N[C@@H]1CCC(F)(F)C1)c1ccc(O)c(O)c1 386240063 BTDDEDVBLBMOFZ-MRVPVSSYSA-N 257.236 2.015 10 10 CECE C[C@H](NCc1nn(C)cc1Cl)c1ccc(O)cc1O 393323670 TVPVQBPDRBKGMW-QMMMGPOBSA-N 281.743 2.336 10 10 CECE C[C@H](NCC1([S@](C)=O)CCC1)c1cc(O)ccc1O 393696236 MBQFHXUSXRKEGA-OVWNDWIMSA-N 283.393 2.050 10 10 CECE C[C@H](Nc1c(N)cccc1C(=O)O)C1CCN(C)CC1 396497769 SLQXJCHVDOOLGA-JTQLQIEISA-N 277.368 2.109 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@H](C)C[S@@](C)=O 399840195 BTMKRISCRMTCLI-AUSHCKSDSA-N 273.373 2.291 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccn2c1CCCC2 2064457790 JIBGQGDSLQYXGW-UHFFFAOYSA-N 286.331 2.166 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2[C@H]3CCCCC[C@H]32)cc1 2167259483 NLIVMHBOEFUUNM-MIFYACCESA-N 274.364 2.343 10 10 CECE Oc1cccc(CNC2(C(F)(F)F)CCOCC2)c1O 2168292719 UZOQMVMNSGUQJE-UHFFFAOYSA-N 291.269 2.299 10 10 CECE CCc1ncncc1CN(C)c1ccc(CN)cc1F 2178810837 YSYFOFLYNKYBRZ-UHFFFAOYSA-N 274.343 2.273 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](O)[C@H](O)CC2(C)C)c(Cl)c1 2188635829 KDDHBVZHPFBXPQ-OWYVNGRQSA-N 298.814 2.070 10 10 CECE COC[C@@H]1CC[C@H](C(=O)N(C)Cc2ccccc2O)C1 2181803456 ASWATHALVFGSJD-OLZOCXBDSA-N 277.364 2.413 10 10 CECE CCc1ccsc1CNC(=O)c1cc(O)c(O)c(O)c1 2188873907 BELPEQNJTGDMTE-UHFFFAOYSA-N 293.344 2.357 10 10 CECE COC[C@@H]1C=CCN1c1ccc([C@H](C)O)cc1[N+](=O)[O-] 2182330645 IEOBURIKLYCKEJ-JQWIXIFHSA-N 278.308 2.039 10 10 CECE OCc1ccc(N2CCOC[C@H]2CF)cc1C(F)(F)F 2182596934 MKVSWUBTMBHFDM-LLVKDONJSA-N 293.260 2.372 10 10 CECE CCC(=O)N1CCN(c2ccc([C@@H](C)O)c(Cl)c2)CC1 2182600753 BCHJKZCAQOSMLI-LLVKDONJSA-N 296.798 2.452 10 10 CECE O=C(NC[C@@H]1CC12CC(F)(F)C2)c1ccc(O)c(O)c1 2189405589 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Cc1cccc(O)c1CN(C)C[C@H]1C[C@@H]2OCC[C@@H]2O1 2354613938 QLICRUDWOGCMMD-KCXAZCMYSA-N 277.364 2.079 10 10 CECE CC(=O)Oc1ccc2c(c1)C(=O)c1ccccc1C2=O 3897240 FGKGRDOTGFSFDX-UHFFFAOYSA-N 266.252 2.387 10 10 CECE biogenic CNC[C@H](C(C)C)N1CCN(c2ccc(OC)cc2)CC1 52418110 YLVHEJZKCFTJTO-QGZVFWFLSA-N 291.439 2.061 10 10 CECE CSCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 172230050 SOOWLMDTLGTTOL-ZDUSSCGKSA-N 295.404 2.263 10 10 CECE C[C@H](N[C@H]1CCCC[C@H]1O)c1c(O)cccc1O 300440824 JSOQIFHLTONZAW-GARJFASQSA-N 251.326 2.052 10 10 CECE Nc1ccc(NC(=O)CCN2[C@@H]3C=CC[C@H]2CC3)cc1 2357018301 NPDGNLVPTNTGOI-CABCVRRESA-N 271.364 2.390 10 10 CECE C[C@H](S[C@@H](C)[C@@H](C)O)C(=O)Nc1ccc(N)cc1 300445637 JKRXZKFSFYXHIC-UTLUCORTSA-N 268.382 2.098 10 10 CECE CC1=NN(c2ccccc2)C(=O)/C1=C/N1C[C@H](C)O[C@@H](C)C1 33889357 KJYZBASWFCQAEB-DWAVZPTGSA-N 299.374 2.402 10 10 CECE CN(C)c1ccc(CN2CCN(C3CC3)CC2)cc1 127873794 PNBJWHMFOFJMSF-UHFFFAOYSA-N 259.397 2.033 10 10 CECE CO[C@@H](C(=O)C(C)=O)c1ccc(Br)cc1 1951495705 JIQWFWHBOVKKOR-LLVKDONJSA-N 271.110 2.295 10 10 CECE CCOc1cccc(CNOCC(F)(F)F)c1O 133957453 LPACWCPVPMXALT-UHFFFAOYSA-N 265.231 2.374 10 10 CECE CC[C@H](C)N(CC(=O)O)[C@@H](C)c1ccc(O)cc1O 86752656 JATKOFQWEVABDX-UWVGGRQHSA-N 267.325 2.344 10 10 CECE COc1ccccc1CC(=O)NCCc1ccc(N)cc1 40675679 SYOIRVFLXZUNOB-UHFFFAOYSA-N 284.359 2.179 10 10 CECE CCN(CCC(=O)Nc1ccc(N)cc1)C[C@H]1CCCO1 48952659 LOAPFIMFLRPFAY-OAHLLOKOSA-N 291.395 2.098 10 10 CECE CN1CCc2cc(CN[C@H]3CCN4CCCC[C@@H]34)ccc21 224329683 DKFQRCAFKAJJIM-WMZOPIPTSA-N 285.435 2.395 10 10 CECE C[C@](Cc1ccccc1)(NCCCN=[N+]=[N-])C(=O)O 90259188 QRIQJMYCLGRCBH-CYBMUJFWSA-N 262.313 2.362 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1c(F)cccc1F 90256812 IYHAZCFXNFVURL-JTQLQIEISA-N 270.239 2.079 10 10 CECE CN(C)c1ccc(/C=C2/N=C(c3ccncc3)NC2=O)cc1 253437303 KGXYFWZFAPXLQT-RVDMUPIBSA-N 292.342 2.065 10 10 CECE CC(C)(C)OC(=O)N1CCC(=O)[C@H]1c1cc(O)ccc1O 1951869654 SPGDAJRXIBWHMY-CYBMUJFWSA-N 293.319 2.349 10 10 CECE COc1ccc2c(c1)CCN2Cc1cn(C(C)C)nn1 289058569 IVRMHYWNERSQSJ-UHFFFAOYSA-N 272.352 2.430 10 10 CECE CCN(c1ccc2c(c1)OCCO2)[C@@H]1CCC[C@H]1CN 2162620545 CRQUGBIGIAYUNA-GXTWGEPZSA-N 276.380 2.412 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@@H]1CCN 2162672601 YPZWBTLNYUAKMN-ZJUUUORDSA-N 284.306 2.429 10 10 CECE CO[C@@H]1CC(N(C)Cc2cc(C)ccc2O)C[C@H]1OC 2166110628 SDTRZUWSVCIAQZ-HZPDHXFCSA-N 279.380 2.325 10 10 CECE CCN1CCc2cc([C@@]3(N)CCN(C(C)C)C3)ccc21 2163061667 JIXGLYHZQDEUIC-QGZVFWFLSA-N 273.424 2.337 10 10 CECE CCN1CCc2cc([C@H](O)CNCC(F)(F)F)ccc21 2163071120 LVQMAZQTRYLWST-CYBMUJFWSA-N 288.313 2.254 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3CNCC34CCC4)ccc21 2163077450 VWWZCELTQZEVBR-ZBFHGGJFSA-N 272.392 2.102 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1CC2(CC2)CN1 2163094491 MCRSYOZNWVFBNV-CVEARBPZSA-N 272.392 2.462 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@H](O)[C@@H]1CCSC1 2163231553 WYKHDHHNNVVITO-FVQBIDKESA-N 292.448 2.401 10 10 CECE C[C@@H]1CSC[C@@]1(O)[C@H](N)c1ccc2c(c1)CCCN2C 2163242385 HKHGYCZQPCHVKW-LYRGGWFBSA-N 292.448 2.183 10 10 CECE CC(=O)C(=O)COC(=O)c1csc(-c2ccccc2)n1 808497118 IFZCKXIFPZOVIP-UHFFFAOYSA-N 289.312 2.125 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@@H](O)[C@H]2C)cc1O 718958470 SLLUTGWGQAWFJF-MISXGVKJSA-N 264.369 2.022 10 10 CECE CN(C[C@H]1CCOC1)c1ccc(/C=C\C(=O)O)cc1 399579327 IQSLGMNIORTBAI-LLPBQKLSSA-N 261.321 2.257 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)CC(=O)N(C)C)cc1 723163216 FHJUUPORKOSCCP-ZDUSSCGKSA-N 277.412 2.272 10 10 CECE CCNCc1ccc(N2CC[C@H]3[C@@H]2CCCN3C)cc1 720432973 OPWTXDBTXZRPKC-IRXDYDNUSA-N 273.424 2.469 10 10 CECE CCOc1ccc(O)c(CN[C@@H]2COCC2(C)C)c1 825090853 KNHBSWLKOUXCIJ-CQSZACIVSA-N 265.353 2.306 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@H]2[C@@H](C1)[C@@H]2C(=O)O 721194894 SEFFNJCMIUAGGK-TWOBJEBXSA-N 279.311 2.245 10 10 CECE CO[C@@H]1CCOC[C@@H]1N[C@@H](C)c1cc(C)ccc1O 724873379 PHPOSPFCSHUDPI-CORIIIEPSA-N 265.353 2.155 10 10 CECE C[C@H](C[S@](C)=O)N(C)C/C=C/c1ccc(N(C)C)cc1 835047270 FBHKTHQIYNADRF-HXQYRECKSA-N 294.464 2.465 10 10 CECE CN(C)c1ccc(/C=C\CN2CCO[C@H](CF)C2)cc1 840955450 VCWDLTBVKCQLCJ-MJSXRHKHSA-N 278.371 2.436 10 10 CECE C[C@H](NCC[C@]1(O)CCOC1)c1ccc(Cl)cc1O 846193453 LVDHWODHYQDLKH-HZMBPMFUSA-N 285.771 2.238 10 10 CECE CCOC(=O)c1oncc1COc1ccc(N)cc1 1951920767 RQDQUBGLRJXKIQ-UHFFFAOYSA-N 262.265 2.013 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@H]3COC[C@@H]3O2)cc1F 929824035 CIROOBWBWKRUIT-WBIUFABUSA-N 281.327 2.074 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1C[C@@H](O)C12CCC2 850388094 HIQRAKPBNUAVCY-CHWSQXEVSA-N 267.756 2.439 10 10 CECE C[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)c2ncnn21 850351938 KBILEQHKKGGHNQ-MFKMUULPSA-N 289.358 2.279 10 10 CECE CC(C)C(=O)NCc1cc(NC(=O)C(C)C)ccc1O 923126418 IMEHADZTJZZIAH-UHFFFAOYSA-N 278.352 2.259 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)CP(C)(C)=O 1899484885 KTIAYXGAGUSLPW-JTQLQIEISA-N 283.312 2.108 10 10 CECE CCN(C)c1ccc([C@H](C)NC[C@H](O)[C@H]2CCCO2)cc1 858470373 YYTOHJWFPOMBOC-RRQGHBQHSA-N 292.423 2.333 10 10 CECE COC[C@@H](C)OC(=O)N(C)Cc1ccc(N(C)C)cc1 866417986 DIMQWDOAAATUEW-GFCCVEGCSA-N 280.368 2.356 10 10 CECE CC[C@@H]1NCC[C@H]1NC/C=C/c1ccc(N(C)C)cc1 863647158 XXUMPCHHEOJLBH-LZCSOBMZSA-N 273.424 2.496 10 10 CECE Cc1cc(CN(C)c2ccc3c(c2)OCO3)c(C)nn1 930095517 XZOAUEBZBRMXGM-UHFFFAOYSA-N 271.320 2.459 10 10 CECE CN(C)c1ccc(CN2CCN(CCCF)CC2)cc1 860007782 FVYZTWMRBQDDCY-UHFFFAOYSA-N 279.403 2.230 10 10 CECE Cc1cc(CN2CC[C@@H]3CC[C@@H](O)[C@@H]32)ccc1N(C)C 860132391 ZOMQQGYSHKALRF-USXIJHARSA-N 274.408 2.406 10 10 CECE CCOc1cccc(CN[C@H]2CC[C@@H](C)NC2)c1O 863484953 QNNIHDOOAINSTN-YPMHNXCESA-N 264.369 2.021 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)Cc1ccco1 50133900 YEAYZOKOMJNXAO-UHFFFAOYSA-N 261.277 2.006 10 10 CECE Cc1cc(=NC(=O)N2Cc3cccc(O)c3C2)cc(C)[nH]1 1119861760 VWJQYNBCGYEBCB-UHFFFAOYSA-N 283.331 2.374 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](C)N(C)C[C@H]2C)c1 775983061 ARUCPGYTYIQZPG-CHWSQXEVSA-N 278.396 2.315 10 10 CECE CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1882297590 FEFXWOJIZHESKO-VIFPVBQESA-N 285.348 2.058 10 10 CECE Cc1coc(-c2ccc(N3CCCNCC3)cc2)n1 82567520 KZMKXWZRTIGLAK-UHFFFAOYSA-N 257.337 2.450 10 10 CECE COc1ccc(N2CCC(N)CC2)c2ccncc12 82792442 MDUXCIFAGQXAJY-UHFFFAOYSA-N 257.337 2.171 10 10 CECE Cn1c(=O)cc(CCN)c2cc(C(C)(C)C)ccc21 84131545 HZBDJUZRFIIOGZ-UHFFFAOYSA-N 258.365 2.337 10 10 CECE Cc1cnccc1[C@H]1NCCc2c1ccc(O)c2O 75793682 LAZZPKRGPOPWTN-CQSZACIVSA-N 256.305 2.036 10 10 CECE Cn1cccc1-c1nc2ccccc2nc1CCN 77434863 FDUKMXIDLLRKBN-UHFFFAOYSA-N 252.321 2.137 10 10 CECE [N-]=[N+]=NCCNS(=O)(=O)c1cc(F)ccc1Cl 164742516 QQFNVUQJXGOYSX-UHFFFAOYSA-N 278.696 2.068 10 10 CECE CCNCc1ccc(OC)c(CN2C(=O)CC[C@H]2C)c1 390804617 XKWAXCKVXUVELQ-GFCCVEGCSA-N 276.380 2.316 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1cc(C)nn1C 686756089 DYOJPUUSOHSFDA-MRXNPFEDSA-N 272.396 2.493 10 10 CECE COCCNCc1ccc(N2C[C@@H]3CCC[C@@H]32)cc1 706759759 DUXIPWVYJDUDAP-HOCLYGCPSA-N 260.381 2.411 10 10 CECE CN(Cc1c(O)cccc1Br)C1CC(N)C1 706861337 LRLLIZRTGXEZHC-UHFFFAOYSA-N 285.185 2.076 10 10 CECE Oc1c(F)cc(F)cc1CN1C[C@@H]2CC[C@H](C1)O2 708415618 ZUKXRRXPQWTVTH-PHIMTYICSA-N 255.264 2.034 10 10 CECE CCNCc1ccc(N2CC[C@@H]3COC[C@@H]3C2)cc1 690287199 XPYNTVYTFSWEAP-CABCVRRESA-N 260.381 2.269 10 10 CECE NCc1ccc(N2CCSC[C@H]2CCO)c(Cl)c1 689739875 DURLVGKPVYVCFR-LLVKDONJSA-N 286.828 2.103 10 10 CECE Nc1ccc(NC(=O)C2C[C@@H]3[C@@H](C2)C3(F)F)cc1 693337143 JMLSVOXIWIGZHW-GHMZBOCLSA-N 252.264 2.499 10 10 CECE CN(C)c1ccc([C@H](O)CCCO[C@@H]2CCOC2)cc1 699498056 NWUDTJFBZJJKRI-HZPDHXFCSA-N 279.380 2.372 10 10 CECE CC[C@@](NCCN=[N+]=[N-])(C(=O)O)c1ccc(OC)cc1 90256369 VENTUNJJVVFABP-ZDUSSCGKSA-N 278.312 2.285 10 10 CECE O=C(C[C@@H]1COC(=O)C1)NCc1c(O)ccc2ccccc12 1157041471 HIILJYYZAOGVOP-NSHDSACASA-N 299.326 2.115 10 10 CECE Nc1ccc(OCCC(=O)N2CCC[C@@H]3C[C@@H]32)cc1 1916861146 QYGZLSJRPBUFQO-RISCZKNCSA-N 260.337 2.049 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H](F)[C@@H](C(=O)O)C1 2120639524 KXWPUQUEAZPOBD-QJPTWQEYSA-N 267.300 2.198 10 10 CECE CO[C@@H](C)c1noc(CN2CCC[C@@H]2CN=[N+]=[N-])n1 2123020408 VHESRXVUYPKWEJ-DTWKUNHWSA-N 266.305 2.052 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@@]12CCC[C@@H]1OCC2 2123018189 KACUNQAQCXSVOO-NTZNESFSSA-N 264.329 2.247 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCNCC3(CC3)C2)c1 2123451041 VJUIOQVEHTWOKR-CYBMUJFWSA-N 260.381 2.447 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2COC3CC2C3)c1 2126733190 HUSACYQDPAZAJS-SLTDEYSJSA-N 263.337 2.229 10 10 CECE CC1(C)COC[C@]1(Sc1nccs1)C(=O)O 1904757947 TWTGMJHBCNXADA-JTQLQIEISA-N 259.352 2.115 10 10 CECE OC[C@@H]1CCCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128279239 NJNFNWLWVHWDPY-MLGOLLRUSA-N 261.365 2.265 10 10 CECE CN[C@H]1CCCc2cc(N3CC([C@@H](C)O)C3)ccc21 2128274885 RNBGWCLDTNUGPA-BZNIZROVSA-N 260.381 2.100 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@@H]3O)C[C@H](C)C1O 2128320195 BGMPUTFJQWRTKF-PGUXBMHVSA-N 261.365 2.119 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)C[C@@H]1N(C)C 2128323164 VNEBCPSOBRDNMM-XFBWCDHKSA-N 260.381 2.053 10 10 CECE C[C@@H](O)c1ccc(N(C)CCC(=O)N(C)C)cc1Cl 2131951728 DRGHOULPVCUZEN-SNVBAGLBSA-N 284.787 2.308 10 10 CECE CN(Cc1ccoc1)c1ccc(CO)c([N+](=O)[O-])c1 2132057813 IZWMFEBICOUNHW-UHFFFAOYSA-N 262.265 2.317 10 10 CECE CN(C[C@H]1CC12CCC2)C(=O)c1ccc(O)c(O)c1 2133080918 GJIGXROSZVSJRX-LLVKDONJSA-N 261.321 2.360 10 10 CECE CCOC(=O)C[C@H](C)N1CCC[C@@H](CN=[N+]=[N-])C1 1912155600 IQOIBBFUAOUJDJ-QWRGUYRKSA-N 254.334 2.350 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])C[C@H]2[C@@H](C1)C2(C)C 1912179213 SCZIJFDIQQWLGB-DDFAGTSDSA-N 266.345 2.254 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2ccnc(Cl)n2)C1 1912188238 MUZBGEYPRQXQRV-SECBINFHSA-N 252.709 2.405 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@H]2COc3ccccc32)CC1 1912185514 QVCCESQMHSPCDP-GFCCVEGCSA-N 272.308 2.464 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)C(C1CC1)C1CC1 1912192071 AMGFCAGHPXLZMJ-LLVKDONJSA-N 252.318 2.166 10 10 CECE [N-]=[N+]=N[C@H]1CCN(S(=O)(=O)c2ccsc2Cl)C1 1912156778 QCFRLNGQAOVKOZ-LURJTMIESA-N 292.773 2.475 10 10 CECE CCOC1CC(CC(=O)N2CCC(N=[N+]=[N-])CC2)C1 1912195975 HWIFSCWGOLDDAB-UHFFFAOYSA-N 266.345 2.493 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C[C@@H](C(=O)O)c2ccccc2)C1 1912145992 NYVBBTXKRLRMRS-WCQYABFASA-N 274.324 2.487 10 10 CECE C[C@H]1COCC[C@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 1912152834 XYMUSVVXWYENSU-CMPLNLGQSA-N 266.345 2.208 10 10 CECE CC[C@H](COC)CC(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912148566 VFPKBGOYQZHKTH-QWRGUYRKSA-N 254.334 2.350 10 10 CECE CN[C@@H](C)c1ccc(N(C)C2(CCO)CC2)cc1O 2133545519 GAAVWHQBXXTKMG-NSHDSACASA-N 264.369 2.024 10 10 CECE CCCNCc1cc(F)c(N2CC[C@H](O)[C@H]2C)c(F)c1 1914256354 PGKCMBGOKBBVKV-YGRLFVJLSA-N 284.350 2.424 10 10 CECE CNCc1cc(F)c(N(C)CCCN(C)C)c(F)c1 111140690 YZWCLUJQIGLMBJ-UHFFFAOYSA-N 271.355 2.072 10 10 CECE CCC[C@H](CCO)CNCc1cccc(F)c1O 226612336 WSWSSFJRDRLNHP-LLVKDONJSA-N 255.333 2.420 10 10 CECE C[C@H]1[C@@H](C(=O)O)[C@H](C)CCN1Cc1ccccc1O 2135855428 PEGMVWFWXACXSV-SUNKGSAMSA-N 263.337 2.323 10 10 CECE CNCc1ccc(N2C[C@@H]3CCCCN3C[C@@H]2C)cc1 227409339 BDGPKQZIVKAJMT-YOEHRIQHSA-N 273.424 2.469 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3[C@H](O)CC[C@H]3C2)c(F)c1 228045907 SQXHVTCEPDUMFF-QZDOHJIMSA-N 278.371 2.313 10 10 CECE CN(C[C@@]1(C)CSCCO1)c1ccc(CN)cc1F 2136549719 WFCCLDCWTJVYHJ-AWEZNQCLSA-N 284.400 2.243 10 10 CECE C[C@H](NC(=O)/C=C/c1cnn(C)c1)c1ccccc1O 1648892076 MCTAIEJDJFZYFW-AEZGRPFRSA-N 271.320 2.016 10 10 CECE C[C@H](NCC[C@]1(C)COCCO1)c1cc(F)ccc1O 1875565339 YBSOFMLHLWROLO-XHDPSFHLSA-N 283.343 2.378 10 10 CECE C[C@@H](CNC(=O)c1c(F)ccc(O)c1O)c1ccncc1 1651179370 NOMBODXHLQZFEB-VIFPVBQESA-N 290.294 2.165 10 10 CECE [N-]=[N+]=NCCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1 231730752 GPJSQFKJBQGMSH-UHFFFAOYSA-N 277.284 2.344 10 10 CECE CN(C)c1ccc([C@H](N)[C@]23CO[C@](CF)(C2)C3)cc1 2137919219 PMNBVZYHDMDZJC-KKUMJFAQSA-N 264.344 2.271 10 10 CECE Oc1ccc(CNC[C@H]2CSCCS2)cc1O 166325358 GZFXUTQHAPWKAG-JTQLQIEISA-N 271.407 2.036 10 10 CECE CC(C)[C@H]1CC(=O)N(CCOc2ccc(N)cc2)C1 166697122 PADAWSYKHMLFAT-LBPRGKRZSA-N 262.353 2.152 10 10 CECE COc1ccc([C@@H](C)N[C@H](C)CN(C)C)c(O)c1 168605829 MDVBEKFJFGTGTO-GHMZBOCLSA-N 252.358 2.002 10 10 CECE C[C@@H](CC(=O)O)[C@H]1CCCN(Cc2ccc(O)cc2O)C1 155910707 RFDVLRZYXOXDGJ-RYUDHWBXSA-N 293.363 2.421 10 10 CECE CN[C@@H]1CN(c2ccc(OC)cc2OC)C(C)(C)C1 259311719 HYDRNCNMZHRDDZ-NSHDSACASA-N 264.369 2.281 10 10 CECE COc1ccc(N2C[C@H](N)CC2(C)C)c(OC)c1 259487161 RTXISASZQJYWPL-SNVBAGLBSA-N 250.342 2.020 10 10 CECE COc1cc(N(C)CC2(OC)CCC2)ccc1CN 2139697250 SFRINAMNPRCMQN-UHFFFAOYSA-N 264.369 2.159 10 10 CECE COc1cc(N(C)C[C@@H]2CC[C@H](C)O2)ccc1CN 2139703852 DNBYDTJBOYQMBC-FZMZJTMJSA-N 264.369 2.158 10 10 CECE C[C@@]12C[C@@H](CO1)N(Cc1c(O)cccc1Cl)C2 1941102570 YHBWSTOQRPZECW-ZANVPECISA-N 253.729 2.409 10 10 CECE CC(C)(F)CS(=O)(=O)Nc1ccc(O)cc1F 1940801003 MCEICKBLXFHTBB-UHFFFAOYSA-N 265.281 2.021 10 10 CECE CN=c1nc(Sc2nccs2)c2cc[nH]c2[nH]1 1941561253 LNNDADFBYRKUMF-UHFFFAOYSA-N 263.351 2.029 10 10 CECE C[C@H](N[C@H](C)C1CSC1)c1cc(O)ccc1O 1942244103 QCNXQZXYEKUMJC-BDAKNGLRSA-N 253.367 2.500 10 10 CECE C[C@H]1C[C@@]1(F)CN(C)c1ccc(CO)c([N+](=O)[O-])c1 2141405483 DSKVVRQWPICBMY-TVQRCGJNSA-N 268.288 2.271 10 10 CECE C[C@@H](CNCc1ccc(Cl)cc1O)CN(C)C 1942497649 OKHZYPWXGLBTAB-JTQLQIEISA-N 256.777 2.333 10 10 CECE Oc1cc(Cl)ccc1CNCC12CC(CO1)C2 1942490952 DABDKDYIAFKEIX-UHFFFAOYSA-N 253.729 2.314 10 10 CECE CCNCc1ccc(N2C[C@H](C)N(C)[C@H](C)C2)cc1 127886048 SRFFLZZMVGGQRA-OKILXGFUSA-N 261.413 2.325 10 10 CECE CN(Cc1c(O)cccc1F)[C@H]1CCN2CC[C@H]1C2 1877793174 QRRYQYZPNMNFJB-FZMZJTMJSA-N 264.344 2.057 10 10 CECE CC1(C)[C@@H](O)CC[C@@H]1NCc1ccc(F)c(F)c1O 2142122751 LNTNJWXAJIDDKD-QWRGUYRKSA-N 271.307 2.310 10 10 CECE Nc1ccc(CCN2CC(O)(c3cccs3)C2)cc1 1878932253 ILWYRQLZVDJUEW-UHFFFAOYSA-N 274.389 2.076 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@]12C[C@H](CO1)C2 1879854479 MDNCZFMIEBTZQH-AKAXFMLLSA-N 258.365 2.077 10 10 CECE CN(C)c1ccc(CNC[C@]23CCOC[C@@H]2C3)cc1 1880194711 GXBCQXACTCURFE-GOEBONIOSA-N 260.381 2.269 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H](C)[C@@H](CO)C2)c(F)c1 1880482257 NITDXBZVUMSDEO-IQJOONFLSA-N 271.307 2.083 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@@H](CO)C[C@H]2C)c(F)c1 1880930527 CECISWKZMLMEGZ-BBBLOLIVSA-N 270.323 2.192 10 10 CECE C[C@H](O)[C@H](N[C@H]1CCc2cccc(O)c21)C(F)(F)F 1882704144 FVVGMNMAYSZBHS-DXBFQKDVSA-N 275.270 2.281 10 10 CECE Cc1c(N)c(N(C)[C@@H](C)c2ccccc2O)nn1C 2142482868 DDORKFBEMRHGFG-VIFPVBQESA-N 260.341 2.214 10 10 CECE Nc1ccc(OCCCO[C@@H]2CCOC[C@H]2F)cc1 1888200722 NAJLESVOZBDPCW-ZIAGYGMSSA-N 269.316 2.181 10 10 CECE Cc1ccc([C@H](C)N[C@@H]2CN3CCC2CC3)c(O)c1 20090964 FZJBMGUCUZJFJH-SWLSCSKDSA-N 260.381 2.445 10 10 CECE CN(C)c1ccc(CN2CC[C@@H]([C@H]3CCCN3)C2)cc1 1967990522 NXUHKWTXYJHFEC-NVXWUHKLSA-N 273.424 2.327 10 10 CECE CC=CC[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 1968445394 SGBRALOAURMIQH-HNNXBMFYSA-N 275.396 2.005 10 10 CECE C[C@H](NC[C@@H](O)CC(F)(F)F)c1ccc(F)cc1O 1970811584 VCBBXQFCMCGKBQ-CBAPKCEASA-N 281.249 2.495 10 10 CECE Oc1c(F)cccc1CNCCN1C[C@H]2CC[C@H]1C2 1971260081 BACUOYILGVWKLE-AAEUAGOBSA-N 264.344 2.105 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)NC(=O)[C@H]3NC)CCS1 253065948 IUGFWELEDPAPCO-RISCZKNCSA-N 291.420 2.231 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC[C@@]23CCCO3)c1 1974320353 NUVNTMLKKOCIBF-CABCVRRESA-N 263.337 2.202 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C3(CC3)C2)cc1C 2149596388 XVRYCANXGHUQLQ-INIZCTEOSA-N 274.408 2.456 10 10 CECE O=c1[nH]c2cc(NCc3cccc(O)c3O)ccc2o1 41117514 NNNGPBWFKHRPMO-UHFFFAOYSA-N 272.260 2.144 10 10 CECE COc1ccc(O)c(CNCCc2ccnc(C)c2)c1 2148071095 HKLIPPQCHXKTMM-UHFFFAOYSA-N 272.348 2.437 10 10 CECE Cc1c[nH]c2ccc([C@H]3C[C@H](CN)CN3C)c(O)c12 258284685 ALKCPAPERMTONU-ZWNOBZJWSA-N 259.353 2.133 10 10 CECE [N-]=[N+]=NCCCn1cnc2c(Br)ncnc21 1982865636 CPKKATSYFLKXPC-UHFFFAOYSA-N 282.105 2.289 10 10 CECE COC(=O)[C@]1(c2ccc(O)c(O)c2)C[C@H]1C(C)C 260089620 FNEVAESSQMPOAE-HZMBPMFUSA-N 250.294 2.185 10 10 CECE Cc1ccc([C@@H](C)NC[C@@]23CC[C@@H](C2)C(=O)N3)c(O)c1 2145559128 DLTQDPPMUQNTCW-BFQNTYOBSA-N 274.364 2.020 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCc1cnn[nH]1 2145969004 PGZMPQYGNWDNLA-PWSUYJOCSA-N 272.352 2.199 10 10 CECE CN[C@H](c1cccnc1)[C@@H](O)c1ccc(N(C)C)cc1 2148637439 UJVJJPWWDAYHIM-CVEARBPZSA-N 271.364 2.142 10 10 CECE C[C@H](N[C@@H](C)[C@H]1CCCS(=O)(=O)C1)c1ccccc1O 2146109471 DBSCNHQXPAZCKJ-AVGNSLFASA-N 297.420 2.256 10 10 CECE Nc1ccc(OCCC(=O)NC2CC(C(F)F)C2)cc1 2146264168 UWUDRKBAGKOYCU-UHFFFAOYSA-N 284.306 2.198 10 10 CECE CC(C)C[C@@H]1CCN1c1cc2c(cc1N)OCC(=O)N2 2148948710 LOCPWMSQGGMDCH-JTQLQIEISA-N 275.352 2.225 10 10 CECE CN1CCc2cc([C@@H](O)[C@H](N)CC3CC(F)C3)ccc21 2148922375 QTXTUAHMAKLLRZ-LFTORDSISA-N 278.371 2.178 10 10 CECE CCNC1CCN(Cc2ccc3c(c2)CCN3C)CC1 2146646558 IITDLBPLHBUQAM-UHFFFAOYSA-N 273.424 2.253 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CCn1cccn1 38089717 OMXVYCPMSXZOTB-GFCCVEGCSA-N 273.336 2.198 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2nccc(Cl)n2)C1 1996283066 IEHXQTXXSUZAGI-MRVPVSSYSA-N 252.709 2.405 10 10 CECE C[C@@H](CNCc1cc(Cl)ccc1O)N1CCC1 1997059772 YQHVJXZPQZWTED-JTQLQIEISA-N 254.761 2.229 10 10 CECE COC1(OC)CC(CN[C@H](C)c2cc(O)ccc2O)C1 2146903986 RFYCJSOJAZPMMO-SNVBAGLBSA-N 281.352 2.148 10 10 CECE C[C@H](NC[C@@H](C)c1ccn(C)n1)c1ccc(O)cc1O 2147080410 OXXDZWUPTGJFLM-MNOVXSKESA-N 275.352 2.286 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@H](O)C2)c(Cl)c1 2000825691 UJKNEXWHFMWTDE-KOLCDFICSA-N 253.729 2.130 10 10 CECE CC[C@@H](c1ccccc1O)N1CCC[C@H]1CS(C)(=O)=O 2151229807 BRSKYAQXHMSQNB-JSGCOSHPSA-N 297.420 2.352 10 10 CECE COC1(OC)CC[C@H]1Nc1c(N)cccc1Cl 2016952431 BOIMBGRTVPEGBS-SNVBAGLBSA-N 256.733 2.486 10 10 CECE CN1CCc2cc(CNCC(C)(C)N(C)C)ccc21 50286089 ATRITUAWQDLBOK-UHFFFAOYSA-N 261.413 2.109 10 10 CECE CC[P@@](C)(=O)CC(=O)N(C)c1ccc(N)cc1 2020908061 PYMJZKXRALQISW-QGZVFWFLSA-N 254.270 2.244 10 10 CECE Cc1ccc(CN=c2cc(Br)n(C)[nH]2)c(O)c1 2024807948 MMKFVGZNNFHZLS-UHFFFAOYSA-N 296.168 2.231 10 10 CECE Oc1cccc2c1[C@@H](NC1CCN(CCF)CC1)CC2 2154500678 YNVWMDDOWYODLI-AWEZNQCLSA-N 278.371 2.403 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)N)cc2F)C[C@@H]1F 2029819198 UUKHTTZGEMIFCL-LJUAHTATSA-N 256.296 2.019 10 10 CECE CCCN(CCCO)c1ccc(CNC)cc1C 2032093921 HSMXXHQAAJYMER-UHFFFAOYSA-N 250.386 2.313 10 10 CECE CCCN[C@H](CSc1nccs1)c1ncnn1C 2035732968 XVBOYSLYBKTMFH-SECBINFHSA-N 283.426 2.105 10 10 CECE CCN(CC)C(=O)[C@H](C)N(CC)c1ccc(N)cc1 63114832 FGLCZEAEBJBYFJ-LBPRGKRZSA-N 263.385 2.352 10 10 CECE FC(F)(F)Oc1ccc(N2C[C@@H]3C[C@H]2CN3)cc1 2037209389 YCRJPUYYOVKKHB-WPRPVWTQSA-N 258.243 2.136 10 10 CECE COc1ccc(N(C)[C@]2(CN)CCCC[C@H]2OC)cc1 300267726 LAPXTZOKJXGENU-CVEARBPZSA-N 278.396 2.418 10 10 CECE NCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)C3)cc1Cl 2037417529 WWYUYEKAMBOVFE-PJXYFTJBSA-N 266.772 2.291 10 10 CECE COCCC1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CC1 2040264568 FHERTZMDGRZBEQ-JTQLQIEISA-N 252.318 2.104 10 10 CECE CC(C)COC1CN(c2ccc(CO)cc2F)C1 2040862843 FRBAFYMHKGKFIN-UHFFFAOYSA-N 253.317 2.179 10 10 CECE C[C@@H]1CC[C@@H](CN)CN1Cc1ccc(N(C)C)cc1 70179246 UDVISURAOYTUTI-HIFRSBDPSA-N 261.413 2.312 10 10 CECE CC[C@@H]1CN(c2ccc([C@@H](C)N)c(O)c2)[C@@H](C)CO1 403772280 RTYDOPGYXVSGKU-DMDPSCGWSA-N 264.369 2.416 10 10 CECE COc1cccc(CNCC23CC(C)(C2)O[C@H]3C)c1O 2156676284 PNMMCOKMBALYCE-SOISORPOSA-N 277.364 2.448 10 10 CECE COc1ccc([C@H](C)N[C@@H]2CCOC[C@@H]2C)c(O)c1 311479572 KMXCHYFZMJEPTJ-COPLHBTASA-N 265.353 2.476 10 10 CECE Nc1ccc(CCC(=O)OC[C@H]2CCC[C@@H](O)C2)cc1 312474374 HHIVCTVNJDHYQK-DZGCQCFKSA-N 277.364 2.296 10 10 CECE C[C@@H]1Cc2nc(-c3ccc(O)c(O)c3)ncc2[C@H](N)C1 313201229 YQFFUGRTLMLSIU-GZMMTYOYSA-N 271.320 2.137 10 10 CECE Cc1ccnc(CNCc2cc3c(cc2O)OCO3)c1 328226218 BODGXFBLEWWYMT-UHFFFAOYSA-N 272.304 2.114 10 10 CECE COC(=O)C(C)(C)CSCC(=O)Nc1ccc(N)cc1 700290313 CTFXPHRWMPWMDC-UHFFFAOYSA-N 296.392 2.140 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)c1csnn1 87466136 VSFKKKWBQHDYJY-UHFFFAOYSA-N 276.365 2.171 10 10 CECE [N-]=[N+]=NCCN[C@](C(N)=O)(c1ccc(Cl)cc1)C1CC1 90257854 QJGURUDFVSDGGT-ZDUSSCGKSA-N 293.758 2.331 10 10 CECE Cc1ncoc1CN(C)C(=O)CCc1ccc(N)cc1 2161906798 XONDGYRWYVDYFK-UHFFFAOYSA-N 273.336 2.156 10 10 CECE Cc1cc(N2CCO[C@H](c3nccs3)C2)ccc1CN 2171861445 YJKCWUISFWZWMN-AWEZNQCLSA-N 289.404 2.488 10 10 CECE Cc1nnc([C@@H]2CCCN2c2ccc(CO)cc2F)o1 2171833826 WGJILSVTRLNWHK-ZDUSSCGKSA-N 277.299 2.351 10 10 CECE [N-]=[N+]=NCc1ccc(COc2nc(=N)[nH]c3[nH]cnc23)cc1 575598640 DSPWEULBEPDTGO-UHFFFAOYSA-N 296.294 2.155 10 10 CECE C[C@H](N)c1ccc(N2CCNC(=O)C[C@H]2C)cc1Cl 707638717 ZRSBHXBEOXKMGH-ZJUUUORDSA-N 281.787 2.075 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC[C@H]1[C@H]1CCCN1 708494822 PYRTXNBRIJZOCB-KGLIPLIRSA-N 282.334 2.387 10 10 CECE CN(CC1C[C@@H]2C[C@H]2C1)c1ccc2c(c1)NC(=O)[C@@H]2O 697849121 ILFGHFNDXSWLJE-UEKVPHQBSA-N 272.348 2.154 10 10 CECE Nc1ccc(OCC(=O)NCCCC2CCC2)cc1 688381060 BLOSTNDZBYOKPH-UHFFFAOYSA-N 262.353 2.344 10 10 CECE Oc1ccc(F)cc1CN1CC[C@@]2(CCCNC2)C1 709827396 KXUZVIROQIEJLO-OAHLLOKOSA-N 264.344 2.107 10 10 CECE COc1ccc(CN[C@@H](C)C(C)(C)OC)c(O)c1 720205447 KPGCHOHFSLSRSJ-JTQLQIEISA-N 253.342 2.304 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)C1[C@@H]2COC[C@@H]12 2163133469 NBANBTAYCWZUMA-CKEIUWERSA-N 272.392 2.222 10 10 CECE O=C(O)[C@@H]1CN(Cc2ccccc2O)C[C@@H]1C(F)(F)F 720384810 MSILBBDNTUXQFR-ZJUUUORDSA-N 289.253 2.087 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@H]2CCN(C)C2)cc1O 381844303 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CNCc1ccc(N2CC[C@@H](OC(C)C)C2)cc1OC 2204540782 CUGSPQODVHNZSV-OAHLLOKOSA-N 278.396 2.418 10 10 CECE Cc1cccc(CNC[C@]2(F)CC[C@H](C(=O)O)C2)c1O 2204628557 ZBLVZRBACPSVNQ-NHYWBVRUSA-N 281.327 2.383 10 10 CECE Cc1cccc(CNC(=O)c2cc(C3CC3)on2)c1O 2204626431 ZVHJMJIJAMSFDW-UHFFFAOYSA-N 272.304 2.496 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H]1C[C@H]2COC[C@H](C2)C1 2206853831 IWHBASWOUCZDIH-YVECIDJPSA-N 278.356 2.350 10 10 CECE Cc1cc(N(CCO)CC(F)(F)F)ccc1[C@@H](C)N 2269666742 RPMPFVOGWOQRPH-SNVBAGLBSA-N 276.302 2.376 10 10 CECE Cc1cc(N2C[C@@H]3CN(C)C[C@H]3C2)ccc1[C@H](C)O 2269676089 HBMNKMRGGOUJKJ-IHRRRGAJSA-N 260.381 2.046 10 10 CECE Nc1ccc(NC(=O)CCO[C@@H]2[C@H]3C[C@@H]3[C@H]3C[C@@H]23)cc1 2208366918 OXKCGIOTTZBNAM-FAHYXWLWSA-N 272.348 2.268 10 10 CECE CCO[C@@H]1C[C@H](NCc2cnc(SC)s2)[C@H]1OC 2208720712 RSGFHXUGTXQHTN-HBNTYKKESA-N 288.438 2.147 10 10 CECE COc1cc(N)c(N2CC[C@H]3C[C@]3(F)C2)cc1OC 2230313977 ZXZUTRCDELHGOD-XPTSAGLGSA-N 266.316 2.224 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1CCOCC1 2231478925 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2.146 10 10 CECE CNCc1cc(OC)ccc1N(C)[C@H](CO)CC1CC1 2235958041 IUBKELBULWLRTP-AWEZNQCLSA-N 278.396 2.012 10 10 CECE OC[C@H]1CCCCCN1c1ccc2c(c1)OCCO2 2226761388 DQKLOPCEHSGYPL-CYBMUJFWSA-N 263.337 2.199 10 10 CECE CO[C@@]1(CO)CCN(c2ccc(OC(C)C)cc2)C1 2226766804 RWDXREVWEZUKEH-HNNXBMFYSA-N 265.353 2.061 10 10 CECE COc1ccc(N2CCOC[C@@H]2C[C@H](C)O)cc1Cl 2226923092 SUXZGMXAKJLYOR-JQWIXIFHSA-N 285.771 2.325 10 10 CECE C[C@H](Nc1cnn2c1OCCC2)c1ccc(O)cc1O 2237192486 RWAWCIOEIOTECS-VIFPVBQESA-N 275.308 2.250 10 10 CECE COCCNC[C@H]1C[C@H]1COc1ccc(N(C)C)cc1 2237680965 ULYSIOFCZJGGOI-KGLIPLIRSA-N 278.396 2.004 10 10 CECE CC[C@H](C)C[C@@](O)(CN)COc1ccc(N(C)C)cc1 2237695556 JIELDLXSJLXNRE-XJKSGUPXSA-N 280.412 2.257 10 10 CECE COc1ccc(O)c(CN[C@H](C(F)F)[C@H]2CCOC2)c1 2239525732 PNLGMIACNNAXEJ-ZANVPECISA-N 287.306 2.161 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1CC([N+](=O)[O-])C1 2240014708 PQKRLFKXPPSXTQ-UHFFFAOYSA-N 275.352 2.102 10 10 CECE CC(=O)c1ccc(O)c(CN2CCOC[C@H]2C(C)C)c1 2240257719 LNIUGJGHMIZMFY-HNNXBMFYSA-N 277.364 2.452 10 10 CECE CCN(CCS(C)(=O)=O)c1ccc([C@@H](C)NC)c(C)c1 2285140302 QEDMZRUJRSVVRB-CYBMUJFWSA-N 298.452 2.146 10 10 CECE CSC1CC(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2248492105 RNWFIKUSPOYYLM-YDYPAMBWSA-N 254.359 2.476 10 10 CECE CSc1ncc(CNC[C@@H]2[C@H](CO)C2(C)C)s1 2248738345 SKTTXILJIWQZCN-ZJUUUORDSA-N 272.439 2.219 10 10 CECE CSc1ncc(CNC[C@@H]2CNCC2(C)C)s1 2248736319 OEKOXXSZUMDOTI-SECBINFHSA-N 271.455 2.200 10 10 CECE Oc1ccc(Cl)cc1CNCCN1CC[C@H]2C[C@@H]21 2261362695 VJGDKVNGZKTBEL-GWCFXTLKSA-N 266.772 2.229 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2ccccc2N)C1 2271368760 LRVNYECWMDJUEU-SNVBAGLBSA-N 259.313 2.431 10 10 CECE CN(CC[C@H]1CCO1)c1ccc(CN)c(F)c1F 2263972890 SNLLQIAOTXOTSV-JTQLQIEISA-N 256.296 2.039 10 10 CECE CCNCc1ccc(N2CCC=C[C@@]2(C)CO)cc1 2264396639 PYBKDHBFYCMYTB-INIZCTEOSA-N 260.381 2.313 10 10 CECE Cc1cc(N(C)CC[C@H]2CCO2)ccc1C[C@@H](C)N 2278541908 NVGMUJSFUIFQSQ-CJNGLKHVSA-N 262.397 2.500 10 10 CECE C[C@@H](O)c1ccc(N2CC(C)(C)OC[C@H]2C)cc1O 2268772355 JEXVXSCXRXMRPL-GHMZBOCLSA-N 265.353 2.449 10 10 CECE CC[C@@H](C)[C@H](N[C@H](C)c1ccc(C)cc1O)C(N)=O 2278845368 GXVIJMBJJYEPRZ-GYSYKLTISA-N 264.369 2.251 10 10 CECE COc1ccc(N(C)[C@@H]2CC[C@H](C)[C@@](N)(CO)C2)cc1 2279052435 AXTZOSODIXDFQQ-BJJXKVORSA-N 278.396 2.010 10 10 CECE COc1ccc(N2CC[C@@H](CO)[C@@H]2C)c2c1CCC2 2269179525 WVDKZLCOVLGIAW-RYUDHWBXSA-N 261.365 2.391 10 10 CECE CC[C@H]1CN(c2ccc([C@@H](C)N)c(C)c2)C[C@H]1CO 2269664642 CQMQSDFSKXHBPF-RDBSUJKOSA-N 262.397 2.469 10 10 CECE COc1ccc(N2CC[C@@H]3[C@@H](CO)[C@@H]3C2)c2c1CCC2 2284606779 MHFFIGSQDUVWLM-NILFDRSVSA-N 273.376 2.249 10 10 CECE CCn1nncc1CN(C)c1ccc([C@H](C)O)c(C)c1 2285175485 LDJMUGDWBYIBDZ-LBPRGKRZSA-N 274.368 2.296 10 10 CECE Cc1cc(N2CCC(OCCO)CC2)ccc1[C@H](C)O 2285151993 VUYYJFPZNFCHRU-ZDUSSCGKSA-N 279.380 2.026 10 10 CECE COc1cc(OC)c(N(C)C2(CO)CCC2)c(OC)c1 2287130504 ZOASCZWNWQZJKW-UHFFFAOYSA-N 281.352 2.064 10 10 CECE Cc1c(CN2C[C@H]3C[C@]3(CN)C2)n(C)c2ccccc12 2288250306 QOHAZSIDCVJOHJ-DYVFJYSZSA-N 269.392 2.267 10 10 CECE CC(C)C1(OC(=O)CCOc2ccc(N)cc2)COC1 2288571800 RSKOAJQFRGNODU-UHFFFAOYSA-N 279.336 2.006 10 10 CECE COc1cccc(O)c1CN[C@@H]1CCCN(C2CC2)C1 2288809478 ZTKSLXQFACOBBW-GFCCVEGCSA-N 276.380 2.117 10 10 CECE OCC1(C(F)F)CCN(c2ccc3c(c2)CCO3)CC1 2289963642 NTOLVCMAHMLJEH-UHFFFAOYSA-N 283.318 2.466 10 10 CECE CN[C@@H](c1ccccc1O)[C@@](C)(O)CCSC 2301805983 RTMCSPPMSDNKOR-STQMWFEESA-N 255.383 2.157 10 10 CECE Cc1ccc(CN2CC[C@](C)(N)C2)c(O)c1Br 2307474908 NVROTZYXJZIYOQ-ZDUSSCGKSA-N 299.212 2.386 10 10 CECE Cc1cccc(CNC(=O)C=Cc2ccc(O)c(O)c2)n1 2307986738 XKLYFECJZCRQOU-UHFFFAOYSA-N 284.315 2.131 10 10 CECE CCO[C@H]1CC[C@@H](C(=O)N(CC)CCN=[N+]=[N-])C1 2315992742 QTLGVAXNGFDZDR-MNOVXSKESA-N 254.334 2.350 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H]1C[C@H](F)C1 2327445296 DEBDMSRRNJRYQL-HAQNSBGRSA-N 252.333 2.328 10 10 CECE Cc1cccc(O)c1CN1[C@H]2CC[C@@H]1C[C@@H]2C(=O)O 2329335045 MACXVJZNAKFOHG-MDZLAQPJSA-N 261.321 2.138 10 10 CECE COc1ccn(CCCc2ccc(N)cc2)c(=O)c1 2335261389 VWAZKHXHMFGDPV-UHFFFAOYSA-N 258.321 2.072 10 10 CECE CCN1[C@H]2CC[C@@H]1CN(c1ccc(CN)c(C)c1)C2 2335518365 GBGXPABLVXSWGH-IYBDPMFKSA-N 259.397 2.127 10 10 CECE CC[C@@]1(C)[C@H](O)CCN1c1ccc2c(c1)CC[C@@H]2N 2336759759 TZLMJHMIZIKKEU-XHSDSOJGSA-N 260.381 2.372 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C[C@H]1COC2(CCC2)CO1 2338087713 HYGGQSLDZAZMFR-NEPJUHHUSA-N 266.345 2.099 10 10 CECE OCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)cc1C1CC1 2339161420 RLXTZIRHIINUKU-IMJJTQAJSA-N 259.349 2.016 10 10 CECE CC1(C)C[C@@H](CN2CCC[C@H]2CN=[N+]=[N-])OC(=O)N1 2343113169 LKVQZAYNWCUYNC-UWVGGRQHSA-N 267.333 2.038 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@]12C[C@H]1CC[C@H]2N 2355673406 NYLKZAVTCNWVGT-KYXHQGGESA-N 274.364 2.039 10 10 CECE CC[C@@](C)(CN)CN1CCN(c2ccc(OC)cc2)CC1 51212306 MVJGIJRYBHDZLZ-KRWDZBQOSA-N 291.439 2.192 10 10 CECE Cc1cc(O)c(CN2CCN(c3cccnn3)CC2)cc1C 170638935 LXMHHBKQLUVFRJ-UHFFFAOYSA-N 298.390 2.121 10 10 CECE Cc1cccc(CN2CCC(n3cncn3)CC2)c1O 179902233 MTXPPEGUHSNSRP-UHFFFAOYSA-N 272.352 2.129 10 10 CECE CCN(C(=O)NCc1cc(OC)ccc1O)C(C)C 114602385 IBRRRALYNQDEDI-UHFFFAOYSA-N 266.341 2.341 10 10 CECE CCNCc1ccc(N(C)[C@H](C)CO)c(Cl)c1 122696160 ZGDBLLHUYUKCPE-SNVBAGLBSA-N 256.777 2.267 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H](N)C[C@@H]3C[C@H]3CF)ccc21 2357155132 OTGYZQZNCDAJJU-RZLSGREXSA-N 278.371 2.035 10 10 CECE CC[C@H](C)CN(C)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 301684146 KUIRQZKJNWYVTA-VIFPVBQESA-N 293.323 2.408 10 10 CECE Nc1ccc(CCN2C[C@@H]3CCC[C@@](CO)(C3)C2)cc1 2357618890 QOPBMXINAUXFIJ-NVXWUHKLSA-N 274.408 2.296 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)c(F)c1 2358071509 UIJCYJRYIKHMJM-ZENOOKHLSA-N 278.371 2.142 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccc(O)cc1F 231732993 XMXMORDBGDKLBY-UHFFFAOYSA-N 252.249 2.352 10 10 CECE O=C(O)/C=C\c1ccc(N2CCn3ccnc3C2)cc1 213416936 PXOIEDVZANNWEA-UTCJRWHESA-N 269.304 2.001 10 10 CECE N[C@@H](CCO)c1c(O)cc(Cl)cc1Br 218849689 CALFVBHOOIOHKO-ZETCQYMHSA-N 280.549 2.190 10 10 CECE Cc1cc(Cl)cc(CN2CCC(C(N)=O)CC2)c1O 183468290 MYWJYZWDFSNSAZ-UHFFFAOYSA-N 282.771 2.051 10 10 CECE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H]1CCOC1 132069566 CSIRMKFQCFKDDD-SNVBAGLBSA-N 286.715 2.175 10 10 CECE CC(C)(CO)[C@H](N)c1c(F)ccc(Br)c1O 95706724 UMAKXXRNFWKHPX-SNVBAGLBSA-N 292.148 2.312 10 10 CECE C[C@H](N[C@@H]1CCCC[C@@H]1O)c1c(O)cccc1O 235529137 JSOQIFHLTONZAW-AXFHLTTASA-N 251.326 2.052 10 10 CECE C[C@@H](N)c1c(Br)cc(F)c(F)c1O 238415847 HNLUWOFZBUQTOO-GSVOUGTGSA-N 252.058 2.453 10 10 CECE C[C@H]1C[C@@H](NCC2COC2)c2c(O)ccc(F)c21 528027481 UHEQOVOCMINOIV-GZMMTYOYSA-N 251.301 2.316 10 10 CECE CNCc1ccc(N2CCO[C@@H]3CCC[C@@H]32)c(C)c1 50562262 ASHAXBQDWMPGIA-JKSUJKDBSA-N 260.381 2.472 10 10 CECE CCOC(=O)[C@@H](F)c1cc(O)c(O)cc1Br 259886063 NVFQWHYOMOJEBW-VIFPVBQESA-N 293.088 2.434 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@H](C)CO)c(F)c1 252814231 SQEZUUYVIKLKOE-MNOVXSKESA-N 254.349 2.313 10 10 CECE Cc1cc(S[C@H](C)C(=O)Nc2ccc(N)cc2)n(C)n1 52308762 XAIWKXNVKIPENX-SNVBAGLBSA-N 290.392 2.430 10 10 CECE CC[C@H](N)CN(C)Cc1ccc2c(c1)CCCN2C 1236865262 HNMXPVNTQZRXFA-HNNXBMFYSA-N 261.413 2.238 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1ccoc1C1CC1 282829376 SBTXMITXNLMTQE-UHFFFAOYSA-N 273.288 2.498 10 10 CECE CCCCOCCNCc1ccc(OC)cc1O 40906849 ALHSRGSWXZFDSU-UHFFFAOYSA-N 253.342 2.307 10 10 CECE COc1ccc(O)c(CNC(=O)N[C@@H]2CSC2(C)C)c1 802162999 ZKJFRNMPDUFFSI-GFCCVEGCSA-N 296.392 2.094 10 10 CECE CC(C)(C)OCCCCNCc1ccc(O)c(O)c1O 2163649986 CVBCSDBRDIDFNB-UHFFFAOYSA-N 283.368 2.488 10 10 CECE COc1ccc(N2[C@H](CN)C[C@H]3CCC[C@H]32)cc1OC 2164799609 WQSRDDURKMFSIT-KWCYVHTRSA-N 276.380 2.410 10 10 CECE C[C@@H](NCCN1C[C@H]2CC[C@H]1C2)c1cc(O)ccc1O 2164878241 LDPVXCAJHVJVQZ-AGIUHOORSA-N 276.380 2.233 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3COCCC3(F)F)ccc21 2166689507 ZCOCYGHJDSCMME-JSGCOSHPSA-N 283.318 2.384 10 10 CECE COc1ccc(N2CCNC[C@@]2(C)C2CC2)c(OC)c1 2162662391 PFCWVCVMNBHYFD-INIZCTEOSA-N 276.380 2.282 10 10 CECE CN1CCc2cc([C@@H](O)C(=O)[C@H]3[C@H]4CCC[C@H]43)ccc21 2168159312 UAMLNSGXWDNKAH-OCVGTWLNSA-N 271.360 2.328 10 10 CECE CCNC(=O)CN(C)c1ccc([C@H](C)NC)c(Cl)c1 723167803 XPAYPGVXAFTJSC-JTQLQIEISA-N 283.803 2.193 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]23C[C@H]4CC[C@@H](N4)[C@@H]2C3)cc1 2163063915 UAQXDCFKBZLMPK-LMLQULGWSA-N 272.392 2.317 10 10 CECE CCN1CCc2cc([C@@H](N)c3cc(C)n(C)n3)ccc21 2163073459 JHBCGUWPXCUIMU-MRXNPFEDSA-N 270.380 2.159 10 10 CECE C[C@@H]1CNCC[C@H]1[C@H](O)c1ccc2c(c1)CCCN2C 2163103718 XCQSLRIRKABFMU-SRCQZFHVSA-N 274.408 2.348 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](CO)[C@H](C)C2)cc1O 2165335213 ADGKMOVBNCNCFZ-JHJVBQTASA-N 278.396 2.127 10 10 CECE CCN(CC)c1ccc(CN2C[C@H]3CC[C@H]2CN3)cc1 817865652 WPJDFSNWEXDKHS-WBVHZDCISA-N 273.424 2.469 10 10 CECE Oc1c(Cl)cccc1CN1CC[C@@]2(O)C[C@H]2C1 827290904 HYEUPZZYYJUESK-GXFFZTMASA-N 253.729 2.002 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CC(=O)NC2CC2)cc1 723183689 WEPUCKIHWYNLKE-LBPRGKRZSA-N 275.396 2.072 10 10 CECE CO[C@@]1(CN(C)CCc2ccc(N)cc2)CCSC1 2129727994 VXVXTAPDUAIFKU-OAHLLOKOSA-N 280.437 2.265 10 10 CECE CCN[C@H](C)c1ccc(N(C)C[C@@H]2CCN2C)cc1 2129883389 XYBZRIJOZNRNBY-CJNGLKHVSA-N 261.413 2.497 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H](C)[C@](C)(CN)C3)ccc2O1 720057889 ULLJKIOKCKSTIW-HWWQOWPSSA-N 260.381 2.431 10 10 CECE CCNC(=O)CN(C)c1ccc([C@H](CC)NCC)cc1 723167759 VRKXFKMRXMYDAV-HNNXBMFYSA-N 277.412 2.320 10 10 CECE Nc1ccc(CN2[C@H](C(=O)O)C[C@H]3CCC[C@H]32)cc1 1891603550 JANJDGWTUWSCKI-BNOWGMLFSA-N 260.337 2.096 10 10 CECE CC1(C)COC[C@@H]1NC(=O)NCc1cc(Cl)ccc1O 845239065 DZCZFXHEOMVDBG-LBPRGKRZSA-N 298.770 2.270 10 10 CECE C[C@H](NCC(C)(C)[C@]1(O)CCOC1)c1ccccc1O 842918088 YTSLUASGWVWKKL-LRDDRELGSA-N 279.380 2.220 10 10 CECE C[C@@H](Cn1cncn1)N[C@H](C)c1ccc(Cl)cc1O 841746597 IZLMYZCWCKKWIB-VHSXEESVSA-N 280.759 2.376 10 10 CECE C[C@@H](C(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCCO1 913726104 IEENNEUDLURRIZ-YGRLFVJLSA-N 261.321 2.050 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@]2(C1)CC2(F)F 846621021 MZXZRPOZPRETBV-KWEXDPCDSA-N 295.285 2.369 10 10 CECE CCCCC[C@H](O)C(=O)NCc1c(O)cccc1F 928705882 MGLZTQPEQUPQHY-ZDUSSCGKSA-N 269.316 2.089 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2cc(N)ccn2)c1 925765747 DPNYDPIBNPGJOO-SNVBAGLBSA-N 273.336 2.229 10 10 CECE O=C(O)/C=C\c1ccc(N2CCO[C@H](CCF)C2)cc1 691990753 JONDRFLPRJREFZ-JHAQOBCDSA-N 279.311 2.349 10 10 CECE O=C(NCc1cc(Br)ccc1O)OCCF 859157533 INVSHAMXXNXGRV-UHFFFAOYSA-N 292.104 2.350 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCN2C)c1 185141865 TWXDGJBHYKEHIE-NEPJUHHUSA-N 264.369 2.146 10 10 CECE CC(C)N[C@@H]1CCCN(c2ccc3c(c2)OCO3)C1 71198614 HPKRWMARTNZHOJ-GFCCVEGCSA-N 262.353 2.382 10 10 CECE COc1cc2c(cc1OC)N(C)CC/C2=C\C(=O)O 84145790 FDOZIYBYMLRCIA-RMKNXTFCSA-N 263.293 2.012 10 10 CECE CN(CC(=O)N1CCCC1)Cc1ccc(Cl)cc1O 1462471046 VQSIVWXJEIYAFS-UHFFFAOYSA-N 282.771 2.100 10 10 CECE CCC1(CC)CN(CCN)c2ccc(OC)cc2N1 76931012 PSUZDEQQTQVWFY-UHFFFAOYSA-N 263.385 2.445 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)CCc2ccncc2)C1 701290658 COXLNZDPKDHWFR-LBPRGKRZSA-N 259.313 2.316 10 10 CECE CCO[C@@H]1CCN(c2ccc([C@@H](C)O)cc2F)C1 701707266 SOUPDYNXILBOHM-ZYHUDNBSSA-N 253.317 2.494 10 10 CECE CSCCN(C)Cc1cc(C(C)=O)ccc1O 167786538 LDLFZGSIQPJSNO-UHFFFAOYSA-N 253.367 2.390 10 10 CECE Oc1c(CNCCN2CC=CCC2)ccc(F)c1F 703417042 GZHPQKOYZNPMDG-UHFFFAOYSA-N 268.307 2.022 10 10 CECE CC(C)(O)[C@@H]1CCCN(c2ccc(CO)cc2F)C1 719676361 OTTPSYCIPUVESU-GFCCVEGCSA-N 267.344 2.305 10 10 CECE C[C@@H]1OC[C@@H](NCc2cc(F)cc(F)c2O)[C@H]1C 708454810 SHTCUIJWWMSLLJ-YVZVNANGSA-N 257.280 2.183 10 10 CECE C[C@H](NC[C@@H]1[C@@H](C(=O)O)C1(F)F)c1cc(F)ccc1O 715296068 LPOCTYQDJXDLBJ-OIVXANJASA-N 289.253 2.148 10 10 CECE CO[C@@H]1CCC[C@@H]1N(C)c1ccc(CN)c(F)c1 687427571 XXNKENRIXYCITR-UONOGXRCSA-N 252.333 2.288 10 10 CECE CNCc1ccc(N(CCN(C)C)C(C)C)c(F)c1 688242613 VGTNFMMRZROSHP-UHFFFAOYSA-N 267.392 2.322 10 10 CECE C[C@@H](N)c1ccc(N2CCC(=O)N(C)CC2)cc1Cl 688959612 OHZVYEGXUWSSQG-SNVBAGLBSA-N 281.787 2.028 10 10 CECE Oc1cc(Br)ccc1CN[C@H]1CCC[C@H]1O 691490678 ZTRYHMGWZDPCCC-WDEREUQCSA-N 286.169 2.158 10 10 CECE NCCC[C@H]1CCCCN1Cc1ccc(O)c(O)c1 693513001 JMLZFWRTSHFLPC-CYBMUJFWSA-N 264.369 2.191 10 10 CECE COC[C@@H](CCNCc1ccc(OC)c(C)c1)OC 694308748 JFKXNNXVQXBDCJ-CQSZACIVSA-N 267.369 2.145 10 10 CECE Cc1nccn1CCCN(C)Cc1ccc(N)cc1 699542694 AJYFUDMQCRQJFK-UHFFFAOYSA-N 258.369 2.296 10 10 CECE C[C@@H]1CN2CCC[C@@H]2CN1c1ccc(CN)cc1Cl 94456720 MRHVNAGYSRHAQX-DGCLKSJQSA-N 279.815 2.472 10 10 CECE NC[C@H]1C[C@@]2(CCN2c2ccc3c(c2)CCCO3)C1 2125790339 KKJDRVYPUWEBMI-YGUOUDRMSA-N 258.365 2.329 10 10 CECE C[C@@H](O)c1ccc(N2CCOCCC2(C)C)cc1O 2125991997 FTAJLGSSKKKTAX-LLVKDONJSA-N 265.353 2.451 10 10 CECE Nc1ccc(CCOc2ncnc3c2CCC3)cc1 2119780450 QROPEBBERYMAPG-UHFFFAOYSA-N 255.321 2.169 10 10 CECE CN1CC[C@@H](CN(C)c2cc(Cl)c(CN)cc2F)C1 2120880347 YBXRYFYWPNJFJE-SNVBAGLBSA-N 285.794 2.326 10 10 CECE OC[C@@H]1CCCCN1c1ccc2c(c1)CCC[C@H]2O 2128276851 GPGQOKSXBAVLJO-GOEBONIOSA-N 261.365 2.408 10 10 CECE OCc1cc(F)c(N2CC[C@@H]3CCO[C@@H]3C2)c(F)c1 2128308060 YUDXXPWUJREKRU-ZWNOBZJWSA-N 269.291 2.072 10 10 CECE CO[C@H]1CN(c2ccc3c(c2)CC[C@H]3O)CC12CC2 2128325449 SSHFZBIOTLJWNS-CABCVRRESA-N 259.349 2.281 10 10 CECE CC1(C)OCCO[C@H]1CN1CCC[C@@H](CN=[N+]=[N-])C1 2130414734 XXHQFNZHOQFQSS-RYUDHWBXSA-N 268.361 2.203 10 10 CECE Nc1ccc(CCN2CC[C@H]3CCOC[C@@H]3C2)cc1 2129003512 YJMWMDQVOYXTFJ-GJZGRUSLSA-N 260.381 2.170 10 10 CECE CCCN1C[C@H]2C[C@H]1CN2Cc1cccc(F)c1O 2131020970 USEGECIBXLIKLP-QWHCGFSZSA-N 264.344 2.200 10 10 CECE Cc1ccc([C@H](C)N(C)C2COCCOC2)c(O)c1 2131480851 JTAIZPOUQWBJRO-LBPRGKRZSA-N 265.353 2.109 10 10 CECE OCc1ccc(N2CC[C@@H]3COC[C@H]32)c(Br)c1 1910357502 QFPBMSZCHOLCNI-ZWNOBZJWSA-N 298.180 2.167 10 10 CECE C[C@@]1(C(=O)N2CCC(CN=[N+]=[N-])CC2)CCCOC1 2133604223 LZDCADDGGGHZDO-CYBMUJFWSA-N 266.345 2.352 10 10 CECE Cc1ccc(F)cc1S(=O)(=O)N1CC[C@H](N=[N+]=[N-])C1 1912170608 ZICHMIRFPLOAHY-JTQLQIEISA-N 284.316 2.207 10 10 CECE CC(C)OC(=O)CN1CCCC[C@@H](CN=[N+]=[N-])C1 1912182273 ZMEZAWOIDZEHDD-NSHDSACASA-N 254.334 2.350 10 10 CECE CCC(CC)NC(=O)[C@H](C)N1CCC[C@@H](N=[N+]=[N-])C1 1912177684 GUIXZVPTJIWUBE-CMPLNLGQSA-N 267.377 2.454 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)c2cc(Cl)c[nH]2)C1 1912152017 NZJHJXKRYCLWKC-ZETCQYMHSA-N 253.693 2.441 10 10 CECE C[C@@H]1CC(C(=O)N(C)CCCN=[N+]=[N-])C[C@@H](C)O1 1912186268 BOMOPFCBUCIYIG-NXEZZACHSA-N 254.334 2.349 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CC[C@H]2CC[C@H]1C2 1912173293 KSDCVVMZOAXTTG-SCVCMEIPSA-N 252.318 2.310 10 10 CECE CN(CCCN=[N+]=[N-])S(=O)(=O)C[C@@H]1CC[C@H](F)C1 1912155317 PNMGNFXRQQYCPS-ZJUUUORDSA-N 278.353 2.087 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1 1912200436 HLGGTKRHMGGCTN-VIFPVBQESA-N 276.296 2.260 10 10 CECE [N-]=[N+]=N[C@H]1CCN(CC(=O)Nc2c(F)cccc2F)C1 1912201409 UHPZRFROYHSLMV-QMMMGPOBSA-N 281.266 2.288 10 10 CECE CNCc1cc(F)c(N2C[C@H](CO)C(C)(C)C2)c(F)c1 1914034887 PLQNQOWEHGXAPS-LLVKDONJSA-N 284.350 2.139 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@H]2CCN(C)C2)c(F)c1 109572699 DBCZBFPBGKRLHG-RYUDHWBXSA-N 265.376 2.233 10 10 CECE Cc1[nH]nc2ncc(C(=O)N[C@H](C)c3ccccc3O)cc12 1454799160 SIZXSMCKDPEYFF-SECBINFHSA-N 296.330 2.463 10 10 CECE NCc1cc(F)c(N2CC3(CCOCC3)C2)c(F)c1 1915825252 BOTZADDKAGMSIX-UHFFFAOYSA-N 268.307 2.040 10 10 CECE CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H](CO)N=[N+]=[N-])C1 1535955419 SKBMNCAYTZIQMH-NXEZZACHSA-N 270.333 2.305 10 10 CECE CCN(CC)c1ccc([C@@H](C(N)=S)N(C)C)cc1 213189418 YMABXCSCCZNHRW-ZDUSSCGKSA-N 265.426 2.422 10 10 CECE CN1N=C(C(F)(F)F)/C(=C/c2ccccc2C(=O)O)C1=O 1865674004 JTOXMRZLPMRHOX-TWGQIWQCSA-N 298.220 2.159 10 10 CECE O=C(NCc1c(O)ccc2ccccc12)c1cccnn1 1472084580 AENHOQMIMAIPNX-UHFFFAOYSA-N 279.299 2.265 10 10 CECE Cc1noc(C)c1[C@@H](C)NCc1ccc(O)c(O)c1O 226756657 HZIHYFORRQYSEH-SSDOTTSWSA-N 278.308 2.259 10 10 CECE C[C@@H](NC(=O)/C=C\c1cn(C)cn1)c1ccccc1O 1557967594 HKLWUQHTLJVFDG-SKVAFPRGSA-N 271.320 2.016 10 10 CECE Cc1ccc(F)c(CC(=O)NCc2ccc(O)cc2O)c1 1626837650 BRTOYRCVIBYVQV-UHFFFAOYSA-N 289.306 2.404 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@@H](O)C23CCC3)c(F)c1 2136740378 YBVFNLPZOZAQSQ-PRHODGIISA-N 268.307 2.088 10 10 CECE Cc1cc(-c2noc(-c3nnsc3N)n2)cs1 1923210752 IHTJYENAAGUBEX-UHFFFAOYSA-N 265.323 2.207 10 10 CECE COc1ccc(N(CC(C)C)C2CNC2)c(F)c1F 2136975110 LYADAXDEMIMOEM-UHFFFAOYSA-N 270.323 2.408 10 10 CECE COCCCCOc1ccc(N2CCC(N)CC2)cc1 228715179 AGJNJJRSQMOKCW-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(C2(C(=O)C=[N+]=[N-])CCCC2)cc1OC 5918265 MLBSSBMIOILHJH-UHFFFAOYSA-N 274.320 2.385 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(OC)c2)C[C@@H](C)O1 2139687220 MJRXBZGFABGRNO-BXUZGUMPSA-N 264.369 2.158 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1C[C@@H]2NCc1ccc(F)cc1O 2139879014 PXCBKBOIPSTFKD-REJLFOLJSA-N 265.328 2.170 10 10 CECE CC1(C)C[C@@H](CCO)CN1c1ccc2c(c1)OCO2 259417512 NFDDSNZOEGHIIY-LLVKDONJSA-N 263.337 2.403 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CC(=O)NCc2ccccc2)CC1 1934379046 XEBICJRDNTZNQL-AWEZNQCLSA-N 287.367 2.468 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H](CO)OC(C)(C)C2)cc1 233886178 XCTIXDOZKCQDOH-HUUCEWRRSA-N 278.396 2.073 10 10 CECE Cc1cc(Sc2nccs2)nc(C(=N)N)c1 1935739045 HENAVODUJWDWQA-UHFFFAOYSA-N 250.352 2.282 10 10 CECE COCC12CC(NCc3c(O)cccc3Cl)(CO1)C2 2141148036 VBXAXLSIZKAYEG-UHFFFAOYSA-N 283.755 2.083 10 10 CECE CNCc1ccc(N2CCC[C@@H](C(=O)NC)C2)cc1Cl 234436423 HOSQVLDDZBYCIJ-GFCCVEGCSA-N 295.814 2.022 10 10 CECE Cc1nc(C(=O)Cc2ccc(N)cc2)c(Br)[nH]1 1940468407 OAQZCPGGJNBKLV-UHFFFAOYSA-N 294.152 2.488 10 10 CECE CO[C@H]1CCN(c2ccc(CNC3CC3)c(C)c2)C1 234852586 OZOXLMBXEGABCE-INIZCTEOSA-N 260.381 2.472 10 10 CECE C[C@@H](CO)N(C)c1ccc(CNC2CC2)c(Cl)c1 235114910 VLPMSFBPSIFWAF-JTQLQIEISA-N 268.788 2.409 10 10 CECE C[C@H](O[C@@H]1CC[C@H]2C[C@@H]21)C(=O)Nc1ccc(N)cc1 2141995348 CKJAEOLZBHFJGS-TXFQPVFDSA-N 260.337 2.411 10 10 CECE C[C@@H]1SCCS[C@H]1[C@@H](NN)c1ccccc1O 1942390357 IVEKTOVFTACVHU-KPXOXKRLSA-N 270.423 2.134 10 10 CECE CN1CCC12CC(CN[C@@H]1CCc3cccc(O)c31)C2 1875868617 QLQFCMZJBVVLTJ-KDJCLPLCSA-N 272.392 2.453 10 10 CECE Cc1ccnnc1CN[C@@H](C)c1ccc(O)cc1O 1877767153 ZWMUMEZMWJCBGK-JTQLQIEISA-N 259.309 2.047 10 10 CECE CN(C)c1ccc([C@H](O)C[C@@]23CC[C@H]2CNC3)cc1 2142554452 ILEYRIMTHGJKLH-NUEKZKHPSA-N 260.381 2.176 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CCC(O)CC2)c(F)c1 1880960462 KMJRAWICELYWPK-VIFPVBQESA-N 270.323 2.206 10 10 CECE CC(C)C[C@@H](CO)CNCc1cc(F)cc(F)c1O 1962904702 UUAHNDMODDSGAP-SNVBAGLBSA-N 273.323 2.415 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1CCCn2ncnc21 1883184359 LNAZRFFFMUFBAO-NSHDSACASA-N 278.743 2.262 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CCCn2ccnc21 1883185730 XLKIPDSCJNRMSL-GFCCVEGCSA-N 261.300 2.353 10 10 CECE COc1cccc(CNC[C@@H](CO)CC(C)C)c1O 1963441383 LGCWIOQQUTWWME-LBPRGKRZSA-N 267.369 2.145 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cncs2)CC1 1949749504 QJGDSGJVUWHKRV-MRVPVSSYSA-N 251.315 2.448 10 10 CECE C[C@@H](NCC(=O)NC1CCC1)c1ccc(N(C)C)cc1 1964479437 BCAOJOFSUPFZTE-GFCCVEGCSA-N 275.396 2.072 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H](CO)C[C@H]2C)c1O 1966216725 QJTSMYLBKLULJA-MWLCHTKSSA-N 297.782 2.451 10 10 CECE Cc1cc(N)cc(NC(=O)Cc2ccc(O)c(O)c2)c1 2144028424 CRFAHTIWFSBJJH-UHFFFAOYSA-N 272.304 2.170 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@H]2CCCOC2)cc1O 251542548 OZEUEFCBFKPYOX-VXGBXAGGSA-N 264.369 2.275 10 10 CECE COc1cccc(CNCC23CC(CCO2)C3)c1O 1967850750 VUOWVGWHCDIVOP-UHFFFAOYSA-N 263.337 2.060 10 10 CECE Oc1cccc(F)c1CN[C@H]1C[C@@H]2CCCCN2C1 1969661388 LVUYYPFLMHNSNP-RYUDHWBXSA-N 264.344 2.248 10 10 CECE C[C@H](N)[C@@H]1CCN([C@H](C)c2ccc(N(C)C)cc2)C1 252784200 OIILDWIOWOIMBW-GZBFAFLISA-N 261.413 2.483 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)c1nccn1C(C)C 2148165567 SVIYOXJGZWVECG-ZIAGYGMSSA-N 275.352 2.164 10 10 CECE Nc1ccc(CCCN2[C@H]3CC[C@@H](C3)CS2(=O)=O)cc1 2144754412 CFCHGGICRHOBNU-ZFWWWQNUSA-N 294.420 2.016 10 10 CECE C[C@@H](NC[C@]1(F)C[C@@H](CO)C1)c1ccc(F)cc1O 1974382740 FDMKEPSNVHQJPH-RULNRJAQSA-N 271.307 2.293 10 10 CECE CC1(C)CC=CCN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2150026581 RZIJBFGJAUHKGD-CYBMUJFWSA-N 276.311 2.356 10 10 CECE NN[C@H](c1ccc2ncccc2c1)c1ccccc1O 2146243918 ZSYUAQFTSHAKJU-MRXNPFEDSA-N 265.316 2.493 10 10 CECE CCNCc1cc(F)c(N2CCC(C)(O)CC2)c(F)c1 160568229 FVTIHDOPBWPWSO-UHFFFAOYSA-N 284.350 2.426 10 10 CECE C[C@H]1CCCCN1CC(=O)N(C)c1ccc(N)cc1 37272010 UUWYPJRIVVMVGT-LBPRGKRZSA-N 261.369 2.106 10 10 CECE CCCN[C@@H](C)c1ccc2c(c1)CCN2CCCO 162192832 DOKCODIBWHEBQB-ZDUSSCGKSA-N 262.397 2.492 10 10 CECE COc1ccc(O)c(CNC[C@H](C)c2cnn(C)c2)c1 2147085494 DWAHQQVWKSHUJK-NSHDSACASA-N 275.352 2.028 10 10 CECE CCN[C@@H](c1ccccc1O)[C@H](O)c1cccc(C)n1 2151325557 ZINSBRLHIRMVGX-JKSUJKDBSA-N 272.348 2.480 10 10 CECE Cc1nc(C(=O)NCC2(CN=[N+]=[N-])CC2)cs1 2006018111 HKNDBDBGOXNCAN-UHFFFAOYSA-N 251.315 2.272 10 10 CECE [N-]=[N+]=NCCCN1C[C@@H](N)CC[C@@H]1C(F)(F)F 2006172241 UYBXDTRPQDZDJG-JGVFFNPUSA-N 251.256 2.041 10 10 CECE CC(C)CN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCOC1 2152129860 CILOVZPGJSAONQ-OAHLLOKOSA-N 276.380 2.085 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H](C(N)=O)C1CC1 2152806821 LUQSJTYSDJKPTH-VPJDZLOFSA-N 274.364 2.102 10 10 CECE CCn1cncc1CN(C)c1ccc([C@@H](C)O)c(O)c1 2153015948 ZMWFYFYVNDTUDZ-LLVKDONJSA-N 275.352 2.298 10 10 CECE COc1ccc(CN2CC[C@@H](CC(=O)O)[C@H]2C)c(O)c1 2153496905 XQIUCRKJOSKPGC-MNOVXSKESA-N 279.336 2.086 10 10 CECE Oc1ccc(Br)cc1CN[C@@]12CCOC[C@H]1C2 2018538568 OIHDAMSJIBDKMJ-ZWNOBZJWSA-N 298.180 2.423 10 10 CECE CCNC[C@H]1CCN(c2ccc3c(c2)OCCCO3)C1 53010931 USYQTTPNOUEPQH-CYBMUJFWSA-N 276.380 2.284 10 10 CECE Nc1ccc(COc2nncc3ncsc23)cc1 2029184624 BNTVEAOVEJZNFM-UHFFFAOYSA-N 258.306 2.248 10 10 CECE C[C@@H](NCc1ccc(O)c(O)c1O)[C@H]1CCSC1 2029412443 YCDZFPSANKFUNF-SCZZXKLOSA-N 269.366 2.035 10 10 CECE CC1(C)COCCN(c2ccc(CN)cc2F)C1 2029566378 BJGNLDGDDPAGLC-UHFFFAOYSA-N 252.333 2.147 10 10 CECE CCC[C@@H](CNCCc1ccc(O)c(O)c1)OC 2031080193 WDLYEWMQZNFUEL-LBPRGKRZSA-N 253.342 2.045 10 10 CECE CCc1cnc([C@@H](O)[C@@H](N)c2ccccc2O)s1 2031148284 SEVIVJJALOOPDQ-RYUDHWBXSA-N 264.350 2.145 10 10 CECE COc1ccc(N2C[C@H](C)OCC[C@H]2C)c(N)c1 2031616542 TVXGMRZUWYMDHL-MNOVXSKESA-N 250.342 2.281 10 10 CECE CNCc1cc(F)c(N2CCC[C@H]2CN(C)C)c(F)c1 62719152 ALHINOPOIKENRL-LBPRGKRZSA-N 283.366 2.215 10 10 CECE C[C@]12CCCN(CCOc3ccc(N)cc3)[C@@H]1COC2 2159840635 WPKLQQZXQKGSDK-HZPDHXFCSA-N 276.380 2.149 10 10 CECE 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Oc1cccc([C@@H]2NCCc3ccc(F)cc32)c1O 83596314 FLBXOIBYLUMZTO-AWEZNQCLSA-N 259.280 2.472 10 10 CECE C[C@@H](N)c1ccc(N2CC(C)(C)CC[C@@H]2CO)cc1O 701646317 BFJYCEGZHUELGZ-DGCLKSJQSA-N 278.396 2.399 10 10 CECE COCC(COC)N(C)c1ccc([C@@H](C)N)c(Cl)c1 701634723 OOHKGJXYLKIQTC-SNVBAGLBSA-N 286.803 2.457 10 10 CECE C[C@@H]1CC[C@@H](NCc2cc(F)cc(F)c2O)CO1 708467340 YXXMJONBKHQUCO-LDYMZIIASA-N 257.280 2.328 10 10 CECE CNCc1cc(F)c(N(C)[C@H]2CCC[C@@H]2O)c(F)c1 709477883 SFMWRDLOQDHZCV-STQMWFEESA-N 270.323 2.034 10 10 CECE C[C@H](c1cn(C)cn1)N(C)c1ccc(CN)c(F)c1F 710492006 LJRPXQDDXXKVCG-SECBINFHSA-N 280.322 2.354 10 10 CECE CC[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(N)cc2)CO1 688480070 SKEGKMJSJAOUJY-OLZOCXBDSA-N 263.341 2.300 10 10 CECE C[C@@H]1CCCN(c2ccc(CO)cc2Cl)[C@H]1CO 688660149 DYIPQPLIJVHADP-YGRLFVJLSA-N 269.772 2.430 10 10 CECE C[C@H](N)c1ccc(N2CCSC[C@@H]2CCO)cc1 689726366 KFRSMLJMFJHTGQ-FZMZJTMJSA-N 266.410 2.011 10 10 CECE CCc1cccc(CN(CC)CC(=O)NC(C)C)c1O 692094302 WEMWHVNPWWREJG-UHFFFAOYSA-N 278.396 2.301 10 10 CECE O=C(NCC1C[C@H]2[C@H](C1)C2(F)F)c1cccc(O)c1O 693384328 XLIKQNFVYSDOKR-UWVGGRQHSA-N 283.274 2.119 10 10 CECE C[C@]1(C(F)F)CN(c2ccc(CN)c(F)c2F)CCO1 698750514 ITRBCQQRJJVWST-CYBMUJFWSA-N 292.276 2.284 10 10 CECE CCC[C@H]1COC[C@@H]1Nc1c(N)cccc1C(=O)O 699840190 QGWUIEJLQQRPHV-CABZTGNLSA-N 264.325 2.194 10 10 CECE Cc1nc(-c2noc(-c3cccc(O)c3O)n2)[nH]c1C 699932921 ZSZJXPPOXVADDL-UHFFFAOYSA-N 272.264 2.155 10 10 CECE COc1ccc(CN2CCC(CC(=O)O)CC2)c(O)c1 93682260 QSTHHJSTRHNPLX-UHFFFAOYSA-N 279.336 2.088 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@](F)(CO)C2)c(F)c1 1917074317 OWODWAMTKMBYRT-ABAIWWIYSA-N 284.350 2.407 10 10 CECE O=C1C(=O)[C@H](c2ccccc2)C(=O)[C-]1c1ccccc1 1088695533 BBJWRTZADIRLIX-CYBMUJFWSA-N 263.272 2.114 10 10 CECE Cc1cc(N(C)[C@H](CCO)C(F)(F)F)ccc1CN 2121999046 VREOAPLNQBNBBZ-GFCCVEGCSA-N 276.302 2.203 10 10 CECE C[C@@H]1O[C@H](C)[C@H](C(=O)NCC2(CN=[N+]=[N-])CC2)[C@@H]1C 2117731111 IBQCFCISMVNXMK-LMLFDSFASA-N 266.345 2.253 10 10 CECE 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2129079619 JHBKTVDAJLVNHL-VXGBXAGGSA-N 274.286 2.258 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@@H]1C[C@@H]2CCC[C@@H]21 2132223736 OTBFYHREPJFTDU-JBLDHEPKSA-N 261.321 2.358 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@H]2CC(=O)N(C)C2)cc1Cl 2131958868 UXSCQBZYTLJKFL-KOLCDFICSA-N 281.787 2.027 10 10 CECE CC1(C)NC[C@]1(O)c1ccc(N2CCCCC2)cc1 2132325346 MHAHXEBGZCEFSM-INIZCTEOSA-N 260.381 2.246 10 10 CECE C[C@@H](c1cc(Cl)ccc1O)N(C)C1COCCOC1 2131481528 QSKLSNMAFJCKNS-JTQLQIEISA-N 285.771 2.454 10 10 CECE Cc1ccc(CN2CC(C)(O)C2)c(O)c1Br 1905138286 MXHXYFYVPIYTSM-UHFFFAOYSA-N 286.169 2.030 10 10 CECE CC(C)N(C(=O)CN1CC[C@@H](N=[N+]=[N-])C1)C(C)C 1912206625 KLRKJKQCFXOEGH-LLVKDONJSA-N 253.350 2.016 10 10 CECE N[C@@H](c1ccccc1O)[C@]1(O)C[C@H]2CC[C@H]1C21CC1 1906354592 HFLGSIJQHMTWBU-NCFRWKGYSA-N 259.349 2.333 10 10 CECE C[C@H](N[C@H]1CCN2CCCC[C@@H]12)c1ccc(O)cc1O 217683916 BIUYBKRPLYXMER-CQDKDKBSSA-N 276.380 2.375 10 10 CECE C[C@]1(O)CCCC[C@@H]1N1CCc2cc(CN)ccc21 2133389959 ONYCIEHHOQUPHQ-HOTGVXAUSA-N 260.381 2.201 10 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C[C@H](O)c1ccc(N(C)C2COC2)cc1Br 1915699011 ADBROXMBTYTUCG-QMMMGPOBSA-N 286.169 2.337 10 10 CECE CC(C)(C)c1n[nH]cc1C(=O)NCc1c(O)cccc1O 1456325988 VNELUOSBHMWLCK-UHFFFAOYSA-N 289.335 2.048 10 10 CECE COc1ccc(F)cc1C(=O)NCc1cccc(O)c1O 1471644810 ZHCVPIMEPBGEHA-UHFFFAOYSA-N 291.278 2.176 10 10 CECE CCN(C)c1ccc(CN2CC[C@@]3(CCOC3=O)C2)cc1 1648658080 PGUXBFWPGBXYLN-QGZVFWFLSA-N 288.391 2.282 10 10 CECE CC1(NC(=O)[C@@H]2CNc3ccccc3N2)CCCC1 229882061 UWUVAXCLPDLDAQ-ZDUSSCGKSA-N 259.353 2.342 10 10 CECE CC1=CCCN(c2cc3c(cc2Cl)[C@@H](N)C(=O)N3)C1 230814351 FBJRKEWKHOLEGY-CYBMUJFWSA-N 277.755 2.448 10 10 CECE COc1ccc([C@@H](C)N(C)Cc2nccn2C)c(O)c1 134103189 NHFKFLFQLKGSHR-LLVKDONJSA-N 275.352 2.327 10 10 CECE CC1=CC2=NC(=O)/C(=C\c3cccs3)C(=N)N2O1 5701410 LQENOSZPFHFJEF-HPLIZGGFSA-N 259.290 2.198 10 10 CECE CCC[C@@H](C(=O)NCc1ccc(N(C)C)cc1)N(C)C 161275517 SNHUQPMPUDUADD-HNNXBMFYSA-N 277.412 2.099 10 10 CECE CS[C@@H](C)CNC(=O)CCc1ccc(N)cc1 162419745 HNXGBOFGKOYXEL-JTQLQIEISA-N 252.383 2.069 10 10 CECE 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10 10 CECE CCCCCC(=O)NCCOc1ccc(N)cc1 38079590 KJLZJGIJUMFDHZ-UHFFFAOYSA-N 250.342 2.344 10 10 CECE C[C@@H]1OCC[C@@H]1CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1885775770 DMYLRVSMFBJFTE-QJPTWQEYSA-N 266.345 2.350 10 10 CECE COC1(CNCc2cc(Br)ccc2O)CC1 1964595789 YXYPIUKKKIHLGT-UHFFFAOYSA-N 286.169 2.423 10 10 CECE CCN(Cc1ccc(O)c(O)c1)[C@H]1CCCC[C@H]1CN 249714032 QTDZIDCBWAJLQR-KBPBESRZSA-N 278.396 2.437 10 10 CECE O=C(CCNCc1ccc(F)cc1O)N1CCCCC1 1964563002 KNFGUFXKAGMMQI-UHFFFAOYSA-N 280.343 2.024 10 10 CECE CC(C)[C@@H](CN[C@H](C)c1cc(O)ccc1O)N(C)C 20145711 GIXBDXRAMWEFBY-BXUZGUMPSA-N 266.385 2.335 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@@H]3CNC[C@H]3[C@H]2C)c1 251147287 GEBPVNVSICERMY-XFMPKHEZSA-N 260.381 2.301 10 10 CECE COc1ccc(N(C)CCn2nc(C)nc2C)cc1 1968599823 STVQORJDHLUSNX-UHFFFAOYSA-N 260.341 2.040 10 10 CECE C[S@@](=O)CCCCNCc1cc(Cl)ccc1O 2001782651 BVMPORNCSFOQDH-QGZVFWFLSA-N 275.801 2.294 10 10 CECE C[C@@H]1CCN[C@@H](C(=O)N(C)[C@H](C)c2ccccc2O)C1 253150715 GAJLTMOXBYEEJZ-YRGRVCCFSA-N 276.380 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C[C@@H]1SCCN(c2ccc(CO)c([N+](=O)[O-])c2)[C@H]1C 2132055636 VCQWMYWABRJFMK-UWVGGRQHSA-N 282.365 2.417 10 10 CECE CCN1C[C@H]2C[C@H]1CN2[C@@H]1CCc2cccc(O)c21 2131023345 BMRPLIRXIZVYTE-BFHYXJOUSA-N 258.365 2.158 10 10 CECE COc1cc(Cl)cc(CN[C@H]2COCC2(F)F)c1O 2131103029 GYJVELGYJFVYHZ-JTQLQIEISA-N 293.697 2.178 10 10 CECE C[C@H](O)c1ccc(N(C)CCC(=O)N(C)C)cc1Cl 2131951727 DRGHOULPVCUZEN-JTQLQIEISA-N 284.787 2.308 10 10 CECE C[C@@H]1C[C@H](N(C)c2ccc(CO)c([N+](=O)[O-])c2)CS1 2132947605 XEWBJIZTZINESW-SKDRFNHKSA-N 282.365 2.417 10 10 CECE C[C@H]1C[C@@H](C)C[C@H]([C@H](NCCN=[N+]=[N-])C(=O)O)C1 1912148435 SVQMRHGVBCAUSF-ZDCRXTMVSA-N 254.334 2.412 10 10 CECE CN(CCN=[N+]=[N-])Cc1cc([N+](=O)[O-])ccc1F 1912157640 SKLFBLKFKQXNOM-UHFFFAOYSA-N 253.237 2.476 10 10 CECE C[C@H](Oc1ccccc1)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912153603 CPAZPWAGDPZMOQ-QWRGUYRKSA-N 260.297 2.365 10 10 CECE C[C@@H]([C@@H]1CCCO1)S(=O)(=O)CCCCN=[N+]=[N-] 1912162527 XBQGWRIULJAEFX-UWVGGRQHSA-N 261.347 2.059 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)CCOC2CCC2)C1 1912184222 CQUWPHRNVZCLNI-LLVKDONJSA-N 266.345 2.495 10 10 CECE CCOC(=O)c1nc(CN2CC[C@H](CN=[N+]=[N-])C2)cs1 1912147139 GRZYBZKVEJLOAW-SECBINFHSA-N 295.368 2.452 10 10 CECE Cn1c(Cl)cnc1CN1CCC[C@H](N=[N+]=[N-])C1 1912172488 USVAQLPLPMQWMN-QMMMGPOBSA-N 254.725 2.348 10 10 CECE C[C@H]1CCN(CCN2CCC[C@@H](CN=[N+]=[N-])C2)C1 1912182126 XTGIQIDXDPPHSJ-STQMWFEESA-N 251.378 2.351 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C[C@@H]2CCCC(=O)N2)C1 1912206419 JSMUHVBCWKJTRF-NEPJUHHUSA-N 265.361 2.068 10 10 CECE Cc1nc(C=CC(=O)NCc2ccc(N)cc2)cs1 1911888026 RDAJPZGBHPGFSM-UHFFFAOYSA-N 273.361 2.363 10 10 CECE Cc1cc(CN)ccc1N1C[C@](C)(CO)CC1(C)C 2134836686 PXRTVTBOHZZOQB-MRXNPFEDSA-N 262.397 2.441 10 10 CECE CC(C)(C)SCCNC(=O)Cc1ccc(O)c(O)c1 1446573683 ZYRJGOCDQRMFBN-UHFFFAOYSA-N 283.393 2.288 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)[C@H]1C[C@H]1C1CC1 2135162110 UMDJHQJLBOUOIL-WMHQRMGPSA-N 261.365 2.450 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H](O)[C@@H]2C)cc1O 1914305551 RRDDCQVHFIVUTA-SUNKGSAMSA-N 264.369 2.022 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C2CC(O)C2)cc1O 1914597454 ZOCKBEAHVGRKPP-PKSQDBQZSA-N 264.369 2.022 10 10 CECE CC[C@@H]1CC[C@@H](C)N1C(=O)Cc1ccc(O)c(O)c1 1295676231 SERYUQUNVYQKOF-ZYHUDNBSSA-N 263.337 2.430 10 10 CECE Cc1cc(C(=O)NCc2cc(O)ccc2O)oc1C 1455356652 JWXMGNJRNJCEOV-UHFFFAOYSA-N 261.277 2.238 10 10 CECE C[C@H](N)c1ccc(N2CCC3(COC3)C2)c(F)c1 1915836000 UTNWTIJPIQLXPS-JTQLQIEISA-N 250.317 2.072 10 10 CECE CC[C@H](O)c1ccc(N2CC[C@@](F)(CO)C2)cc1 1917127903 SONBBNBJIVQSIA-KBPBESRZSA-N 253.317 2.041 10 10 CECE Cc1cncc(CNC(=O)NCc2c(O)cccc2F)c1 1478343041 CQKDTAAONIKHNK-UHFFFAOYSA-N 289.310 2.234 10 10 CECE CS[C@H]1CC[C@@H](NCc2ccc(O)c(O)c2)C1 226758966 NRMWRPSKVWOMLE-MNOVXSKESA-N 253.367 2.472 10 10 CECE COc1cccc(CNC(=O)c2ccc3[nH]ccc3n2)c1O 1622778982 DOANWXIEILIHOI-UHFFFAOYSA-N 297.314 2.207 10 10 CECE Cc1cnc(C(=O)NCc2cccc(Cl)c2O)cn1 1637227196 RAKZUOQRKSUQBA-UHFFFAOYSA-N 277.711 2.074 10 10 CECE CC(C)C[C@@H](CN)CC(=O)NCc1ccccc1O 228423365 GYXWDEZQGHDSBT-GFCCVEGCSA-N 264.369 2.020 10 10 CECE Cn1cc(CCn2ccc3ccc(CCN)cc32)cn1 230897167 PZNPFKGVBMSVFA-UHFFFAOYSA-N 268.364 2.119 10 10 CECE CNC(=O)CN(Cc1ccccc1)c1ccc([C@@H](C)N)cc1 1932035241 HKLFKOZLJKMDNS-CQSZACIVSA-N 297.402 2.459 10 10 CECE Cc1ccc(CN2C[C@@H]3CCC[C@H](C2)N3C)c(O)c1 2139789736 DKIPUEUMMCVGAC-GASCZTMLSA-N 260.381 2.369 10 10 CECE Cc1cccc(CNC(=O)C2CCC(=O)CC2)c1O 2139759634 KJQZGVARCSJTKD-UHFFFAOYSA-N 261.321 2.076 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CC=C(C(F)(F)F)CC3)ccc21 167227055 SLHSBNLNOLWLPO-GFCCVEGCSA-N 297.280 2.337 10 10 CECE CCOc1ccc(N2CCN[C@H](C)CC2)cc1F 167790147 LHJZNBWMOPGXHX-LLVKDONJSA-N 252.333 2.413 10 10 CECE Cc1ccc(NC(=O)[C@H](C)Oc2ccc(N)cc2)nc1 1860078274 KGQNZJAWPNLSKV-NSHDSACASA-N 271.320 2.378 10 10 CECE CCOC(=O)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1865958075 GGVWCDNZCSHWAX-UHFFFAOYSA-N 298.342 2.361 10 10 CECE COc1cc2c(c(OC)c1O)C(=O)c1ccccc1C2=O 14775071 VVVZBZBYGDTROV-UHFFFAOYSA-N 284.267 2.185 10 10 CECE biogenic,in-vitro CN1CCN([C@H]2CCCC[C@H]2Oc2ccc(N)cc2)CC1 31977564 VKYAHWWKVHREGI-DLBZAZTESA-N 289.423 2.206 10 10 CECE CC[C@@H]1CC[C@H](NC(=O)COc2ccc(N)cc2)C1 2141189756 JVZRKPYFFJXMAK-YPMHNXCESA-N 262.353 2.343 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(F)c2F)CCO1 234115007 NNSJWPUXEFOCMQ-JTQLQIEISA-N 256.296 2.039 10 10 CECE CCc1nn(C)cc1CNCc1cccc(C)c1O 124865722 NQPBDKXUVLTWLS-UHFFFAOYSA-N 259.353 2.286 10 10 CECE CCNCc1ccc(N(CC)CC(=O)N(C)C)cc1Cl 233513656 LPBJKWFJXHJZFB-UHFFFAOYSA-N 297.830 2.364 10 10 CECE C[C@@H](Cc1cnn(C)c1)NCc1ccc(Cl)cc1O 1205830736 DVQIEHDIIWOJFG-JTQLQIEISA-N 279.771 2.500 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2ccncn2)c1 234972129 WTQXESADAVGZSV-SNVBAGLBSA-N 259.309 2.042 10 10 CECE C[C@H]1C[C@H](NCc2ccc(O)c(O)c2)CCS1 1940331315 ZKPQFMHJMTZPSS-GXSJLCMTSA-N 253.367 2.472 10 10 CECE C[C@@H]1C[C@@H]1CCC(=O)NCCOc1ccc(N)cc1 1876947816 ONSROBWQDQQXOH-NEPJUHHUSA-N 262.353 2.200 10 10 CECE CCN1C[C@@H](CN(C)[C@@H](C)c2ccccc2O)OC1=O 2143466617 JOTRCYGMQLNJSW-NWDGAFQWSA-N 278.352 2.226 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC(C)(N(C)C)C2)c(F)c1 1880478661 HFOOAAWOTDNLLZ-SECBINFHSA-N 270.323 2.158 10 10 CECE COc1ccc(N(C)C[C@@]23CCOC[C@H]2C3)c(N)c1 1880556784 OBBBTLJVDIWKGC-ABAIWWIYSA-N 262.353 2.140 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@@]2(C)CO)c(F)c1 1880924395 QYZOJVBLQVJWDR-XPTSAGLGSA-N 270.323 2.336 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCCn2ncnc21 1883185166 SDQDVALVVCNLKT-NSHDSACASA-N 278.743 2.262 10 10 CECE CN(c1ccc(CO)cc1C(F)(F)F)C1(C)COC1 2143195372 NVWGVVPZKJHQAP-UHFFFAOYSA-N 275.270 2.423 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H]2COCCO2)cc1Cl 2143687578 PNJWBXGPYCKOFF-AAEUAGOBSA-N 298.814 2.472 10 10 CECE Oc1cccc(F)c1CNC[C@H]1CSCCS1 1964572971 YSORDNDTYQNPEX-VIFPVBQESA-N 273.398 2.470 10 10 CECE CO[C@@H](CN(C)c1ccc(CN)cc1)[C@H]1CCCOC1 1967635348 MVHJOSHESXDSNN-HOCLYGCPSA-N 278.396 2.023 10 10 CECE N[C@H]1CC12CCC(NCc1ccc3c(c1)CCO3)CC2 1967988190 ZIPIPTSJHQFMTP-WIHSUSGWSA-N 272.392 2.371 10 10 CECE Oc1ccc(CCNCc2cccc(F)c2O)cc1O 2148013627 WXBIMBKVMHFLBF-UHFFFAOYSA-N 277.295 2.275 10 10 CECE Cc1cccc(CNCCN2C[C@H]3CC[C@H]2C3)c1O 1971260522 ITXQMTHHECSWJR-ZFWWWQNUSA-N 260.381 2.275 10 10 CECE Oc1c(CNCCN2C[C@H]3CC[C@H]2C3)ccc(F)c1F 1971261127 ABHKSNZHUIIREU-JQWIXIFHSA-N 282.334 2.244 10 10 CECE CCCN(CC(=O)Nc1ccc(N)cc1)CC(F)(F)F 42738803 OYKGRKZYQFOFQG-UHFFFAOYSA-N 289.301 2.482 10 10 CECE Nc1ccc(CCN2CC(=O)Nc3ccccc32)cc1 35677201 IZQFELJYBZLFEN-UHFFFAOYSA-N 267.332 2.270 10 10 CECE COc1cc(N)c(N2CC[C@@H](OC)[C@H](C)C2)cc1OC 2149316954 ROCUJTPNVXYRJV-ZWNOBZJWSA-N 280.368 2.147 10 10 CECE CNCc1ccc(N2C[C@@H]3CCC[C@H](O)[C@H]3C2)c(C)c1 2150922331 OWWBODWWIXCJEO-ZOBUZTSGSA-N 274.408 2.312 10 10 CECE CC(C)NCc1ccc(N2CCC[C@@H]2C(N)=O)c(Cl)c1 163934570 IPCATPISUJQIKZ-CQSZACIVSA-N 295.814 2.292 10 10 CECE CCNCc1ccc(N2CCC[C@]23CC[S@](=O)C3)cc1 2158466304 XZNFWSLTUBLAMZ-UZLBHIALSA-N 292.448 2.288 10 10 CECE CC(C)c1nc(NCc2ccccc2O)cc(=O)[nH]1 164162392 UOJFKYKTZRBXNL-UHFFFAOYSA-N 259.309 2.211 10 10 CECE C[C@@H](N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N)C(F)(F)F 2151714688 MFYSEFXTUNWCMM-RDDDGLTNSA-N 287.285 2.050 10 10 CECE CC[C@@H]1CCOC[C@H]1NC(=O)CCc1ccc(N)cc1 2152568296 CNZFBWSAQMZECO-UKRRQHHQSA-N 276.380 2.133 10 10 CECE CCNCc1ccc(N2C[C@@H](O)[C@@H]2C)cc1Br 2011384967 QGBSVAKKUXCAMF-TVQRCGJNSA-N 299.212 2.128 10 10 CECE COCCNCc1ccc(OCCC(C)(C)O)c(C)c1 2155013023 DVDTVLKBOPSGGY-UHFFFAOYSA-N 281.396 2.271 10 10 CECE Cc1cc(CNC2CC2)ccc1OCCCS(C)(=O)=O 2155016344 DZUOQXXBCKQMEL-UHFFFAOYSA-N 297.420 2.061 10 10 CECE CNC[C@H]1CCN(c2cc(Cl)c(OC)cc2OC)C1 53011385 UXNQIHIQYJRHPU-SNVBAGLBSA-N 284.787 2.403 10 10 CECE Cn1nc([C@@H](N)c2ccccc2O)cc1C(F)F 2029553569 QKNRCYOCNPEJEN-NSHDSACASA-N 253.252 2.111 10 10 CECE COCCOC[C@@H]1CCN([C@H](C)c2ccccc2O)C1 2159075994 YEWDLDGHGCMSFH-ZIAGYGMSSA-N 279.380 2.438 10 10 CECE c1nnc(CNCc2ccc3c(c2)CCCO3)s1 2033505647 YGMRCBBENAWNGD-UHFFFAOYSA-N 261.350 2.153 10 10 CECE Oc1cccc(Cl)c1CNC1CN(CC2CC2)C1 2036004112 PPYDOCYLHTXRIO-UHFFFAOYSA-N 266.772 2.229 10 10 CECE COc1cccc(CN(C)[C@@H]2CC[C@@H](C)OC2)c1O 401542486 VEJMZFLDOZJQRT-DGCLKSJQSA-N 265.353 2.400 10 10 CECE Nc1ccc(OCC(=O)N2CCC(C(F)F)CC2)cc1 307868349 PFTPIRRAQKYSJE-UHFFFAOYSA-N 284.306 2.151 10 10 CECE Cc1oc(C(=O)O)cc1COc1cncc(F)c1 307987701 LDPNHVHIOVUSFG-UHFFFAOYSA-N 251.213 2.399 10 10 CECE C[C@H](NCc1ccns1)c1ccc(O)cc1O 404428957 NNMVFOPNLLWGGI-QMMMGPOBSA-N 250.323 2.405 10 10 CECE Oc1cc(CNCC(F)(F)F)cc(Cl)c1O 309509080 OLXMSDABWKWDBA-UHFFFAOYSA-N 255.623 2.403 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nncn2C)cc1Cl 312719088 USEJQWTWNSDITK-JTQLQIEISA-N 293.802 2.385 10 10 CECE CN(C)C[C@@H]1CCN1c1ccc(C=CC(=O)O)cc1F 2160851096 RQKXUVNOFJBAKA-LBPRGKRZSA-N 278.327 2.064 10 10 CECE Oc1c(CNCC[C@@H]2CCCO2)ccc(F)c1F 700764425 IYLVNCZAELLUAC-JTQLQIEISA-N 257.280 2.329 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2C[C@H]2C(F)(F)F)cc1 2161754874 HHDAXXADEUVRBM-GHMZBOCLSA-N 288.269 2.105 10 10 CECE CC[C@@H](CN)C(=O)N(CC)Cc1ccc(N(C)C)cc1 87525579 YKUOEGCBNHVOCF-AWEZNQCLSA-N 277.412 2.086 10 10 CECE CN(C)CCC1CCN(c2ccc(CO)cc2F)CC1 700835583 NFOYGQGJPQSNAQ-UHFFFAOYSA-N 280.387 2.486 10 10 CECE CNCc1ccc(N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1 2171168976 YSDKOINGBLNONA-WBVHZDCISA-N 273.424 2.327 10 10 CECE CSCCN1CCN(c2ccc([C@H](C)N)cc2F)CC1 2171555265 GUTCRUQJNODYGN-LBPRGKRZSA-N 297.443 2.330 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1CC[C@H](C(F)F)C1 687841146 MTFZFJXDDBMSPM-ZJUUUORDSA-N 283.322 2.183 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CNC[C@H]32)c(C)c1 2162652563 GMLXRMBZDBDXOI-MMTVNHQJSA-N 272.392 2.438 10 10 CECE CC[C@H](CN[C@@H](C)c1ccc(OC)cc1O)N(C)C 388658041 BUIXHXNGQGCNBM-NWDGAFQWSA-N 266.385 2.392 10 10 CECE O=C1Nc2cc(N3CC[C@H](CF)C3)c(Cl)cc2[C@@H]1O 711433739 JNRCPYOLCQHAGI-KRTXAFLBSA-N 284.718 2.121 10 10 CECE Nc1ccc(CS(=O)(=O)Nc2cncc(Cl)c2)cc1 691036182 VXFGPHFCXUQSLN-UHFFFAOYSA-N 297.767 2.259 10 10 CECE CC1(C)CN([C@H]2CCN(c3ccc(CO)cc3F)C2)C1 2176863938 XKHMOHBNBZQQFT-ZDUSSCGKSA-N 278.371 2.239 10 10 CECE CCS[C@@H]1CCN(C(=O)c2cccc(O)c2O)C1 382875465 KHNNQBVHJLFCSE-SECBINFHSA-N 267.350 2.065 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2C[C@@]2(C)OC)c1O 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CECE C[C@H](NCCN1CC[C@H]2C[C@@H]21)c1ccc(N(C)C)cc1 2290199403 HGPSSHAOKUJLBI-QRTARXTBSA-N 273.424 2.497 10 10 CECE C[C@H](NCCN1CC[C@@H]2C[C@@H]21)c1ccc(N(C)C)cc1 2290199339 HGPSSHAOKUJLBI-LXZKKBNFSA-N 273.424 2.497 10 10 CECE COc1ccc(CNC[C@H](C)Cc2cn[nH]c2)c(O)c1 2290420235 CNNHMCPNLHDBGH-LLVKDONJSA-N 275.352 2.092 10 10 CECE Cc1cc(N2C[C@@H](C)O[C@H](CCO)C2)ccc1[C@@H](C)O 2285165354 PGKNBYQRPKDDJC-UMVBOHGHSA-N 279.380 2.024 10 10 CECE Cc1cc(N2CCNC(=O)[C@H]2C(C)C)ccc1[C@@H](C)O 2285163484 JXOVJIPHDIXLFV-IUODEOHRSA-N 276.380 2.009 10 10 CECE CN(CC1COC1)c1c(F)cc(CNC2CC2)cc1F 2285275411 HOQHRSQFPWLRAS-UHFFFAOYSA-N 282.334 2.299 10 10 CECE CCCN(C[C@H](C)O)c1ccc([C@@H](C)O)cc1[N+](=O)[O-] 2287959853 IZNBUCBXWAOAQB-WDEREUQCSA-N 282.340 2.245 10 10 CECE CC[C@H](NCc1c(O)cccc1OC)[C@@H](C)CN(C)C 2288823129 IUMZFJULJSDNDW-JSGCOSHPSA-N 280.412 2.467 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@@]12C[C@@H](CO1)C2(C)C 2289167624 YCGJCPDGGRTBAT-BLLLJJGKSA-N 274.364 2.042 10 10 CECE CNCc1ccc(N2CCO[C@H](P(C)(C)=O)C2)c(C)c1 2289322337 BYMSVJCXEBAVTL-OAHLLOKOSA-N 296.351 2.500 10 10 CECE CCC(CC)(CO)CNC(=O)C=Cc1ccc(O)c(O)c1 2308005994 QCHQVONNODWVQE-UHFFFAOYSA-N 293.363 2.026 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@@H]3CC[C@@H]32)c(F)c1 2312394508 QCIJPBJFAUKIBW-SCDSUCTJSA-N 251.301 2.184 10 10 CECE Nc1ccc(NC(=O)CCCOC[C@@H]2CCOC2)cc1 49688694 LCAVZUWZUUIXOK-LBPRGKRZSA-N 278.352 2.041 10 10 CECE C[C@H](c1ccccc1O)N1CC(F)(F)[C@](C)(N)C1 2315159086 MSODFHKRNPSHTA-BXKDBHETSA-N 256.296 2.122 10 10 CECE CCN1CCN(c2ccc(CN)c(SC)c2)CC1 2328548314 BYMIULOZNFRMLC-UHFFFAOYSA-N 265.426 2.009 10 10 CECE Oc1ccc(CCN[C@@H]2C[C@@H]3C[C@H]2[C@H]2C[C@@H]32)cc1O 2330292057 REZCVZQJRSVBEA-HTVCTNPSSA-N 259.349 2.274 10 10 CECE CO[C@H]1C[C@@H]2C[C@@H](NCc3c(O)cccc3F)[C@@H]2C1 2331999261 UXHFATQBOQIEDM-FBKDDSFISA-N 265.328 2.434 10 10 CECE Cc1ccc(CN[C@@H]2C[C@@H]3[C@@H]2[C@@H]2CC[C@H]3O2)c(O)c1 2333190887 HUWMRPDWXSMHMI-RIMJYPKNSA-N 259.349 2.356 10 10 CECE OC[C@@H]1[C@@H]2C[C@H]1N(c1ccc(OCC(F)F)cc1)C2 2333688729 MUNFBWULZSJLQR-OASPWFOLSA-N 269.291 2.148 10 10 CECE CCN(CCN=[N+]=[N-])Cc1ccc(C(=O)OC)cn1 2337775561 BNIDJACZFWUTPG-UHFFFAOYSA-N 263.301 2.000 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C[C@](C)(C(=O)O)C(C)C 2337778347 VHTGKSQXGZGTDV-LBPRGKRZSA-N 270.333 2.282 10 10 CECE Cc1ccc(O)c(CN2C[C@H]3C[C@@H]2C[C@H]3N(C)C)c1 2341130523 BWUAECVCCRKAGH-BPLDGKMQSA-N 260.381 2.225 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@@H](C)[C@H]2C)c(F)c1 2344578728 XDWSCVCHPITTEZ-RWSFTLGLSA-N 266.360 2.141 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@@H]2C[C@@H]3CC[C@H]2O3)cc1 2355076121 RCRDZLCVTYCSLL-YHUYYLMFSA-N 276.380 2.026 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@@H]2C[C@@H](C(=O)O)[C@@H]2C1 2355437486 METDABUWNPFSSV-RBJBARPLSA-N 279.311 2.245 10 10 CECE O=C1NCCC[C@H]1NCc1cc(Cl)cc(Cl)c1O 50394427 LZOJVOJGDNYVEQ-SNVBAGLBSA-N 289.162 2.067 10 10 CECE CCN1C=CC=C/C1=C1\SC(=S)N(C)C1=O 100661525 KXIIPDZROMVEHG-CMDGGOBGSA-N 252.364 2.094 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)NCC(F)(F)F)c1 103503245 YIHPIIQEIZDVOL-ZETCQYMHSA-N 292.257 2.323 10 10 CECE COc1ccc(N2CCC[C@@H]2C[C@H](C)O)c(N)c1 302609481 KRLNAMKRUXDWAK-WDEREUQCSA-N 250.342 2.017 10 10 CECE CCN(c1ccc([C@@H](C)N)cc1F)[C@@H]1CCOC1 310915879 RORMFMCBIVBTQO-ZYHUDNBSSA-N 252.333 2.461 10 10 CECE COc1ccc([C@H](C)N2CC[C@@H](OC)C2)c(O)c1 300102663 VBBKHNAAFNECDA-CMPLNLGQSA-N 251.326 2.183 10 10 CECE CCN(CC)c1ccc([C@@H]2NCCc3[nH]cnc32)c(O)c1 65376496 LXSDNXQJRDQAFN-HNNXBMFYSA-N 286.379 2.197 10 10 CECE Cc1cccc(-n2c(C)cc(C(=O)N3CC(CO)C3)c2C)c1 184228359 QVJREPLMPFEDEM-UHFFFAOYSA-N 298.386 2.467 10 10 CECE CCCOc1cc(N2CCC(OCCO)CC2)ccc1N 128778681 AFOUNQJTCGHKMB-UHFFFAOYSA-N 294.395 2.035 10 10 CECE CSc1cc(NCCc2ccc(N)cc2)ncn1 235124178 WDPHUGINUGDVCL-UHFFFAOYSA-N 260.366 2.435 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1cncs1 131865702 CIGCEIIPNURVRR-VIFPVBQESA-N 269.330 2.037 10 10 CECE CN(C)c1ccc(CNC(=O)N2C[C@H]3CC[C@H]2C3)cc1 194269870 RHKIMOHKEBYVDM-ZFWWWQNUSA-N 273.380 2.447 10 10 CECE CC[C@H]1CN[C@H](C)CN1c1cc(OC)c(OC)c(OC)c1 86151545 YOLJVKUEDFTXLL-NEPJUHHUSA-N 294.395 2.289 10 10 CECE COCC[C@@H](C)N[C@@H](C)c1ccc(OC)cc1O 81707727 HLKXGJZVSPUJKM-MNOVXSKESA-N 253.342 2.476 10 10 CECE N[C@@H](CCCO)c1c(Br)ccc(F)c1O 95706392 CJYZCHKFHOZPAQ-QMMMGPOBSA-N 278.121 2.066 10 10 CECE C[C@@H](NCCc1nccs1)c1c(O)cccc1O 235182615 SBIZGAGVLSUDKK-SECBINFHSA-N 264.350 2.448 10 10 CECE CC[C@H](N)c1ccc(N(C)C[C@@H]2CCN(C)C2)cc1 234032381 JGHIPAPKWIXTJA-CJNGLKHVSA-N 261.413 2.484 10 10 CECE Cc1ccnc(CNC(=S)Nc2ccc(N)cc2)c1 243455540 NFUPBMOXUIBTEW-UHFFFAOYSA-N 272.377 2.459 10 10 CECE Oc1cc(C[C@@H]2CCCN2)cc(Br)c1O 258388763 DCRHCHLOSRXFLZ-QMMMGPOBSA-N 272.142 2.155 10 10 CECE COC(=O)[C@H](C)Cc1c(Br)ccc(O)c1O 260082811 AUEMIDLJRFDKJL-ZCFIWIBFSA-N 289.125 2.212 10 10 CECE Cc1cc(N2CCC[C@@H]3COC[C@@H]32)ccc1C[C@H](C)N 690350820 KMBJIOYEEDCPDT-LXZKKBNFSA-N 274.408 2.500 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(C(C)(C)C)s1 808527714 LDJFWQQJTSSNKC-UHFFFAOYSA-N 268.334 2.361 10 10 CECE C[C@H](N)c1ccc(N2[C@H](CO)C[C@@H]3CCC[C@H]32)cc1O 2164836141 MSEHLNOHMHDKKU-TZQJONAQSA-N 276.380 2.152 10 10 CECE CCn1ccc([C@H](O)c2ccc3c(c2)CCCN3C)n1 2163096043 GKJSZOVZCLVAOP-MRXNPFEDSA-N 271.364 2.367 10 10 CECE Cc1cnc([C@@H](N)c2ccc3c(c2)CCCN3C)cn1 2163107724 PRHOAJLFFGBMMM-INIZCTEOSA-N 268.364 2.216 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H](N)CCCOC)cc1 2163111297 QFTCKLPKNXCMNV-HOTGVXAUSA-N 280.412 2.320 10 10 CECE Nc1snnc1[C@H](O)c1ccc(N2CCCCC2)cc1 2163112312 AQHPEBZGNVRSRC-CYBMUJFWSA-N 290.392 2.192 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@]1(O)C[C@@H]2C[C@@H]2C1 2163243913 RHDBEOPXDDYZRG-YALNPMBYSA-N 272.392 2.448 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](OC)C[C@@H](O)C2)c(Cl)c1 2165324402 YQKCANZRCNQVCE-RTXFEEFZSA-N 298.814 2.206 10 10 CECE CC[C@H](O)[C@@H](N)c1ccc(F)c(Br)c1O 396696035 MTFOSASABUVDLE-CBAPKCEASA-N 278.121 2.065 10 10 CECE CC(C)NCc1ccc(N2C[C@@]3(C)C[C@]3(CO)C2)cc1 2165465855 XNTCLAWLHCWSOS-IAGOWNOFSA-N 274.408 2.393 10 10 CECE C[C@H]1CC(C(=O)NCc2ccccc2O)C[C@H](C)O1 724400699 RINWLXDBAGSADN-QWRGUYRKSA-N 263.337 2.212 10 10 CECE C[C@H](CNCc1cc(Cl)c(F)cc1O)N(C)C 293671715 QRDMSWBCMREPLC-MRVPVSSYSA-N 260.740 2.224 10 10 CECE CNC(=O)[C@@H]1CCN(Cc2c(O)ccc3ccccc23)C1 398514118 RJCSVQNQCIISTM-CYBMUJFWSA-N 284.359 2.113 10 10 CECE C[C@H](N[C@@H]1CNCCC1(F)F)c1ccc(N(C)C)cc1 817978415 ANDODRPTPCNCFF-SMDDNHRTSA-N 283.366 2.400 10 10 CECE Cc1cc(F)c(O)c([C@@H](C(F)F)N2CCOCC2)c1 575303049 VFINGUAMRHUCRC-NSHDSACASA-N 275.270 2.478 10 10 CECE CCN(C)c1ccc([C@H](C)NC2COCCOC2)cc1 813879629 OIQMSSAKSNBFBP-ZDUSSCGKSA-N 278.396 2.209 10 10 CECE CCc1cccc(CN[C@](C)(CCF)C(=O)OC)c1O 827352724 OCMRQSVTPPIYHP-OAHLLOKOSA-N 283.343 2.336 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](O)C12CCC2 827366628 XWONNYHTNPAVLA-HOTGVXAUSA-N 274.408 2.454 10 10 CECE CCOc1ccc(O)c(CN2CC3(CCCOC3)C2)c1 839139598 WKCRAFVIMHHJBG-UHFFFAOYSA-N 277.364 2.403 10 10 CECE Cc1ccc(O)c(CN2CCO[C@]3(CCSC3)C2)c1 843417361 CRTGKXCDRWTLPY-OAHLLOKOSA-N 279.405 2.409 10 10 CECE CN(C)c1ccc(/C=C\CN[C@@H](CCN)C(F)F)cc1 841074679 QFYZEPCAKUHVLM-NQHOJNORSA-N 283.366 2.338 10 10 CECE CC(C)(C)OC(=O)C[C@](C)(N)c1ccc(O)cc1O 1951844092 PJHORDVPNRULNW-AWEZNQCLSA-N 267.325 2.004 10 10 CECE COc1ccc(N2C[C@H]3CCC[C@@]3(N)C2)cc1OC 1893619172 MGOOBFMGQAEVOP-IAQYHMDHSA-N 262.353 2.021 10 10 CECE CCOc1ccc(CN(C)[C@H](CC)C(=O)O)c(O)c1 844937995 SEQKCVZGITWZBY-GFCCVEGCSA-N 267.325 2.086 10 10 CECE COc1cccc(S(=O)(=O)CCCN=[N+]=[N-])c1 42416500 MBOJJKDHWUBOGM-UHFFFAOYSA-N 255.299 2.169 10 10 CECE CO[C@@H]1C[C@H](NC(=O)NCc2c(O)cccc2F)C1(C)C 921375823 CPYQWUPKQFMDCK-QWHCGFSZSA-N 296.342 2.144 10 10 CECE CN(C[C@@H]1C[C@]12CCCOC2)c1ccc(CO)cc1 1895413920 NSTGRJOUPLDUKX-HOCLYGCPSA-N 261.365 2.432 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)c3cc[nH]c3C)C2)cc1 855232491 UWEAQOQWDCSAFQ-CYBMUJFWSA-N 299.374 2.340 10 10 CECE CN(Cc1ccccc1O)C(=O)C1(CF)CCOCC1 857466776 GUFCLZIAUFCZFJ-UHFFFAOYSA-N 281.327 2.117 10 10 CECE CC(C)(C)OC(=O)Nc1cccc([C@@]2(C)CC(=O)N2)c1O 1952562150 KGGNLJAVVMQLBD-OAHLLOKOSA-N 292.335 2.474 10 10 CECE CCN(C[C@@H]1C[C@@H]1C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 698394380 OUOQJQDKJDOTAK-ZIBATOQPSA-N 273.380 2.145 10 10 CECE COc1ccc(N(C)CCN(C)CCC(OC)OC)cc1 852211185 HOPATWWJKJEFQU-UHFFFAOYSA-N 296.411 2.072 10 10 CECE CC[S@](=O)CCN[C@H](C)c1cc(Cl)ccc1O 756578041 VQAUDESUXOXYQY-XLFHBGCDSA-N 275.801 2.465 10 10 CECE Cc1cc(Cl)cc([C@@H](C)NC[C@H]2COCCN2C)c1O 858523787 UYDFZGJFTHPRIQ-YPMHNXCESA-N 298.814 2.335 10 10 CECE O=C(NC[C@@H]1CCC[C@H]2C[C@@H]21)c1c(F)ccc(O)c1O 857321761 RPWLTGGJTWFZFL-GUBZILKMSA-N 279.311 2.403 10 10 CECE CC(C)(C(=O)NCCOc1ccc(N)cc1)C(F)F 698405727 KIMDRYDUDYUVII-UHFFFAOYSA-N 272.295 2.055 10 10 CECE Cc1cc(Cl)cc(CN(C)C2CC(O)C2)c1O 761223423 QWYWGZXSRJMOEB-UHFFFAOYSA-N 255.745 2.309 10 10 CECE CCOC(=O)C1=CC[C@@H](NCc2cc(F)ccc2O)C1 862488939 VFOKUXPQSREMRX-CYBMUJFWSA-N 279.311 2.273 10 10 CECE Oc1ncc(NCc2ccc(N3CCCC3)cc2)c(O)n1 1115858826 CMTKFSZUEDSDDY-UHFFFAOYSA-N 286.335 2.100 10 10 CECE CCCNC(=O)CN(C)[C@H](CC)c1ccccc1O 132973629 HVUJWWWTCRBNBP-CYBMUJFWSA-N 264.369 2.301 10 10 CECE CC[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@H](C)O[C@H](C)C1 62460794 OCTHTOQSPNNKRW-TYNCELHUSA-N 291.395 2.095 10 10 CECE Cc1cccc(CN(C)[C@@H]2CCN(C3CC3)C2)c1O 775681094 MZFJTNYSPWWYDL-OAHLLOKOSA-N 260.381 2.369 10 10 CECE Cc1cc(Cl)c(C)c(CN2CCNCC2)c1O 71457068 GDWZAHYXKQCOPS-UHFFFAOYSA-N 254.761 2.068 10 10 CECE CN(C)c1ccc(Cn2ncc3c2CCC[C@@H]3CN)cc1 82827977 QFSNEOXSHRQEJS-CQSZACIVSA-N 284.407 2.376 10 10 CECE CC[C@H]1CN(CC)[C@H](c2cc(F)ccc2O)CN1 83393453 VJQVAZPNALHTPL-AAEUAGOBSA-N 252.333 2.276 10 10 CECE Oc1ccc(F)cc1CNCCCCN1CCCC1 83493081 YPPGDKQNMUIGCE-UHFFFAOYSA-N 266.360 2.497 10 10 CECE Cc1cccc([C@H]2NCCc3c(O)ccc(O)c32)c1O 83657885 UJKDLZBYNNRREY-OAHLLOKOSA-N 271.316 2.347 10 10 CECE Oc1c(CN[C@@H]2CCN3CCCC[C@H]23)ccc(F)c1F 703347411 JDEOFRJPUPBLHS-CHWSQXEVSA-N 282.334 2.387 10 10 CECE CC[C@H]1CCCCN1c1cc2c(cc1N)OCC(=O)N2 57476731 KAUXJOASJYFBHH-JTQLQIEISA-N 275.352 2.369 10 10 CECE CNCc1cc(F)c(N(C)C[C@@H]2CCN(C)C2)c(F)c1 71190105 DFSZAMJWMHDZBH-LLVKDONJSA-N 283.366 2.072 10 10 CECE Nc1ccc(OCCN2CC[C@@H](C(F)F)C2)cc1 707687443 WJGDWVUBJKDUMX-SNVBAGLBSA-N 256.296 2.235 10 10 CECE c1cc(N2CCCC2)ccc1CN[C@]12COC[C@@H]1C2 718094641 VEOURHRJZNRJGH-GOEBONIOSA-N 258.365 2.165 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1CN 708888920 IUUWGGFTWLGVHU-VHSXEESVSA-N 254.761 2.072 10 10 CECE c1cc2c(cc1CN[C@@H]1CCN(C3CCC3)C1)CCO2 709152192 UGVMXLWOBPWONX-OAHLLOKOSA-N 272.392 2.338 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCCC1(C)C 63065561 WTZAZROOPSRLGV-NSHDSACASA-N 261.369 2.470 10 10 CECE C[C@@H]1C[C@@H](C)N1C(=O)NCc1ccc(N(C)C)cc1 791998866 WVZCICHXRGLEIK-VXGBXAGGSA-N 261.369 2.445 10 10 CECE OCCC1(NCc2cc(F)ccc2O)CCSCC1 719629044 ACSIJCSVSLGNMJ-UHFFFAOYSA-N 285.384 2.269 10 10 CECE CCCOc1cc(N2CC([C@H](C)O)C2)ccc1[N+](=O)[O-] 719905970 WQASOEWUQKDVGV-JTQLQIEISA-N 280.324 2.201 10 10 CECE Cc1cc(N(C)[C@@H]2CO[C@@H](C3CC3)C2)ccc1CO 691758626 ZTKGNSHBKKKVJX-JKSUJKDBSA-N 261.365 2.491 10 10 CECE CCCC1([C@@H](NCCCN=[N+]=[N-])C(N)=O)CCC1 686127842 XVZLZHFFKQWGJW-JTQLQIEISA-N 253.350 2.101 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1CC[C@@H]2[C@@H](C1)C2(F)F 1153885367 MPMMTFDNSIKOJX-GGZOMVNGSA-N 297.301 2.395 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1c(F)cccc1F 90257357 FJAYVVOPVJHLFI-LLVKDONJSA-N 284.266 2.469 10 10 CECE Cc1cc(CN)ccc1N1CCN2CCCC[C@@H]2C1 94440016 SKGNGUKASNMIBR-OAHLLOKOSA-N 259.397 2.128 10 10 CECE CO[C@@H]1CC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1 1154335966 SOWKGKLGENOWGO-NWDGAFQWSA-N 290.323 2.146 10 10 CECE CSc1cc(C(=O)NCc2cc(O)ccc2O)ccn1 1153879487 PSOGATNTWKZKTA-UHFFFAOYSA-N 290.344 2.145 10 10 CECE CSCC[C@@H](O)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2125474588 BAWCIFYPYMPLJT-WDEREUQCSA-N 286.401 2.039 10 10 CECE CCS[C@@H](C(=O)NCc1cc(O)ccc1O)C(C)C 1176747835 CJKZIDPOTIGRQU-CYBMUJFWSA-N 283.393 2.492 10 10 CECE Cc1cc(N2CC=C[C@H]2CO)ccc1CNC(C)C 2119806957 JVCHHBKCHIWEEI-INIZCTEOSA-N 260.381 2.230 10 10 CECE CCc1cnc([C@H](N)c2ccc(N(C)C)cc2)nc1 2126217111 XVCXNTINFGSCLW-CQSZACIVSA-N 256.353 2.153 10 10 CECE Cc1cc(C)c([C@H](C)NCCOCCCO)c(O)c1 1324966350 XVBJYEHCHPPWJR-ZDUSSCGKSA-N 267.369 2.059 10 10 CECE CCN1CCc2cc(C3(O)CC4(COC4)C3)ccc21 2125812002 ZDRQICINERAYLA-UHFFFAOYSA-N 259.349 2.067 10 10 CECE Cc1cc(N2CCO[C@H](CF)C2)ccc1C[C@H](C)N 2115447022 LMZJFQBCZAAZAJ-SWLSCSKDSA-N 266.360 2.059 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](CCO)C(F)F)c(F)c1 2122010639 CYKNLNLTKOULBP-PRHODGIISA-N 277.286 2.331 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(F)(CO)C2)c(F)c1 2116283329 VSGVVQGOJTUUGW-JTQLQIEISA-N 270.323 2.017 10 10 CECE CN[C@@H](C)c1ccc(N2CC3(CC[C@H]3O)C2)c(F)c1 2123113872 GAYMINVHQJCZNB-IINYFYTJSA-N 264.344 2.067 10 10 CECE CC[C@H](C)[C@@H](C(=O)O)N(C)Cc1ccc(O)c(O)c1 2118358985 UFSZKLWSVMQFIQ-ZANVPECISA-N 267.325 2.029 10 10 CECE CCN1CCN(c2ccc(CN)c(F)c2)C(C)(C)C1 2118417750 JMDBYXGDUXUTBV-UHFFFAOYSA-N 265.376 2.205 10 10 CECE CCN[C@@]1(C(N)=O)C[C@@H](Sc2nccs2)C[C@H](C)C1 2118839820 UWQBPTYSTPVBOL-OUJBWJOFSA-N 299.465 2.257 10 10 CECE CCOCCOCCSc1ncc(C=O)s1 1901593466 WGLGZWSJWWPAOD-UHFFFAOYSA-N 261.368 2.101 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2CC[C@@H]2OC)c(O)c1 2130357426 CRPKCGVPEWGBDB-PGUXBMHVSA-N 265.353 2.476 10 10 CECE N[C@H]1CCCc2cc(N3CC4(CCOC4)C3)ccc21 2128272207 QTGWGOPDEYRRDK-HNNXBMFYSA-N 258.365 2.249 10 10 CECE N[C@H]1CCc2cc(N3CC[C@H]4COC[C@@H]4C3)ccc21 2128317991 ISRHDFIKCRQBQT-XEZPLFJOSA-N 258.365 2.105 10 10 CECE CC1(CO)CCN(c2ccc3c(c2)CC[C@H]3N)CC1 2128309012 MTMIBHIVSKVZOF-OAHLLOKOSA-N 260.381 2.231 10 10 CECE CN(C[C@H]1CCC[C@H]1O)c1ccc2c(c1)CC[C@@H]2O 2128314664 JBASUVSXVIROIF-WQVCFCJDSA-N 261.365 2.263 10 10 CECE CCN[C@@H]1CCc2cc(N(C)CCCCO)ccc21 2128314514 HJRGBSRGEBYUHL-MRXNPFEDSA-N 262.397 2.492 10 10 CECE CCN(c1ccc2c(c1)CC[C@H]2O)[C@H](C)CN(C)C 2128324473 FTNQEUNYESQBDZ-MLGOLLRUSA-N 262.397 2.443 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CC[C@@]3(CO)C2)cc1 1903835206 JBQLVBUNPNUFAQ-INWMFGNUSA-N 260.381 2.176 10 10 CECE CC1(C)COc2ccc(N3C[C@H]4NCC[C@@H]4C3)cc21 2132355126 FMGDSZFTQIIWPU-BXUZGUMPSA-N 258.365 2.155 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(Br)sn1 1909842154 XXMUTSVPYLVSIV-UHFFFAOYSA-N 290.146 2.336 10 10 CECE OCc1ccc(N2CC[C@H]3C[C@H]2CO3)cc1Cl 1947551202 CRDDFSLHOMUWAS-RYUDHWBXSA-N 253.729 2.200 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2ccc(Cl)nn2)C1 1912177095 GXAXNMYYMSLLBH-QMMMGPOBSA-N 252.709 2.405 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(Cc2ccc([N+](=O)[O-])cn2)C1 1912164020 RDWBZAFFORSELF-SECBINFHSA-N 262.273 2.122 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])C(C1CC1)C1CC1 1912174136 VKBUSWWURVLMQV-GFCCVEGCSA-N 266.345 2.254 10 10 CECE Cc1oc(C=O)cc1C(=O)NCc1c(O)cccc1F 1456027698 FNYFYIWYJRXEAF-UHFFFAOYSA-N 277.251 2.175 10 10 CECE CCCN([C@@H]1CCNC1)[C@H](C)c1ccc(O)cc1O 221573088 VHHPOCWGQFQNRX-VXGBXAGGSA-N 264.369 2.233 10 10 CECE O=C(O)C[C@@H](c1cccc(O)c1O)C(F)(F)F 1536142563 SSNIJPJAELEIGQ-LURJTMIESA-N 250.172 2.218 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC=C[C@@H]1C(=O)O 2136395265 YLMPJQSTKVBVSE-BXUZGUMPSA-N 260.337 2.139 10 10 CECE CCN1CCN(c2ccc(CN)cc2C(F)(F)F)CC1 116925838 PNHFLTGAUYVSIU-UHFFFAOYSA-N 287.329 2.306 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC[C@]2(CCN2)C1 1922992981 IELDOCNBSPVDPA-XJKSGUPXSA-N 259.397 2.251 10 10 CECE CC1(C)C[C@@H](O)CN(c2c(F)cc(CN)cc2F)C1 1923153244 OXUNPCNSQYYFKL-SNVBAGLBSA-N 270.323 2.021 10 10 CECE Cc1cc(F)ccc1-c1noc(-c2nnsc2N)n1 1923200286 HCTATZFLGBQHQE-UHFFFAOYSA-N 277.284 2.285 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1C[C@H]1c1ccco1 1639046441 ZXBMTMVNLYOSGJ-WBIIUDBISA-N 285.299 2.376 10 10 CECE Cc1c(CN2C[C@H](F)C[C@@H]2CN)n(C)c2ccccc12 1923569516 WQDUWFDJLZHXPP-CHWSQXEVSA-N 275.371 2.358 10 10 CECE COc1cc(Cl)cc(CN2C[C@H](C)C[C@@H](N)C2)c1O 229104502 FUHBJFWDIRQDSN-BXKDBHETSA-N 284.787 2.223 10 10 CECE O=C(Nc1ccc2nccnc2c1)c1cccc(O)c1O 1596480969 AEWNERCIBRXISA-UHFFFAOYSA-N 281.271 2.293 10 10 CECE CC(C)NCc1ccc(N(CCO)CC(F)F)cc1 231328991 PIFNPKHINQHUPX-UHFFFAOYSA-N 272.339 2.248 10 10 CECE CC(=O)C(=O)[C@@H](O)c1cccc(Br)c1Cl 1929214978 ROLCTVUTDSGUAF-JTQLQIEISA-N 291.528 2.294 10 10 CECE Nc1ccc(NC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)cc1 160793438 MCWZWBMQWNEWLG-MLGOLLRUSA-N 289.379 2.428 10 10 CECE CCOC(=O)N1CCN(/N=N/c2ccccc2OC)CC1 1860486225 SNBNQNXPLSXWLS-FOCLMDBBSA-N 292.339 2.468 10 10 CECE CCCN1N=C(C)/C(=C\c2ccccc2C(=O)O)C1=O 1865673964 HLMOQRVEGLVOCH-UKTHLTGXSA-N 272.304 2.396 10 10 CECE CC(C)[C@H](CO)CN(C)c1ccc2c(c1)OCO2 259015774 PEICPKPECJGTKJ-NSHDSACASA-N 251.326 2.116 10 10 CECE CCN(c1ccc([C@H](C)NC)c(O)c1)[C@@H](C)CN(C)C 232255455 FJMSXUSDDCVLOJ-STQMWFEESA-N 279.428 2.449 10 10 CECE CCN(C[C@H]1CCOC1)c1ccc(CO)c(OC)c1 2139684479 KXZHQWZJUWZCJD-GFCCVEGCSA-N 265.353 2.050 10 10 CECE Cc1cccc(CNCc2occc2C(=O)O)c1O 2139760576 SWBDEIDXVVSWIN-UHFFFAOYSA-N 261.277 2.282 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1CC[C@H](OC)C1 233694917 UEYUWIXMGSKLOI-MNOVXSKESA-N 278.352 2.425 10 10 CECE CC1=C(C)CN(c2cc3c(cc2Cl)[C@H](N)C(=O)N3)C1 2140688711 QPFZXBSGJZDJKZ-ZDUSSCGKSA-N 277.755 2.448 10 10 CECE C[C@@H](N)c1ccc(N2CC(CCO)C2)cc1Cl 1946924726 FFTBQNICVPGNBG-SECBINFHSA-N 254.761 2.178 10 10 CECE c1cc(N2CCCC2)ccc1CNCC[C@H]1CCNC1 1117953413 GMDTZUMCRKBHBV-INIZCTEOSA-N 273.424 2.376 10 10 CECE NCc1ccc(N2CC(O)(c3cccs3)C2)cc1F 1878935751 LDVZDWKXLIISNC-UHFFFAOYSA-N 278.352 2.054 10 10 CECE Oc1c(CNC[C@]23CCOC[C@@H]2C3)ccc(F)c1F 1880209130 VHOGXQWKHWOAMW-IINYFYTJSA-N 269.291 2.187 10 10 CECE C[C@H]1CN(c2c(F)cc([C@@H](C)O)cc2F)CC[C@@H]1O 1880485769 LQQVBINKLGNCHN-RWEMILLDSA-N 271.307 2.225 10 10 CECE CC(C)(N)[C@@H]1CCCCN1Cc1ccc(O)c(O)c1 2142942330 CEBIGRXOPBMXGL-AWEZNQCLSA-N 264.369 2.190 10 10 CECE CNC(=O)c1ccc(N)cc1Oc1ccc(N)cc1 1904308684 JDTGZEUKGQJDFN-UHFFFAOYSA-N 257.293 2.003 10 10 CECE CCCN1CCN(c2ccc([C@@H](C)N)cc2F)CC1 19872659 DZHJSXJFSUEZRS-GFCCVEGCSA-N 265.376 2.377 10 10 CECE CCN(CCN=[N+]=[N-])C[C@@H](O)COCc1ccccc1 1887716965 FFDYLIZDUJLILS-CQSZACIVSA-N 278.356 2.196 10 10 CECE CC(C)[C@@H](O)[C@@H](C)NCc1ccc(N(C)C)cc1 1964590766 XJKRHHMFKMPMAT-IUODEOHRSA-N 250.386 2.248 10 10 CECE Cc1ccc([C@H](C)N(C)C[C@H]2OCCO[C@H]2C)c(O)c1 2143681187 BZBKVWDPVBHCJQ-HEHGZKQESA-N 279.380 2.497 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C(=O)N(C)C)C2)c(Cl)c1 2143704172 XVGODJUBOQBYKW-ZYHUDNBSSA-N 295.814 2.274 10 10 CECE CN[C@H](CCCCF)[C@@H](O)c1ccc2c(c1)CCN2C 2147503029 WSFDJWWNLFXEQG-ZBFHGGJFSA-N 280.387 2.440 10 10 CECE CC(C)(CNC(=O)COc1ccc(N)cc1)C(F)(F)F 2144265277 VTTJLDLCYAZKDN-UHFFFAOYSA-N 290.285 2.352 10 10 CECE CC(C)NCc1cc(F)c(N2CC[C@@H](CO)C2)c(F)c1 167874826 KCOLCTCDKGAGDO-LLVKDONJSA-N 284.350 2.281 10 10 CECE Cc1cc([C@@H](N)[C@@H](O)c2ccc3c(c2)CCN3C)sn1 2147666796 ZGGADFCXAOIUQT-CABCVRRESA-N 289.404 2.177 10 10 CECE CCN[C@H](CCCOC)[C@@H](O)c1ccc(N(C)C)cc1 2147625510 QNFVNDVPQZEAAQ-CVEARBPZSA-N 280.412 2.191 10 10 CECE Cn1ncc(-c2cc(C(C)(C)C)cc(O)c2O)c1N 258426462 PEYARAWETCMZIX-UHFFFAOYSA-N 261.325 2.378 10 10 CECE NC(=O)c1cnc(Sc2csc(C(=O)O)c2)s1 2213435350 DXSYAABIXOEGFW-UHFFFAOYSA-N 286.359 2.153 10 10 CECE CCOC(=O)c1ccc2c3c(n(C)c2c1)C(=O)CC3 260797494 PXIVXRLQTQZELP-UHFFFAOYSA-N 257.289 2.484 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@H]3C[C@H]32)c(Cl)c1 2004447815 VGMZSKFXVRHBKA-CKLFPEKLSA-N 253.729 2.371 10 10 CECE C[C@H](NCc1nccn1C1CC1)c1c(O)cccc1O 2148838299 UICBVPSEKCWVLR-JTQLQIEISA-N 273.336 2.480 10 10 CECE CC[C@]1(O)CCN(c2ccc(CNC3CC3)cc2F)C1 2150757586 ATRPZYULNKJFTE-INIZCTEOSA-N 278.371 2.429 10 10 CECE N[C@@H](Cc1ccc(O)c(O)c1)c1nc2ccccc2[nH]1 40225887 POBJUSPLQOOJLO-JTQLQIEISA-N 269.304 2.217 10 10 CECE C[C@@H]1CCS[C@@H]1CN(C)c1ccc2c(c1)NC(=O)[C@H]2O 2150879174 WQPKFIAXBOZAKE-FZQKWOKYSA-N 292.404 2.250 10 10 CECE COCCc1nsc(CN2CCC(CN=[N+]=[N-])CC2)n1 2158910849 IZXSMIXBDVXMPG-UHFFFAOYSA-N 296.400 2.249 10 10 CECE Nc1ccc(C[C@@H](O)c2cnn([C@H]3CC3(F)F)c2)cc1 2151315495 RYKSCTQOTGNRIS-OLZOCXBDSA-N 279.290 2.322 10 10 CECE Nc1ccc(NC(=O)CCN2CCS[C@@H]3CC[C@H]32)cc1 2152207833 SQZDSECBCMWYRW-ZIAGYGMSSA-N 291.420 2.177 10 10 CECE CC1=C[C@@H](C)CN(c2ccc3c(c2)N(C)C(=O)[C@H]3N)C1 2152307029 SAABCIJRYYVCLP-BMIGLBTASA-N 271.364 2.065 10 10 CECE Oc1ccnc(NCc2cccc(Br)c2O)n1 2017528927 ZNTIOBDIZAAJRW-UHFFFAOYSA-N 296.124 2.262 10 10 CECE CN(C(=O)COc1ccc(N)cc1)c1ccc(F)cc1 49964573 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2.181 10 10 CECE Cc1cc(N2C[C@H]3COC[C@@H]32)ccc1CNC(C)C 2129796370 HERKKSCKLNGBCX-HOCLYGCPSA-N 260.381 2.328 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H](C)C(N)=O)c(Cl)c1 723177850 HYAIREXAYDNYEW-ZJUUUORDSA-N 283.803 2.321 10 10 CECE Cc1cn(C)nc1CN(C)c1ccc([C@H](C)O)c(O)c1 723500266 TYMSOTPALWDZTJ-NSHDSACASA-N 275.352 2.124 10 10 CECE COC(=O)c1sc2c([N+](=O)[O-])cccc2c1O 725307900 UJIDYGDEEOLFAT-UHFFFAOYSA-N 253.235 2.302 10 10 CECE CC[C@H](c1ccccc1O)N1CC[C@H]2[C@@H](C1)[C@@H]2C(=O)O 721222479 KJDFZCDAQVNMND-XTWPYSKKSA-N 275.348 2.496 10 10 CECE O=C(C[C@@H]1CCC2(CCC2)O1)NCc1ccc(O)cc1O 910958303 YPKFSILYAOVEJF-ZDUSSCGKSA-N 291.347 2.206 10 10 CECE C[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCS1 915525852 TWYACUZWLKDIPJ-JQWIXIFHSA-N 280.393 2.476 10 10 CECE CCc1cccc(CN2CC[C@@H]3CN(C)C[C@H]32)c1O 848912883 LFVHMAWNJTWHJA-UKRRQHHQSA-N 260.381 2.091 10 10 CECE COc1ccc(CN2CCOC(C)(C)[C@H]2C)c(O)c1 687954593 RWGGMCUTNJXIGK-LLVKDONJSA-N 265.353 2.400 10 10 CECE Cc1cc(CN[C@@H](C)c2cc(O)ccc2O)ncn1 2130071841 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291.347 2.272 10 10 CECE CC1(C)CNCCCN1c1ccc2c(c1)OCCO2 216853709 RUISDYNUOJPPTC-UHFFFAOYSA-N 262.353 2.036 10 10 CECE C[C@@H](N)c1ccc(N(C)CC2(CO)CC2)c(F)c1 1915532646 UYMFIMXTWQOWFO-SNVBAGLBSA-N 252.333 2.054 10 10 CECE COCC1CN(c2ccc(CNC(C)C)cc2F)C1 1916914090 WWMBSQHWYOTXFD-UHFFFAOYSA-N 266.360 2.406 10 10 CECE CCCNCc1ccc(N2CC(COC)C2)c(F)c1 1916911639 KTCGAAQVDGNXQG-UHFFFAOYSA-N 266.360 2.408 10 10 CECE CN(C(=O)Cc1ccc(O)c(O)c1)C1Cc2ccccc2C1 1625680652 CJQBACUXQIIBBJ-UHFFFAOYSA-N 297.354 2.266 10 10 CECE CCc1ocnc1CNCc1ccc2c(c1)CCO2 1926425208 ZVAVHCAIUZJFBH-UHFFFAOYSA-N 258.321 2.462 10 10 CECE Cn1ccc(C(=O)NCc2ccc3cccnc3c2O)c1 1643282838 BHDDUGJIFJTEAQ-UHFFFAOYSA-N 281.315 2.209 10 10 CECE CCOc1ccc(N2CCN(C[C@](C)(O)CC)CC2)cc1 1653840859 RPXGCURRBQDXMT-QGZVFWFLSA-N 292.423 2.368 10 10 CECE CCN(CCCN(C)C)c1ccc(CNC)cc1C 230725219 OQKPMUCXLCSNMV-UHFFFAOYSA-N 263.429 2.492 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)cc1 2138372384 AZQNTHBZBFSODY-CUBALJKWSA-N 260.381 2.174 10 10 CECE CCCNCc1ccc(N(C)C2COC2)cc1OC 2139682870 NHMORKAHECBYAA-UHFFFAOYSA-N 264.369 2.030 10 10 CECE CC[C@@H]1C[C@H](N(C)c2ccc(CO)c(OC)c2)CO1 2139701613 WGIBTKAGIQVRMV-UONOGXRCSA-N 265.353 2.191 10 10 CECE Nc1ccc(COc2nnc([C@H]3CCOC3)s2)cc1 2139899475 HEEBRFKKHAWFRJ-JTQLQIEISA-N 277.349 2.203 10 10 CECE COc1ccc(NN=NCCN2CCOCC2)cc1Cl 1860489963 LEJIRNYEGKSDNF-UHFFFAOYSA-N 298.774 2.460 10 10 CECE O=C(CCNCc1cc(Cl)ccc1O)N1CCCC1 20127274 YVCVLPJJDNBUOC-UHFFFAOYSA-N 282.771 2.148 10 10 CECE N[C@@H]1CC[C@H]2CN(Cc3c(O)cccc3F)C[C@@H]2C1 2141252665 BXYIUPCDWGYDCN-SDDRHHMPSA-N 264.344 2.091 10 10 CECE CCc1cnc(CC(=O)NCc2cc(Cl)ccc2O)[nH]1 824212935 CPCMENVQMYHJFR-UHFFFAOYSA-N 293.754 2.190 10 10 CECE CC1(C)[C@H](O)CC[C@H]1NCc1cc(F)cc(F)c1O 2142127634 WNXUODSFSKJQRM-VXGBXAGGSA-N 271.307 2.310 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1CCC[C@H](N)C1 1876150947 XXCPIMDHFUYOEB-AAEUAGOBSA-N 262.357 2.002 10 10 CECE CN[C@H]1C[C@H]2C[C@H]1C[C@H]2N(C)Cc1ccccc1O 1877522970 CKIYOYIKBRWEDR-LJISPDSOSA-N 260.381 2.211 10 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268.332 2.084 10 10 CECE Nc1ccc(CCOc2ccc(OC(F)F)nn2)cc1 2176329601 ANYRRSZPGASVBO-UHFFFAOYSA-N 281.262 2.282 10 10 CECE Nc1ccc(O)c(CN2CCCC3(CCOCC3)C2)c1 2171161549 WCGNRALIMMINQU-UHFFFAOYSA-N 276.380 2.367 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@H]2CN(C)CC[C@H]21 2171162315 YPGGBPWNGVUHOZ-DOTOQJQBSA-N 273.424 2.374 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC(C(C)(C)F)C2)cc1 2178848605 MEWKIOSQHNLHHI-OAHLLOKOSA-N 279.403 2.432 10 10 CECE COCC1(N(C)c2ccc(CO)cc2Cl)CC1 706377148 MHSBGBZWHUCXLE-UHFFFAOYSA-N 255.745 2.448 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H](C)[C@@H]2CO)cc1O 688640049 TWJLREFFAJTDDS-MJVIPROJSA-N 264.369 2.009 10 10 CECE C[C@H]1CC[C@@H](N(C)C(=O)c2cccc(O)c2O)CS1 689536773 CXBLCWGDLDLPLE-VHSXEESVSA-N 281.377 2.454 10 10 CECE CC[C@@H]1[C@@H](C(=O)O)CCN1[C@@H](C)c1ccc(O)cc1O 690674429 BPGIZBSJSVXCNF-TVYUQYBPSA-N 279.336 2.344 10 10 CECE CC(C)CNCc1ccc(N2CC([S@@](C)=O)C2)c(F)c1 2171957621 SYNYBSSDKALMFS-HXUWFJFHSA-N 298.427 2.138 10 10 CECE COc1ccc(N(C)[C@]2(CN)CO[C@H](C3CC3)C2)cc1 691264604 QPUPJBTZDAQVHH-JKSUJKDBSA-N 276.380 2.028 10 10 CECE COC(=O)C[C@@H](C)NCc1ccc(N2CCCC2)cc1 380351925 LHWAHMAULVHUAW-CYBMUJFWSA-N 276.380 2.328 10 10 CECE C[C@@H]1OCCN([C@H](C)c2c(O)cccc2O)[C@@H]1C 380572164 CMUMTUOYNPSMMU-MXWKQRLJSA-N 251.326 2.268 10 10 CECE COc1ccc(O)c(CN2CCN(C)C(C)(C)CC2)c1 712661934 CAMRLMMUHLCKOB-UHFFFAOYSA-N 278.396 2.317 10 10 CECE NCc1ccc(N2CCS[C@H](CO)C2)c2ccccc12 720069908 YAPPMFNBKGJQOF-ZDUSSCGKSA-N 288.416 2.213 10 10 CECE COCC[C@@H](COC)N[C@H](C)c1ccccc1O 381226883 HJYHOJZWDORQKQ-NEPJUHHUSA-N 253.342 2.094 10 10 CECE CN1CCc2cc([C@H](NN)[C@H]3C[C@@]34CC4(F)F)ccc21 2172030436 AKRVJRZMFZTSIM-KWCYVHTRSA-N 279.334 2.229 10 10 CECE Nc1ccc(OCCC(=O)NC2C3(CC3)C23CC3)cc1 715631643 QXZVOYKGCUAFIR-UHFFFAOYSA-N 272.348 2.097 10 10 CECE CC1(C)CN(c2c(F)cc(CN)cc2F)[C@H]2COC[C@H]21 384608681 LLJQILAURMJZCZ-MFKMUULPSA-N 282.334 2.285 10 10 CECE C[C@@H](N[C@H](CO)C1CCCC1)c1c(O)cccc1O 386119709 BZCLKWYSEXZMAB-ZYHUDNBSSA-N 265.353 2.300 10 10 CECE C[C@@H]1CCCN(c2ccc(CN)c(F)c2F)[C@@H]1CCO 697211625 SPVVJMAVOCLWFN-ZYHUDNBSSA-N 284.350 2.411 10 10 CECE CC(C)NCc1ccc(N2CCSC[C@H]2CO)c(F)c1 387977128 OCUMBPIDKDVYNB-CYBMUJFWSA-N 298.427 2.238 10 10 CECE CCN1CCC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 389192154 OOHQKDDVJJKRAL-ZIAGYGMSSA-N 260.381 2.453 10 10 CECE CCC(=O)NCCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 392985187 IFNPPXKABAWGEG-NEPJUHHUSA-N 276.380 2.365 10 10 CECE C[C@H](N[C@H](C)c1cc(O)ccc1O)C1CCN(C)CC1 396422934 AJVFZXAETCYMRP-NWDGAFQWSA-N 278.396 2.479 10 10 CECE COc1ccc(N(C)C[C@@H](C(=N)N)C2CCC2)cc1 397143468 YWFVZIWIOMGYBW-CQSZACIVSA-N 261.369 2.484 10 10 CECE C[C@H]1CC[C@H](O)CN1c1ccc(CN)cc1Br 399320853 IJYBEWZCLXOOCQ-ONGXEEELSA-N 299.212 2.257 10 10 CECE C[C@@H]1CC(NC(=O)Nc2ccc(N)cc2)C[C@@H](C)N1C 2166871090 TUYTZQOVRNKGND-GHMZBOCLSA-N 276.384 2.262 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@@H]3[C@H]3C[C@@H]32)c([N+](=O)[O-])c1 2174058380 BAZISCJKLPLZQT-XVXKCHKCSA-N 274.320 2.493 10 10 CECE COc1cccc(O)c1CN1CC(C)(CCC(=O)O)C1 2179837572 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C[C@@H]1CN[C@H](C(=O)N[C@H](C)c2ccccc2O)[C@@H](C)C1 2192627459 MEAQSXUMZVAMHV-OHTBPHCPSA-N 276.380 2.204 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)C[C@H](C)O1 2188576510 HVLPQMSEZOKCTG-GXFFZTMASA-N 280.324 2.091 10 10 CECE CN(C[C@@H]1C[C@H]1C(F)F)c1ccc(CO)c([N+](=O)[O-])c1 2188575730 JKESPKUMTCYDNK-GXSJLCMTSA-N 286.278 2.425 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N3CC[C@H]3CF)ccc21 2183171060 VDJZIGCQQWZWAN-SMDDNHRTSA-N 277.343 2.228 10 10 CECE FC(F)C[C@@H]1CNCCN1c1ccc2c(c1)COCC2 2183407493 IMCZPFNTVNMXSP-CQSZACIVSA-N 282.334 2.193 10 10 CECE O=C(NCC1(CC2CC2)CC1)c1cc(O)c(O)c(O)c1 2189884980 QUIXVOXFNRGHLH-UHFFFAOYSA-N 277.320 2.114 10 10 CECE Oc1cccc(CNC2C[C@@H]3CSC[C@H]3C2)c1O 2042846709 LCFBHRBMXNNHID-GHMZBOCLSA-N 265.378 2.329 10 10 CECE CCn1nc(CN2CCc3cc(CN)ccc32)cc1C 2189922918 JWSBUBVZLDPBFV-UHFFFAOYSA-N 270.380 2.233 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)CC(C)C 2044755195 VGCVAPJGGLWANA-LSDHHAIUSA-N 250.386 2.420 10 10 CECE CC1(C)CCN(c2ccc3c(c2)CC[C@H]3O)CC[S@]1=O 2184737875 MYOKQSNZKIYINV-FOIQADDNSA-N 293.432 2.404 10 10 CECE CN(CCCn1cccn1)c1ccc2c(c1)CC[C@@H]2O 2184733360 GWGGKCLTTBYAHS-INIZCTEOSA-N 271.364 2.389 10 10 CECE NC[C@@]1([C@@H](O)c2ccc(N3CCCC3)cc2)CC1(F)F 2196694183 ALPGNPYZNBFILW-UONOGXRCSA-N 282.334 2.304 10 10 CECE N[C@H]1CCc2cc(N(CC(F)(F)F)C3COC3)ccc21 2196632202 OKYPSNHKBMIRQW-ZDUSSCGKSA-N 286.297 2.400 10 10 CECE CC1(C)CNCC1=Cc1nccn1CC(F)(F)F 2050592370 ZOPCBDZUFJJUMP-UHFFFAOYSA-N 259.275 2.458 10 10 CECE O=S(=O)(Nc1ccc(O)cc1)[C@@H]1CCCC[C@@H]1F 2055256828 WFSISLDIFRVCFK-NWDGAFQWSA-N 273.329 2.415 10 10 CECE CCCOc1ccc(N2CCO[C@H]3CCNC[C@@H]32)cc1 2185528256 GPCLVVNQYCBGPU-HOTGVXAUSA-N 276.380 2.043 10 10 CECE CN(Cc1c(O)cccc1F)C[C@H]1OCC[C@@H]1F 2058676179 LUEXNZNSOCDDNP-WCQYABFASA-N 257.280 2.090 10 10 CECE COCCN(Cc1cc(C)ccc1O)[C@H]1CCCOC1 2197180218 CLYRIWOIRYQPHV-HNNXBMFYSA-N 279.380 2.328 10 10 CECE CN(CC(C)(C)CCF)C(=O)c1cc(O)c(O)c(O)c1 2191346566 QHBHSPFPJGIEAQ-UHFFFAOYSA-N 285.315 2.261 10 10 CECE CCOc1c(N)nsc1NCc1ccccc1O 2066426407 HHRHDMWXAAXLJW-UHFFFAOYSA-N 265.338 2.442 10 10 CECE NCCN(Cc1cc(F)ccc1O)C1CCCC1 2066565535 AJLXSLAFPAHUGK-UHFFFAOYSA-N 252.333 2.235 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3C[C@@H](CO)[C@@H]3C2)c(F)c1 2194519004 QGRBNRPCHUKCBO-PDEGPIFNSA-N 283.318 2.083 10 10 CECE CN(C)c1ccc([C@H](C[C@H]2C[C@H]2CF)NN)cc1 2071459490 BBFNSLPKLHZTRU-DYEKYZERSA-N 251.349 2.253 10 10 CECE Cc1ccc(N)cc1C(=O)NCCc1ccc(N)cc1 2191749466 JPKWVIWWLUBSGJ-UHFFFAOYSA-N 269.348 2.132 10 10 CECE Nc1ccc(CS(=O)(=O)Nc2c(O)cccc2F)cc1 2191761600 UXDRRGRKDPAEDD-UHFFFAOYSA-N 296.323 2.055 10 10 CECE CCOC(=O)C[C@@H](C)N[C@@H](C)c1ccccc1O 2072482203 QAVYTXITSFAJQA-MNOVXSKESA-N 251.326 2.385 10 10 CECE CCCN(CCO)c1c(F)cc([C@@H](C)O)cc1F 2074082771 PEVSWIKTHWMTTM-SECBINFHSA-N 259.296 2.227 10 10 CECE CO[C@@H]1CCN([C@@H](C)c2ccc(F)cc2O)C[C@H]1OC 2199565786 DXIAZIDQUSGHDS-COLVAYQJSA-N 283.343 2.328 10 10 CECE CN(C)c1ccc(CNCc2ccc(N)cc2)cn1 2100827976 UOSWYLYTIHRSSV-UHFFFAOYSA-N 256.353 2.020 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cc(Cl)cnc1Cl 2211686248 BHQWFGKDDBAHFB-UHFFFAOYSA-N 260.084 2.429 10 10 CECE Nc1ccc(OCCNC(=O)[C@@H]2C[C@H]2C2CCC2)cc1 2199902257 JBJODEVBGLZQIT-LSDHHAIUSA-N 274.364 2.200 10 10 CECE COc1ccc(CNCC[C@@H]2CO[C@H](C)C2)c(O)c1 2103184802 XGFGPWUOCUDAAV-NEPJUHHUSA-N 265.353 2.306 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N1CCOCCOCC1 2103239882 YRLDOQFOVYRQRQ-LLVKDONJSA-N 285.771 2.455 10 10 CECE Cc1cc(NC(=O)CCOc2ccc(N)cc2)sn1 2103703705 KGDBTNRPHPGOKP-UHFFFAOYSA-N 277.349 2.441 10 10 CECE CN(Cc1nc(C2CC2)no1)c1ccc(CO)cc1 2104125996 SXDNMYXHTHTXII-UHFFFAOYSA-N 259.309 2.076 10 10 CECE CC1(C)[C@H](N)C[C@H]1NCc1ccc2c(c1)CCCO2 2104271810 OSXSVAZPGOYECN-HUUCEWRRSA-N 260.381 2.227 10 10 CECE OCC1CCC(CNCc2c(O)cccc2F)CC1 2104477312 KNZQMPGUBKPTOY-UHFFFAOYSA-N 267.344 2.420 10 10 CECE C[C@H]1[C@@H](C(=O)O)CCCN1Cc1c(O)cccc1F 2104510513 ISRPYTFRNJOFOQ-UWVGGRQHSA-N 267.300 2.216 10 10 CECE C[C@@H]1[C@H](CN(C)c2ccc3c(c2)NC(=O)[C@@H]3O)[C@@H]1C 2105242334 QSVFVLVDELDZOK-XSPYEYLBSA-N 260.337 2.010 10 10 CECE C[C@@H]1CC[C@@H]1N(C)C(=O)CCOc1ccc(N)cc1 2105662711 SPBBXYVZRXQHEM-RISCZKNCSA-N 262.353 2.295 10 10 CECE CCN1CCc2cc([C@](C)(O)[C@@H]3CCCN3)ccc21 2106794877 APVYWVGUVCNTET-HOTGVXAUSA-N 260.381 2.029 10 10 CECE Cc1occc1[C@@H](O)[C@H](N)c1ccc(N(C)C)cc1 2106852227 CRDLHCFONPOJAF-HUUCEWRRSA-N 260.337 2.387 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CCN(C)C3)ccc21 2106800267 FXHIDEZLPNTCRO-ZBFHGGJFSA-N 260.381 2.054 10 10 CECE Oc1ccc(CNC[C@@H]2CC[C@H]3C[C@H]2CO3)cc1O 2087946425 PZBDIRIGVTYTHO-AVGNSLFASA-N 263.337 2.003 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3COCC[C@H]32)cc1O 2088758182 NRICJVYAJRZCMA-MISXGVKJSA-N 262.353 2.027 10 10 CECE CC(C)OCC1CN(c2ccc([C@H](C)O)c(O)c2)C1 2109581585 XSZWJNBDZKIHPB-NSHDSACASA-N 265.353 2.307 10 10 CECE CC(C)OCC1CN(CCOc2ccc(N)cc2)C1 2109586359 XTUDUNMVTDKCRK-UHFFFAOYSA-N 264.369 2.004 10 10 CECE CCNCc1ccc(N(CCO)[C@H]2C[C@@H]2C)cc1C 2110785064 VZPQTMZDRVLRCQ-BBRMVZONSA-N 262.397 2.312 10 10 CECE C[C@H]1C[C@@H](N(C)Cc2ccc(N)cc2)CN1C1CC1 2092475175 LFBDQQNELSZHMS-BLLLJJGKSA-N 259.397 2.326 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1coc(C)n1 2092747673 BZNDUVTXLBNUBR-UHFFFAOYSA-N 259.309 2.228 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@H](O)[C@H](F)C1 2092821905 GMGVZHHYGBGYCW-HIFRSBDPSA-N 266.360 2.012 10 10 CECE C[C@@H](N[C@H](C)c1ccnn1C)c1ccc(O)cc1O 2094124256 JRRZEGYCVNOQOQ-NXEZZACHSA-N 261.325 2.243 10 10 CECE Cc1cnn(C)c1CN(C)c1ccc([C@@H](C)O)cc1 2094117731 JJUWRNSKFMZHQC-GFCCVEGCSA-N 259.353 2.418 10 10 CECE CO[C@@H]1COC[C@H]1CN[C@@H](C)c1ccc(C)cc1O 2097868846 URJZETICRPGPAQ-YWPYICTPSA-N 265.353 2.013 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@H]2CCCCS2(=O)=O)CC1 2099338141 DSSKGJMXULUPRN-VXGBXAGGSA-N 286.401 2.119 10 10 CECE C[C@@H]1CC[C@H](C(=O)O)N([C@H](C)c2ccc(O)cc2O)C1 2201058742 FECDBFZPOWXVAR-GIPNMCIBSA-N 279.336 2.344 10 10 CECE C[C@@]1(NC(=O)COc2ccc(N)cc2)C=CCCC1 2112774506 WEJHNUGYHUJQGO-OAHLLOKOSA-N 260.337 2.263 10 10 CECE CC[C@@H](N)c1ccc(N2CC[S@@](=O)C(C)(C)C2)cc1 2114520973 CXJWUONPVQEABI-AUUYWEPGSA-N 280.437 2.444 10 10 CECE Cc1nc(Cl)cc(NC(=O)Cc2ccc(O)c(O)c2)n1 2203480406 HPHVGBLOZKSJRL-UHFFFAOYSA-N 293.710 2.031 10 10 CECE OCc1cnc(Sc2nc3ncccc3o2)s1 2213515961 HYUHQPATIUAKEO-UHFFFAOYSA-N 265.319 2.323 10 10 CECE COc1cc(N(C)C[C@H](O)C2CCCC2)ccc1CN 2204545086 KPXKDHYHMGWQSG-HNNXBMFYSA-N 278.396 2.141 10 10 CECE COc1cc(N2CCC[C@@H]3OCC[C@H]3C2)ccc1CO 2204568081 YCJRTJUWNLQAQL-WFASDCNBSA-N 277.364 2.193 10 10 CECE CNCc1ccc(N(C)C[C@H]2OCC[C@H]2C)cc1OC 2204534977 CWCXQPWXVWRZSG-MLGOLLRUSA-N 278.396 2.276 10 10 CECE CCN(CCCCO)c1ccc2c(c1)OCCO2 2219593310 SAKJCYPWVYHZHI-UHFFFAOYSA-N 251.326 2.057 10 10 CECE COc1ccc(N2CCC(CCO)CC2)c(F)c1 2219621519 JADMNRUQAQFOFQ-UHFFFAOYSA-N 253.317 2.433 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCN2CCC1CC2 2232032858 HHPJOQGZKBODTK-ZDUSSCGKSA-N 259.397 2.299 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)Cc1cccnn1 2232096588 RVCVLWNEXFACAY-GFCCVEGCSA-N 256.353 2.441 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)CC2(CC(=O)O)CC2)C1 2234176945 OOUSQSSUWCHPND-JTQLQIEISA-N 280.328 2.180 10 10 CECE OCCC[C@H]1CCCN(c2c(F)cc(CO)cc2F)C1 2234183590 LKKXBHZMNLMAEM-LLVKDONJSA-N 285.334 2.446 10 10 CECE OC[C@@]1(F)CCCN(c2ccc3c(c2)OC(F)(F)O3)C1 2235065056 PNSBYPHTXWDPFX-GFCCVEGCSA-N 289.253 2.309 10 10 CECE CC(C)[C@H]1[C@H](O)CCN1c1ccc2c(c1)OCCCO2 2235128617 FELQTAVNRPTRBG-CJNGLKHVSA-N 277.364 2.444 10 10 CECE OC[C@@H]1C[C@@H]2CCC[C@H]2N1c1ccc2c(c1)OCCO2 2235100867 GSLPVULTFIOZOM-FPMFFAJLSA-N 275.348 2.198 10 10 CECE CNCc1cc(OC)ccc1N1C[C@H](CO)CC1(C)C 2235964075 VOYGELFCVFTQAM-GFCCVEGCSA-N 278.396 2.012 10 10 CECE C[C@]12CC[C@@]1(C)C(=O)N(Cc1ccccc1O)C2=O 2225924058 FKYIUKOUGPBKKV-GASCZTMLSA-N 259.305 2.067 10 10 CECE COc1ccc(N2C[C@H](CO)CC(C)(C)C2)c(CO)c1 2236001617 HYCSSPYBCYHMTP-GFCCVEGCSA-N 279.380 2.032 10 10 CECE CC1(C)COc2ccc(N3C[C@H]4C[C@]4(CO)C3)cc21 2226669376 TYBIRIOHGIYOLH-BDJLRTHQSA-N 259.349 2.175 10 10 CECE CN(c1ccc2c(c1)OC(F)(F)O2)[C@@H]1CCC[C@@H]1O 2226705098 BOKNDDADMIZLFB-ZJUUUORDSA-N 271.263 2.358 10 10 CECE COc1ccc(N2CCC[C@@H]2CCCO)cc1OC 2226806753 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C[C@@H](NCC1(F)CCOCC1)c1ccc(O)cc1O 2229930657 VYBRZYRFSKOLRT-SNVBAGLBSA-N 269.316 2.267 10 10 CECE OC[C@H]1CN(c2ccc(CNC3CCC3)cc2)CCS1 2240063873 NHFAGQLAXYEKHM-MRXNPFEDSA-N 292.448 2.243 10 10 CECE CCn1ncc(CN(C)c2ccc([C@H](C)O)cc2C)n1 2240839701 JARQRZSVMSCWJU-LBPRGKRZSA-N 274.368 2.296 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)[C@H]1CCN(C)C(=O)C1 2240834751 CYILYRDDLNDSNS-JSGCOSHPSA-N 276.380 2.105 10 10 CECE CCn1ncnc1CN(C)c1ccc([C@H](C)O)cc1C 2240833388 NJEDTXAFCFNDMK-LBPRGKRZSA-N 274.368 2.296 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(C)[C@@H](C)CF)ccc21 2270217131 IQAHYAGQNYUQRW-ZANVPECISA-N 265.332 2.084 10 10 CECE CNC(=O)[C@H](C)N(C)[C@@H](C)c1cc(Cl)c(C)cc1O 2270975830 KALIIDCILNJPSJ-UWVGGRQHSA-N 284.787 2.481 10 10 CECE C[C@H]1C[C@@H](O)CN(c2ccc(OC(F)F)cc2)C1 2263855348 YPZAAHCDGRVBRD-GXSJLCMTSA-N 257.280 2.495 10 10 CECE COc1ccc(N(C)C2C[C@@H](OC)[C@H](OC)C2)cc1 2264363088 QWAXODHRWIZHBD-HUUCEWRRSA-N 265.353 2.324 10 10 CECE CCc1nonc1COc1ccc(CNC)cc1C 2274266893 FINCFQPBMMGGDY-UHFFFAOYSA-N 261.325 2.239 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nncs2)cc1O 2266634992 DQJLJURYEYKAFF-VIFPVBQESA-N 278.381 2.161 10 10 CECE C[C@@H](N1CCN(c2ccc(N)cc2)CC1)C(F)(F)F 2278449042 UFHAOAVSIGONFJ-SNVBAGLBSA-N 273.302 2.342 10 10 CECE Cc1cc(N2CC[C@@H](C)[C@@H](CO)C2)ccc1[C@@H](C)N 2269651123 HMZAJVNMKGTYBI-MRVWCRGKSA-N 262.397 2.469 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H]2CC(N)=O)c(Cl)c1 2270069938 QVDMXGFUQHWTSG-ONGXEEELSA-N 282.771 2.238 10 10 CECE C[C@H](CCNCc1cc2c(cc1O)OCO2)OC(F)F 2290130254 NQYCPFGUTQJCAB-MRVPVSSYSA-N 289.278 2.228 10 10 CECE COc1ccc(N2C[C@@H]3CCNC[C@@H]3C2)c2c1CCC2 2284531487 PEUPUNUAKDXNPV-QWHCGFSZSA-N 272.392 2.230 10 10 CECE CC1(C)[C@@H]2C[C@@H]2CN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2284506387 FEKPDGKNRCJGJL-HUQFOHBGSA-N 276.311 2.046 10 10 CECE C[C@H]1C[C@@H](C)N(Cc2ccc(N3CCNCC3)cc2)C1 2286064673 BGBIZSDGCHZJJZ-LSDHHAIUSA-N 273.424 2.327 10 10 CECE COc1cc(OC)c(N2CC[C@H](N)C[C@@H]2C)c(OC)c1 2287155677 QBIVXOPFWBIGPT-QWRGUYRKSA-N 280.368 2.028 10 10 CECE CC[C@@H]1[C@H](O)CCN1Cc1cc(F)cc(C(C)=O)c1O 2288912423 YCCQZGSVQRBKAL-ZIAGYGMSSA-N 281.327 2.079 10 10 CECE COC[C@@H]1C[C@H](CN)N(c2ccc(OC(C)C)cc2)C1 2289510850 LNRYNNLIXRTONV-UKRRQHHQSA-N 278.396 2.274 10 10 CECE COCC1(C)CC(N(C)c2ccc(CN)c(OC)c2)C1 2289708156 AUMRWFQAFLQSEM-UHFFFAOYSA-N 278.396 2.405 10 10 CECE CC1(C)CC[C@](Sc2nccs2)(C(=O)O)CN1 2306961532 AQZPWKRJCGSCPX-LLVKDONJSA-N 272.395 2.221 10 10 CECE Cc1ccc(CN2CCO[C@H]3C[C@@H]32)c(O)c1Br 2307468163 DZVFHGQXNMCCPL-QWRGUYRKSA-N 298.180 2.436 10 10 CECE COCCN(CCOC)N=Nc1cccc(NC(C)=O)c1 2330216818 IIMXPOQPMWNSKJ-UHFFFAOYSA-N 294.355 2.239 10 10 CECE CN(c1ccc(CN)cc1)[C@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12 2331842574 FJRVVSIWSYTBTP-AALSBFMBSA-N 258.365 2.147 10 10 CECE N[C@@H](c1ccccc1O)[C@@]1(O)C[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21 2332252327 AKXKCKSEUDMOMW-CUZZDHPWSA-N 259.349 2.189 10 10 CECE CC[C@@H](c1ccccc1O)N1C[C@@H]2C[C@H]1[C@H]2C(=O)O 2333051614 KXJLFUGUMBUFHE-HVTMNAMFSA-N 261.321 2.248 10 10 CECE NN[C@@H](c1ccccc1O)[C@H]1OC[C@@H]2CCCC[C@H]12 2333522144 IZGGYFMAYCJEAT-GVARAGBVSA-N 262.353 2.102 10 10 CECE CO[C@H](C)CCSC[C@H](O)COc1ccc(N)cc1 2336904610 NPFOMBOYDLPSPQ-DGCLKSJQSA-N 285.409 2.167 10 10 CECE CNCc1ccc(N2C[C@H]3CC[C@H]2C[C@H]3O)cc1C 2337167119 SKTSYFCPSLDBFM-VNQPRFMTSA-N 260.381 2.064 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(C3CC3)c2)CC[C@H]1O 2339147626 YJBLQUWPLMJYKM-BDJLRTHQSA-N 260.381 2.230 10 10 CECE C[C@@]1(CCO)CCN1c1ccc(CN)c(C2CC2)c1 2339156999 CUXSMVRIBUTHJT-INIZCTEOSA-N 260.381 2.374 10 10 CECE COc1cc(N(C)Cc2cnc(C)o2)ccc1CN 2342833213 GSPPLFAZBOXPHR-UHFFFAOYSA-N 261.325 2.087 10 10 CECE C[C@H]1[C@H](C)N(c2ccc(CN)c(F)c2F)CC[C@H]1O 2344531589 XANHHNOTUFKCEC-HOTUBEGUSA-N 270.323 2.019 10 10 CECE C[C@H]1[C@H](C)N(c2ccc3c(c2)OCCO3)CC[C@H]1O 2344537999 ACOFSXYKPMWFQU-GMXVVIOVSA-N 263.337 2.053 10 10 CECE COCc1ccc([C@H](NCCCN=[N+]=[N-])C(=O)O)s1 2352174088 NUKIJVMUZPDLIE-JTQLQIEISA-N 284.341 2.310 10 10 CECE COc1cccc(O)c1CN(C)C[C@@H]1C[C@@H]2CC[C@H]1O2 2355028311 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10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(O)c(CN)c1 258504878 LDEMZFJVEGVEBD-SECBINFHSA-N 266.341 2.437 10 10 CECE COc1cccc(CN2CCC[C@@H]([C@H]3CCCN3)C2)c1O 252413533 DQYHKVNTDGEHCC-UKRRQHHQSA-N 290.407 2.365 10 10 CECE COC(=O)[C@@H]1CCN(Cc2cc(Cl)cc(C)c2O)C1 271735192 OFKQHVUNJNWTLB-SNVBAGLBSA-N 283.755 2.349 10 10 CECE Cc1ccc([C@@H](C)N[C@@H]2CCC(=O)N(C)C2)c(O)c1C 273622775 ZPHCFNWUSCOPDM-CHWSQXEVSA-N 276.380 2.280 10 10 CECE O=c1c(Sc2nccs2)nccn1C(F)F 807937091 XKMGZJZCGBUMFF-UHFFFAOYSA-N 261.278 2.246 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)C[C@H](C)CN1 2162641004 WXKOZXUHMOIBDN-OLZOCXBDSA-N 276.380 2.282 10 10 CECE CC(C)(C)[C@@H](C(=O)O)N1CCCc2cc(CN)ccc21 2162727719 NWMBSMMSNBQLRX-CQSZACIVSA-N 276.380 2.397 10 10 CECE CN(c1ccc(CO)cc1[N+](=O)[O-])[C@@H]1[C@H]2C[C@H]2[C@H]2C[C@H]21 2166622761 GSHSNBFDDWFBII-HSKKSDQVSA-N 274.320 2.178 10 10 CECE CN(C)c1ccc([C@H](O)[C@]23C[C@H]4CC[C@@H](N4)[C@@H]2C3)cc1 2163063976 UAQXDCFKBZLMPK-SOKJMZBUSA-N 272.392 2.317 10 10 CECE 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10 10 CECE CC[C@H](C)NCc1ccc(N2CCS(=O)CC2)c(F)c1 2240033446 OIKFSWDFPKAAJZ-LBPRGKRZSA-N 298.427 2.283 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c(C)c1 2240755547 CHPMMRNASXSMSA-UTXMOHQDSA-N 273.424 2.272 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@H](C)NC(=O)C1(C)C 2240754359 SKNVJDNELKVPLL-RYUDHWBXSA-N 275.396 2.118 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCC[C@@H](S(C)(=O)=O)C1 2240831766 WFPNFLGMDVOQBG-GXTWGEPZSA-N 297.420 2.062 10 10 CECE CN(CC[C@@H]1CCO1)c1ccc(CO)cc1Cl 2253181953 PKLXCDMIHPRUSP-LLVKDONJSA-N 255.745 2.448 10 10 CECE CC[C@@H](C)[C@H](N)CNCc1cnc(SC)s1 2243843917 HZGMXWMXGNAYRV-PSASIEDQSA-N 259.444 2.328 10 10 CECE COc1ccc(N2C[C@@H](F)C[C@@H](O)C2)c(C)c1C 2256952487 ITMWDVXJGUVBIC-NWDGAFQWSA-N 253.317 2.221 10 10 CECE CSc1ncc(CNC[C@H]2CNCC[C@@H]2C)s1 2248739242 JRYDSYHHLMZAMY-VHSXEESVSA-N 271.455 2.200 10 10 CECE CCc1nsc(CNCc2cccc(C)c2O)n1 2260230779 WJJTVYPEALUUNE-UHFFFAOYSA-N 263.366 2.404 10 10 CECE C[C@@H](COC(F)F)OC(=O)CCc1ccc(N)cc1 2265083653 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10 CECE C[C@@H]1CN(C)CC[C@]1(N)c1ccc2c(c1)CCCN2C 2163099563 JKJNCBREALJHRR-CXAGYDPISA-N 273.424 2.195 10 10 CECE CCN1CCc2cc([C@@H](N)c3cnn(CC)c3)ccc21 2163132687 FHXDMISFRBVGRW-MRXNPFEDSA-N 270.380 2.334 10 10 CECE CN1CCc2cc([C@@H](N)[C@@]3(O)C[C@@H]4CC[C@@H]4C3)ccc21 2163139720 CDQJZPXVLWFONS-WTTBNOFXSA-N 272.392 2.230 10 10 CECE O=C(O)[C@@H](O)c1cc(S)c2scc(O)c2c1 396377878 ORSAUTKHWJWBED-QMMMGPOBSA-N 256.304 2.014 10 10 CECE C[C@H](N[C@H]1CCNC[C@@H]1C)c1ccc(F)cc1O 817972628 YUPWLFSBZGQKLI-KWBADKCTSA-N 252.333 2.180 10 10 CECE CC(=O)C(=O)COC(=O)/C(F)=C/C1CCCCC1 814545267 WDLBJSHUUGEJAL-XFFZJAGNSA-N 256.273 2.121 10 10 CECE COc1ccc(N2CCC[C@]3(CC[C@@H]3O)C2)c(N)c1 2129557263 UUEYHSBCHZNLLY-GJZGRUSLSA-N 262.353 2.019 10 10 CECE CN1CCCC12CN(c1cc(Cl)c(CN)cc1F)C2 2129977894 RVUGSSBDHLYQDF-UHFFFAOYSA-N 283.778 2.222 10 10 CECE Oc1cc(Br)ccc1CN1CCC2(COC2)C1 827644734 QXFIMLUHTXYXJY-UHFFFAOYSA-N 298.180 2.377 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@@H]2CCCCN21 901055245 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CN(Cc1cc(F)ccc1O)[C@H]1C[C@H]2CC[C@H]1O2 2220812190 GSLUVLPWTMOKDI-MBNYWOFBSA-N 251.301 2.283 10 10 CECE COc1cc(OC)c(NCc2ccc(N)cc2)cn1 2231217008 JQGQEAPUXBJNGF-UHFFFAOYSA-N 259.309 2.293 10 10 CECE C[C@H]1[C@@H](O)CN1c1ccc(CNC2CCC2)cc1F 2231480027 GZWQUMSUHAYZLK-BONVTDFDSA-N 264.344 2.037 10 10 CECE CN[C@H](C)c1ccc(N2CCO[C@H](CF)C2)c(C)c1 2232092441 SWXVREFTGHASAU-TZMCWYRMSA-N 266.360 2.450 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)Cc1cn(C)cn1 2232098752 RBXVZXHPWBWUDJ-LBPRGKRZSA-N 259.353 2.418 10 10 CECE C[C@@H](CO)CC1CN(c2ccc(CN)cc2Cl)C1 2222935455 IKUMBGDBAZSDRR-SNVBAGLBSA-N 268.788 2.253 10 10 CECE CCOc1ncc([C@H](O)Cc2ccc(N)cc2)s1 2223411941 KQQZVTWYCKOBGQ-LLVKDONJSA-N 264.350 2.400 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CCCN(C)C 2223985956 VPFGMALUGXLCLK-CYBMUJFWSA-N 250.386 2.436 10 10 CECE CC(C)[C@@]1(C(=O)O)C[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2234171514 MPAXTHPLQXTJML-NRUUGDAUSA-N 280.328 2.035 10 10 CECE O[C@H]1C[C@H]2C[C@H]1CN(c1ccc3c(c1)OC(F)(F)O3)C2 2235064357 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CC(C)(O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1 2226770435 QGKLMXWJGNCNHQ-NSHDSACASA-N 263.337 2.055 10 10 CECE CO[C@@H]1C[C@@H](O)CN(c2ccc(OC(C)C)cc2)C1 2226766004 OSJUANHCSWYGAY-UKRRQHHQSA-N 265.353 2.060 10 10 CECE C[C@H]1CCC[C@H](COC(=O)Cc2ccc(N)cc2)O1 2226873408 WYINBMSRYFOFMF-SMDDNHRTSA-N 263.337 2.312 10 10 CECE COc1ccc(N2CC[C@H](CO)C[C@@H]2C)cc1OC 2226808461 KUWWQOGMOOBIDJ-RYUDHWBXSA-N 265.353 2.301 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)c(F)c1F 2226929476 IWLGTUXKUSQUFU-WCABBAIRSA-N 269.291 2.181 10 10 CECE COc1ccc(N2CC[C@@H](CO)C[C@H]2C)c(C=O)c1 2227687391 DSIFVXQTZOUNDL-VXGBXAGGSA-N 263.337 2.105 10 10 CECE CCO[C@H]1CCCN(c2ccc(OC)cc2CN)C1 2227672215 GHEJVBJGRLVXNH-AWEZNQCLSA-N 264.369 2.159 10 10 CECE COc1cccc(O)c1CNC[C@@H](F)C1CCOCC1 2238297180 IUHSQVSZEDMDPJ-CYBMUJFWSA-N 283.343 2.255 10 10 CECE CN(C[C@@H](F)[C@H]1CCOC1)c1ccc2c(c1)CC[C@H]2N 2238333144 KVXYOBWJKOMBLZ-APHBMKBZSA-N 278.371 2.443 10 10 CECE CN(C)c1ccc(OCC2(CC(=N)NO)CC2)cc1 2229381174 KBHPUESPOJKKCA-UHFFFAOYSA-N 263.341 2.258 10 10 CECE CNc1cnc(COc2ccc(N(C)C)cc2)cn1 2229375066 WPBAQRNVDYFFPM-UHFFFAOYSA-N 258.325 2.163 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])c1scnc1C 2229627830 SSGSNOWLNIEFFO-LLVKDONJSA-N 283.357 2.130 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1 2240043615 LMOHEFUWSQDESC-VZEFYGNVSA-N 274.408 2.249 10 10 CECE CO[C@@]1(CO)CCCN(c2ccc([C@@H](C)O)cc2C)C1 2240831874 ZMZXSJLNQBQBJT-CJNGLKHVSA-N 279.380 2.026 10 10 CECE Cc1cc(N2CCS(=O)(=O)[C@H](C)[C@@H]2C)ccc1[C@@H](C)N 2285131314 NCDPRSHLCDQKTG-FRRDWIJNSA-N 296.436 2.027 10 10 CECE C[C@@H](O[C@H](C)C(F)F)C(=O)Nc1ccc(N)cc1 2258200198 CSQDAJIPUAORRH-HTQZYQBOSA-N 258.268 2.266 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@H]2C3)c(F)c1 2258859961 IKIZOMFGLVJPAN-JFGNBEQYSA-N 251.301 2.104 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1c(F)cc([C@H](C)N)cc1F 2273223575 BDVNILUDJHWYOD-HJIKLVIJSA-N 270.323 2.334 10 10 CECE CN1CC2(CCN(c3ccc(CO)c(Cl)c3)CC2)C1 2265197871 JDLBMNWIUBNCQX-UHFFFAOYSA-N 280.799 2.364 10 10 CECE COc1ccc(N2CCN[C@@H](C)CC2)c(OC)c1C 2278014929 IXGQYDZHMFAHPY-NSHDSACASA-N 264.369 2.200 10 10 CECE CC[C@@H](C)[C@@H](N)[C@@H](O)c1ccc2c(c1)CCCN2C 2278574383 NUIMMKRYSNGQQI-LYRGGWFBSA-N 262.397 2.476 10 10 CECE Cc1nc(Sc2ncc(C(=N)NO)s2)nc(C)c1C 2278775886 YCDSPDUIQAKGES-UHFFFAOYSA-N 295.393 2.314 10 10 CECE CO[C@@H]1CCN(CCN[C@@H](C)c2cc(C)ccc2O)C1 2283083288 RQFYKUFGKRFTOP-UONOGXRCSA-N 278.396 2.072 10 10 CECE COC[C@]1(O)CCCN(c2ccc(OC)c(C)c2C)C1 2284511729 FCVGNCGBQALYFK-INIZCTEOSA-N 279.380 2.290 10 10 CECE Cc1cc(N(C)C[C@@H]2COCCCO2)ccc1[C@H](C)O 2285171662 YNKOZSMMRDDYTP-DZGCQCFKSA-N 279.380 2.290 10 10 CECE COc1ccc(N)c(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])c1 2286941809 BHFKWTXJQGQYSJ-NEPJUHHUSA-N 275.312 2.239 10 10 CECE Cc1cc(N2N=C(C(=O)O)CC2=O)c(Cl)cc1Cl 2318290903 QLLCRFRXMHEZMA-UHFFFAOYSA-N 287.102 2.479 10 10 CECE CC(C)[C@@H]1C[C@@H](O)CN1c1ccc(CN)cc1Cl 2321377025 MCXJTWXYVZFWHI-RISCZKNCSA-N 268.788 2.394 10 10 CECE FC1(F)CC12CN(c1ccc3c(c1)CCNC3)C2 2326878335 XDAWSEIFRVGBNX-UHFFFAOYSA-N 250.292 2.178 10 10 CECE O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2Cc1c(O)cccc1Cl 2329069836 NRLGSRYBFQJESE-HOTUBEGUSA-N 281.739 2.483 10 10 CECE O[C@H]1CC[C@@H]2CN(c3ccc(OC(F)F)cc3)C[C@H]12 2335080587 LITNGXYSVQQGTL-ICCXJUOJSA-N 269.291 2.495 10 10 CECE C[C@]12C[C@H](C1)[C@H](C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-])CO2 2337659106 FZKGBBWIUFZISC-YFVNTRNASA-N 264.329 2.149 10 10 CECE CO[C@@H]1CN(Cc2cc(N)ccc2O)C2(CCC2)C1 2337851930 CIUPQXSOOXYREV-ZDUSSCGKSA-N 262.353 2.118 10 10 CECE CCN[C@](CSc1nccs1)(C(N)=O)[C@@H]1CC1(C)C 2340936857 RKAVKVFPTRTIGY-RNCFNFMXSA-N 299.465 2.115 10 10 CECE COc1ccc(N(C[C@@H](C)O)C2CCCC2)c(N)c1 2342951350 NTEXPZZYPLCQCV-LLVKDONJSA-N 264.369 2.407 10 10 CECE Cc1ccc(O)c(CNC[C@]2(O)C[C@H]2C(F)(F)F)c1 2344269084 MQSQTOLJZMIDDG-VXGBXAGGSA-N 275.270 2.104 10 10 CECE OCc1cc(F)c(N2[C@H]3CCC[C@H]3C[C@@H]2CO)c(F)c1 2354700252 HLLNZSJHDFFTBS-WDMOLILDSA-N 283.318 2.197 10 10 CECE C[C@@H](N[C@@H]1C[P@](C)(=O)C[C@H]1O)c1ccc(N(C)C)cc1 2355678766 NRSORBRFIDOCKZ-HAYILDEMSA-N 296.351 2.139 10 10 CECE CCOc1ccc(/C=C2\SC(=S)N(N)C2=O)cc1 4882759 JAVIWBDMJWBISB-YFHOEESVSA-N 280.374 2.160 10 10 CECE C[C@H](CNC[C@H]1CCCO1)Sc1nccs1 53647016 CWOBVOFLCAUFCA-NXEZZACHSA-N 258.412 2.392 10 10 CECE Oc1ccccc1CN1CCC(Nc2cccnn2)CC1 179571434 ZPAUMWQAABWCKK-UHFFFAOYSA-N 284.363 2.259 10 10 CECE CC[C@@]1(C(=O)O)CCCN1[C@H](C)c1c(O)cccc1O 300441654 MCFKGMMFBJAMIZ-BMIGLBTASA-N 279.336 2.488 10 10 CECE COCCNCc1ccc(N2CCOCC2(C)C)c(C)c1 62737011 STRRZZDOSVDBBZ-UHFFFAOYSA-N 292.423 2.346 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)C[C@@H]2C[C@H]2CF)cc1 2357146735 ACTJJURCHHUDCP-OFQRWUPVSA-N 279.403 2.290 10 10 CECE N[C@H](CCCC(=O)O)c1ccc(Br)cc1O 309258244 UCLBCIHYXDFTDA-SECBINFHSA-N 288.141 2.409 10 10 CECE CCc1nc2n(n1)C[C@H](N[C@H](C)c1ccccc1O)CC2 183597196 BTLGJPPYCORNSG-VXGBXAGGSA-N 286.379 2.212 10 10 CECE Cc1ccc(C(=O)N2CCN(c3ccc(N)cc3)CC2)o1 35367297 MILCEBCLTJGZFT-UHFFFAOYSA-N 285.347 2.133 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(Br)c2)CC[C@@H]1O 228156654 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CCN1CCc2cc([C@]3(O)CN(C)C(C)(C)C3)ccc21 2163073334 IAIHWNVBOXYKHW-QGZVFWFLSA-N 274.408 2.371 10 10 CECE CCC[C@@H]1CNCC[C@@]1(O)c1ccc2c(c1)CCN2C 2163075016 YGRRSDNPRSWIBW-NVXWUHKLSA-N 274.408 2.276 10 10 CECE CCN1CCc2cc([C@H](O)[C@H](N)CC(F)(F)F)ccc21 2163078228 ZYRYSGQYSCKUIY-YPMHNXCESA-N 288.313 2.382 10 10 CECE COC[C@@H](C)C[C@H](NN)c1ccc(N2CCCC2)cc1 2163096550 XWNITPMCBCTXQW-BBRMVZONSA-N 277.412 2.464 10 10 CECE CC(=O)C(=O)COC(=O)[C@H](C)Oc1ccc(Cl)c(C)c1 808506280 GBVYNEVOCWCYBN-JTQLQIEISA-N 298.722 2.117 10 10 CECE CN(C[C@@H]1C[C@@H]2OCC[C@@H]2O1)c1ccc(CN)c(Cl)c1 2163190054 OPBVESXQEYRMCJ-QEJZJMRPSA-N 296.798 2.181 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@H](O)C1CCC1 2163229162 JMFRCWGXRNCQSV-SJORKVTESA-N 274.408 2.491 10 10 CECE C[C@@H](N)c1ccc(N2CC=C[C@@H](O)C2)cc1C(F)(F)F 2165069133 MVFBSETZSTZUBY-MWLCHTKSSA-N 286.297 2.462 10 10 CECE COC[C@@]12C[C@@H]1CN(c1ccc(CNC3CC3)cc1)C2 2165468308 QYFMVASUOTYFHE-PBHICJAKSA-N 272.392 2.411 10 10 CECE CN(c1cc2c(cc1F)[C@H](O)C(=O)N2)[C@@H]1CC[C@H]2C[C@@H]21 2165522123 PLAGYBAOLMOYCS-BNUHHUEWSA-N 276.311 2.046 10 10 CECE COc1cccc(CN2[C@H]3CC[C@@H]2CCN(C)C3)c1O 718893729 ZYBUNTRZNCZBDU-KGLIPLIRSA-N 276.380 2.069 10 10 CECE CC[C@@H](N)c1ccc(N(CC(N)=O)C2CCCC2)cc1 723174230 AAEWVHUNKJHAAQ-OAHLLOKOSA-N 275.396 2.331 10 10 CECE Cc1ccc2c(c1)N(C(=O)/C=C\c1cnccn1)CC2 746819265 RWFWVIBQPWBXGJ-PLNGDYQASA-N 265.316 2.388 10 10 CECE CCOc1ccc(O)c(CN[C@H]2CCC[C@@H](CO)C2)c1 840979498 SNBNACUPFKTNBY-OCCSQVGLSA-N 279.380 2.432 10 10 CECE CCN(CC)c1ccc([C@@H]2NCCC[C@H]2O)c(OC)c1 1952652061 CNLWLSKNWHXFGQ-ZBFHGGJFSA-N 278.396 2.327 10 10 CECE Cc1cc(CN2CCC[C@H]3NCC[C@H]32)ccc1N(C)C 923417066 UEDLJESNNGTWQC-NVXWUHKLSA-N 273.424 2.387 10 10 CECE C[C@H](N[C@H]1CNOC1)c1ccc(N2CCCCC2)cc1 925870480 UJXWELIXLLABSV-ZFWWWQNUSA-N 275.396 2.231 10 10 CECE C[C@@H]1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CCO1 928545347 DGLDOTCEKFKFLJ-SNVBAGLBSA-N 290.323 2.100 10 10 CECE CCOC1(C(=O)NCc2ccc(N(C)C)cc2)CCC1 854272097 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BVGLCUXFYUKKHY-LBPRGKRZSA-N 263.337 2.101 10 10 CECE CNCc1ccc(N2CCO[C@@H](CCF)C2)c(F)c1 700583175 ZZIDCGXEEWTVEW-LBPRGKRZSA-N 270.323 2.110 10 10 CECE C[C@@H]1CC(=O)CC[C@@H]1C(=O)NCc1ccccc1O 1137471638 UPHGVHARGGQFSR-MFKMUULPSA-N 261.321 2.014 10 10 CECE COc1ccc([C@H](C)N[C@@H](C)[C@H](C)CO)c(O)c1 168791287 YBPVMZYLSFTEEC-VWYCJHECSA-N 253.342 2.068 10 10 CECE CN(CC12CCCN(CCC1)C2)c1ccc(CN)cc1 705124915 JOLCBNPHAJVHII-UHFFFAOYSA-N 273.424 2.458 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)C[C@@H]2C)cc1C 706008995 TYQQHVRQBXQEAV-XJKSGUPXSA-N 262.397 2.454 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@H]3C)c(Cl)cc21 706732010 QZCOTMNGWSYDBH-JMCQJSRRSA-N 265.744 2.151 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@@H]2CNCC[C@@H]21 715019856 OCORZFRSJRFXBJ-UPJWGTAASA-N 276.380 2.233 10 10 CECE O=C(NCCC1=CCCCC1)c1cc(O)c(O)c(O)c1 1148589916 QKIDJXZFOBDXQA-UHFFFAOYSA-N 277.320 2.424 10 10 CECE COc1cccc(CNC2CCC3(CC2)OCCO3)c1O 715662914 VKAKWMLVBOQWIN-UHFFFAOYSA-N 293.363 2.176 10 10 CECE CCO[C@@H](C)c1noc(COc2ccc(N)cc2)n1 80741833 DMABLSMRGLROPL-VIFPVBQESA-N 263.297 2.328 10 10 CECE Nc1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1 698074252 JKFWICJKYZHLNO-RYUDHWBXSA-N 261.321 2.237 10 10 CECE OC[C@@H](NCc1c(O)cccc1F)[C@@H]1CC=CCC1 1885066536 BSFVZRSIBTWEOL-BXUZGUMPSA-N 265.328 2.338 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1C[C@H]2NCc1cc(F)ccc1O 2121707164 KLPYICBAJQLUBS-VDYMJLGFSA-N 265.328 2.170 10 10 CECE NCc1ccc(N2CC3(CCO3)C2)cc1C(F)(F)F 2115160491 CDNWJTJWRGQLJS-UHFFFAOYSA-N 272.270 2.143 10 10 CECE CN[C@@H](c1cc(C2CC2)n(C)n1)c1ccccc1O 2126746467 IADJNPFXOPXIHH-OAHLLOKOSA-N 257.337 2.312 10 10 CECE O=C1C[C@@H](CCNCc2c(O)cccc2Cl)CCN1 2125784725 JWGSCANUPCWLNI-JTQLQIEISA-N 282.771 2.052 10 10 CECE Cc1cccc(CN[C@H](C)Cc2ccnn2C)c1O 2117693422 OCAMSKNFYAAFKM-GFCCVEGCSA-N 259.353 2.155 10 10 CECE CO[C@H]1CC[C@H](CNC(=O)Nc2ccc(N)cc2)C1 2118257451 MJSBLFJLKZKWPD-GWCFXTLKSA-N 263.341 2.205 10 10 CECE COc1ccc(CNCc2ccc(O)c(O)c2O)cc1 226749373 WOVBPHDMJDYVBX-UHFFFAOYSA-N 275.304 2.102 10 10 CECE CN1CC[C@H](CN(C)c2cc(Cl)c(CN)cc2F)C1 2120880346 YBXRYFYWPNJFJE-JTQLQIEISA-N 285.794 2.326 10 10 CECE C[C@H](CN(C)C(=O)COc1ccc(N)cc1)C(F)F 2127520755 CAUYGTRBBFWDMW-SECBINFHSA-N 272.295 2.007 10 10 CECE N[C@H]1CCCc2cc(N3CCOC[C@H]3CF)ccc21 2128278097 VLVDDBQDPFSENQ-HIFRSBDPSA-N 264.344 2.197 10 10 CECE CN1CCCN(c2ccc3c(c2)CC[C@@H]3N)CCC1 2128324570 HEPJJZNZSXENMV-INIZCTEOSA-N 259.397 2.165 10 10 CECE CN(C[C@]12COC[C@H]1C2)c1ccc2c(c1)CC[C@@H]2O 2128321698 MHZOKMXIFHCGOC-UHOFOFEASA-N 259.349 2.139 10 10 CECE CCN(c1ccc2c(c1)CC[C@H]2N)[C@H]1CCN(C)C1 2128309169 PCZUBLKGRHEBHT-GOEBONIOSA-N 259.397 2.163 10 10 CECE CCN1[C@H](C)CN(c2ccc(CNC)cc2)C[C@H]1C 2130406744 DJKBMHOTIVBOGA-ZIAGYGMSSA-N 261.413 2.325 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@H]2C2CC2)c(F)c1 2130628823 UVOKYEGNVVMONO-ZWZTZDBGSA-N 264.344 2.195 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1 1912171378 JUQYDVUVNOQYAG-GFCCVEGCSA-N 259.313 2.400 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2O3)CC1 1912147436 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VXNMEVXLJHHZRB-SNVBAGLBSA-N 299.708 2.137 10 10 CECE CC[C@H](C)CN(CC)C[C@@H](O)COc1ccc(N)cc1 223287477 NHKXDDAHJRZSOG-DZGCQCFKSA-N 280.412 2.377 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@](F)(CO)C2)c(Cl)c1 1917127515 HTFXPZUYGLJVJR-NOZJJQNGSA-N 273.735 2.304 10 10 CECE CC(C)(C)OC(=O)Nc1ccc(O)c([C@H](N)CCO)c1 1535928851 UWCNTNWZGPFHFM-LLVKDONJSA-N 282.340 2.121 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@@]3(CO)C2)c(Cl)c1 2136089938 PLICRJSHCOQGMZ-WBIUFABUSA-N 280.799 2.439 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)CC3CC3)c(Cl)cc21 118587614 OYIAHRGYCVVRQB-CYBMUJFWSA-N 279.771 2.399 10 10 CECE CC(C)[C@H](CCO)NCc1ccc2c(c1)CCN2C 228689439 FGPNKELMIURGNV-HNNXBMFYSA-N 262.397 2.176 10 10 CECE COc1cc(Cl)cc(CNCc2cnn(C)c2)c1O 228672034 KOHNFQPDXMMWGD-UHFFFAOYSA-N 281.743 2.078 10 10 CECE C[C@]1(c2ccccc2)C[C@H]1NC(=O)Cc1ccc(O)c(O)c1 1630230110 IISQIGDKKXBPEX-SJLPKXTDSA-N 297.354 2.487 10 10 CECE COCc1noc(CN[C@H](C)c2ccc(C)cc2O)n1 1926270108 NYQYOAXCYNDMGO-SNVBAGLBSA-N 277.324 2.081 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1Cc2ccccc21 1644753573 FANDXCVALWVNQH-CQSZACIVSA-N 269.300 2.054 10 10 CECE Cc1cncc(CCC(=O)NCc2cc(O)ccc2O)c1 1644753771 JICOKECVFCIXGD-UHFFFAOYSA-N 286.331 2.050 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C(C)(C)CC(=O)O 1926939267 PLMRWWGZPQGOLR-SECBINFHSA-N 267.325 2.344 10 10 CECE CNCc1ccc(N2CCC[C@@](C)(O)CC2)c(F)c1 230360074 APIIHLPNIRNEIE-OAHLLOKOSA-N 266.360 2.286 10 10 CECE O=C(O)Cc1ccc(NCc2ccccc2O)nc1 2138579754 DHYNGKGASCXBBJ-UHFFFAOYSA-N 258.277 2.026 10 10 CECE CC1(C)OCCN(Cc2cc(N)ccc2O)C1(C)C 2138951338 UQALBHUGSIPQLO-UHFFFAOYSA-N 264.369 2.364 10 10 CECE COCCCOCCN(Cc1ccc(N)cc1)C1CC1 232221042 WFCZMUFOLXVXBC-UHFFFAOYSA-N 278.396 2.286 10 10 CECE O=C1c2ccccc2C(=O)C1(O)c1c[nH]c2ccccc12 5808070 RROGHTXKVLKJMG-UHFFFAOYSA-N 277.279 2.435 10 10 CECE biogenic CC[C@@](C)(O)CN1CCN(c2ccc(OC)c(F)c2)CC1 161504567 PSYROAOKSCZMEX-MRXNPFEDSA-N 296.386 2.117 10 10 CECE COc1cc(N(C)Cc2ccccn2)ccc1CN 2139682915 OBMKBXXDMMNWAL-UHFFFAOYSA-N 257.337 2.185 10 10 CECE 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CC(C)(C)OC(=O)N[C@@H]1C[C@H]1CNCc1ccc(N)cc1 1955969921 SYTZFUQEDJDFKK-GXTWGEPZSA-N 291.395 2.272 10 10 CECE CN1CCN(c2ccc(CNC(=O)/C=C\C3CC3)cc2)CC1 893608567 WTLKUGVRAPVDNP-TWGQIWQCSA-N 299.418 2.021 10 10 CECE Nc1ccc(CC(=O)c2ccnn2CC2CC2)cc1 687063058 RXKNZOWZIZUKAO-UHFFFAOYSA-N 255.321 2.301 10 10 CECE CN(C(=O)CN1CCC[C@@H]1C1CC1)c1ccc(N)cc1 706664576 ZZPWHEKGCVPIDS-OAHLLOKOSA-N 273.380 2.106 10 10 CECE CCN(Cc1cc(F)cc(F)c1O)C[C@H]1CCCNC1 708497204 PJGICFIZVCYDCZ-NSHDSACASA-N 284.350 2.492 10 10 CECE CN(CC1(C)CCC1)S(=O)(=O)Cc1ccc(N)cc1 720463012 MDKZCWNIGIDOJT-UHFFFAOYSA-N 282.409 2.221 10 10 CECE CO[C@H]1CC[C@@H](C)N(c2ccc(CN)c(F)c2F)C1 687204478 JUAVHHUIEVNTNV-KOLCDFICSA-N 270.323 2.427 10 10 CECE CCN(CC(=O)NCCC(C)C)c1ccc(N)cc1 63114627 GTCYUWHWMBCWDN-UHFFFAOYSA-N 263.385 2.257 10 10 CECE CN[C@@H]1CCN(C2CC2)[C@]1(C)c1ccc(N(C)C)cc1 711940577 MXXIWBQISQMPOY-IAGOWNOFSA-N 273.424 2.424 10 10 CECE NCc1ccc(N2CCO[C@H](C(F)F)CC2)cc1F 687564361 JNPAVAAKZOZAHE-LBPRGKRZSA-N 274.286 2.145 10 10 CECE COc1ccncc1CN[C@@H](C)c1cc(O)ccc1O 688982665 DMTSKVJCLKHUHZ-JTQLQIEISA-N 274.320 2.352 10 10 CECE CN(C[C@@]12COC[C@H]1C2)c1ccc(CN)c(Cl)c1 689298343 UTHYDMBVXBLJOB-RISCZKNCSA-N 266.772 2.271 10 10 CECE CCc1cccc(CNC[C@@H](CC)N(C)C)c1O 691450271 HBPRMGLGGBWUOS-CQSZACIVSA-N 250.386 2.384 10 10 CECE CCC(F)(F)CN(C)c1ccc2c(c1)NC(=O)[C@@H]2NC 692860733 FTRIFSKHYLDNJJ-GFCCVEGCSA-N 283.322 2.381 10 10 CECE CO[C@H](CNCc1cccc(O)c1O)C1CCCC1 692935623 QLQXXFBHPGLPER-CQSZACIVSA-N 265.353 2.393 10 10 CECE CC(C)[C@@H]1CNCCN1c1ccc2c(c1)OCCCO2 86176902 TXYKYZZZIBVFLP-AWEZNQCLSA-N 276.380 2.282 10 10 CECE CCN(CC)C1CN(Cc2cc(C(C)=O)ccc2O)C1 697778861 UEMDKVMCNWJJBJ-UHFFFAOYSA-N 276.380 2.121 10 10 CECE Cc1cc(N2CC3(CCO3)C2)ccc1CNC1CC1 2115166691 GIJGVEISAFARLY-UHFFFAOYSA-N 258.365 2.226 10 10 CECE CCNCc1cc(F)c(N2CCO[C@@H]3C[C@H]32)c(F)c1 2115162937 HZDKKEDUJYVWMT-CHWSQXEVSA-N 268.307 2.052 10 10 CECE CC1(C)CCC[C@@](O)(C(=O)NCc2cc(O)ccc2O)C1 1176755755 VFUDCBJTRKRZGP-INIZCTEOSA-N 293.363 2.045 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCOC[C@@H]1CCCCO1 2123006525 YEQOKMPVWBXIBT-STQMWFEESA-N 268.361 2.347 10 10 CECE CCN[C@H](C[C@@]1(C)COCCO1)c1ccccc1O 2117623990 OOZDIMROFCBTHW-HIFRSBDPSA-N 265.353 2.238 10 10 CECE Cc1ccc(O)c(CN2C[C@@H](CN)CC23CCC3)c1 2118005659 ZSSQJGHMJKZHDG-CYBMUJFWSA-N 260.381 2.404 10 10 CECE CO[C@H]1C=C[C@@](N)(c2ccc(N3CCCC3)cc2)C1 2119424077 MGIJOFOBPJBABI-HOTGVXAUSA-N 258.365 2.416 10 10 CECE Oc1cc(Cl)ccc1CNCc1csnn1 1183170109 IUICDXWXTGEMQV-UHFFFAOYSA-N 255.730 2.187 10 10 CECE CN[C@H](CC1COC1)c1ccc2c(c1)CCCN2C 2119984499 BDFOJJIHGUKJDN-OAHLLOKOSA-N 260.381 2.366 10 10 CECE CN(CC1(F)CCC1)c1ccc2c(c1)NC(=O)[C@H]2O 2121325496 NYPPWSNQKALAHK-LBPRGKRZSA-N 264.300 2.001 10 10 CECE CN1CC(CN(C)c2ccc3c(c2)CCC[C@@H]3N)C1 2128269560 TWEINXNIIMHRRG-INIZCTEOSA-N 259.397 2.021 10 10 CECE CN[C@@H]1CCc2cc(N3CC=C[C@H](OC)C3)ccc21 2128296115 FNDYXMROYYFOEX-GOEBONIOSA-N 258.365 2.285 10 10 CECE CN(Cc1cccnn1)c1ccc2c(c1)CC[C@H]2N 2128297377 WOBUDAISRLHVOX-OAHLLOKOSA-N 254.337 2.059 10 10 CECE C[C@H]1C[C@H](O)CCN1c1ccc2c(c1)CCC[C@H]2N 2128277212 LFNHUZDRGXSJOC-SGIREYDYSA-N 260.381 2.372 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H]4CCO[C@H]4C3)ccc21 2128277591 PWQUXKBOVTTWBP-KCXAZCMYSA-N 258.365 2.248 10 10 CECE C[C@@H]1C[C@@H](CN(C)c2ccc3c(c2)CC[C@H]3N)CO1 2128313815 YAHMQGLWSMDRBC-BFQNTYOBSA-N 260.381 2.494 10 10 CECE N[C@@H]1CCc2cc(N3CC(OCC(F)F)C3)ccc21 2128315467 SGUQUVGJUJQWCV-CYBMUJFWSA-N 268.307 2.103 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)[C@H]1COC2CC1C2 2128329766 YEALDRQLCHTKER-FQWOSJGLSA-N 258.365 2.246 10 10 CECE CC1(C)OCCO[C@@H]1COCCc1ccc(N)cc1 2130424899 GGBZMEUZRBBCJN-CQSZACIVSA-N 265.353 2.022 10 10 CECE C[C@@]1(CCO)CCN(c2ccc3c(c2)CC[C@H]3O)C1 2131900822 CHYGTTXIWOKLDW-CVEARBPZSA-N 261.365 2.265 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@H]2COCC2(F)F)c1 2131099576 DORMMGCLWVMINW-PELKAZGASA-N 273.279 2.086 10 10 CECE CCC(C)(C)CCNC(=O)c1cc(O)c(O)c(O)c1 2132349216 AJXVYTALOXTFIA-UHFFFAOYSA-N 267.325 2.360 10 10 CECE [N-]=[N+]=NC1CCN(CC(=O)Nc2cccnc2Cl)CC1 1912205956 QOLQGGAHWMVUTO-UHFFFAOYSA-N 294.746 2.448 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CCC[C@H]2CSC[C@@H]21 1912151864 MFUUSOYJFSICIQ-JBLDHEPKSA-N 284.385 2.263 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)c2cnc(Cl)cn2)CC1 1912172037 BNGKXHILFJXETC-UHFFFAOYSA-N 280.719 2.293 10 10 CECE CCOCCC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 1912159108 CUPFKCBCYOPAQJ-LLVKDONJSA-N 254.334 2.352 10 10 CECE Cc1nn(C)c2sc(C(=O)N3CC[C@@H](N=[N+]=[N-])C3)cc12 1912209135 YYKJLASIIAGXFX-MRVPVSSYSA-N 290.352 2.468 10 10 CECE O=C(NCCCCCF)[C@@H]1CNc2ccccc2N1 1913680101 FXPPBWJDAPCPQQ-ZDUSSCGKSA-N 265.332 2.149 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@@H](O)[C@H]1C 1914253747 GJDRCNXGZIMFLF-MLGOLLRUSA-N 260.381 2.207 10 10 CECE COc1cccc(CNC(=O)[C@@H](C)c2ccccn2)c1O 1294924366 BPNWCQNREIHMPO-NSHDSACASA-N 286.331 2.216 10 10 CECE CCC1(CC)CCN1c1ccc2c(c1)NC(=O)[C@H]2O 1914990133 MKHWONRYTZRVGI-ZDUSSCGKSA-N 260.337 2.441 10 10 CECE OCc1ccc(N2CC3(CCOC3)C2)c(Br)c1 1915330212 ZBRXENBYZAFSMW-UHFFFAOYSA-N 298.180 2.168 10 10 CECE COc1ccc(N2CCC([C@@H](C)N)CC2)c([N+](=O)[O-])c1 110651770 ZUBWPGAJYBKBKP-SNVBAGLBSA-N 279.340 2.167 10 10 CECE C/C(=C/c1cccnc1)C(=O)N1CCc2ccncc21 1466604969 AORSKPSCDIAFFD-XFXZXTDPSA-N 265.316 2.469 10 10 CECE CC1CCC(OCC(=O)NCc2cc(O)ccc2O)CC1 1471662129 PDHUJZQNYCAFIH-UHFFFAOYSA-N 293.363 2.309 10 10 CECE COc1cc(O)cc(NC(=O)c2cccc(O)c2O)c1 1556169227 KZRUFJYPWGLBHK-UHFFFAOYSA-N 275.260 2.064 10 10 CECE Cc1cnc2c(c1)N(C(=O)/C=C/c1cncc(O)c1)CC2 1558564560 ZFJUJVHAHFRDJI-NSCUHMNNSA-N 281.315 2.093 10 10 CECE Oc1cccc(Br)c1CN1CCCNCCC1 1947187009 ZSMZKSZYKYWHNJ-UHFFFAOYSA-N 299.212 2.340 10 10 CECE N[C@H]1CN(Cc2ccc(O)cc2O)C2(CCCCC2)C1 1925253054 RBVUWEJBOGTYRD-CYBMUJFWSA-N 276.380 2.334 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC12CCC(CC1)C2 1638446054 UUZSLWLLVFJPBT-UHFFFAOYSA-N 261.321 2.089 10 10 CECE Cn1cc(Cl)c(NC(=O)/C=C\c2ccc(O)c(O)c2)n1 1646102392 KPVZSLXIPZNPNN-HYXAFXHYSA-N 293.710 2.137 10 10 CECE C/C(=C/C(=O)NCc1ccc(O)cc1O)c1ccco1 1643104342 VAJTWSCJKFPRSG-YFHOEESVSA-N 273.288 2.411 10 10 CECE CO[C@H](C(=O)NCc1cc(O)ccc1O)C1CCCCC1 1651225708 VKRFMUPKJSOZLV-HNNXBMFYSA-N 293.363 2.309 10 10 CECE CO[C@@]1(C)CCCN(c2ccc([C@@H](C)N)c(O)c2)C1 230269650 YAQLFMSFLXPFMS-ABAIWWIYSA-N 264.369 2.417 10 10 CECE CCN(CC1CCC1)c1ccc2c(c1)NC(=O)[C@@H]2N 230319883 RIIVTQSOZFNWAN-CQSZACIVSA-N 259.353 2.265 10 10 CECE CC(C)(N=[N+]=[N-])[C@H]1c2ccccc2OCC2=CNNN21 19801326 XJTWQQAAMMGCJX-GFCCVEGCSA-N 272.312 2.375 10 10 CECE C[C@H](O)[C@H]1CCN(c2c(F)cc(CNC3CC3)cc2F)C1 167897503 QJESACFMEDEAJY-JQWIXIFHSA-N 296.361 2.424 10 10 CECE CN1CC[C@@H]2CCN(Cc3ccc(F)cc3O)C[C@H]21 2139787092 SQKYZVQBGNKKIU-BXUZGUMPSA-N 264.344 2.057 10 10 CECE Cc1cccc(CNCc2[nH]ccc2C(=O)O)c1O 2139759623 KGNYPPCMEYUCPK-UHFFFAOYSA-N 260.293 2.017 10 10 CECE Cc1ccc(CN2CCC(C3CNC3)CC2)c(O)c1 2139771758 FJIQRLHBWDUPLT-UHFFFAOYSA-N 260.381 2.132 10 10 CECE Cc1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c(O)c1 2139768072 WIDQSQYFINKNDD-XQQFMLRXSA-N 261.321 2.138 10 10 CECE Cc1cccc(Cn2cncc2CC(C)(C)N)c1O 2139745938 NJXAXEARAXNFJZ-UHFFFAOYSA-N 259.353 2.225 10 10 CECE COc1cc(CC(=O)C(=O)C(C)(C)C)cc(OC)c1 258638302 RVZVWQZZCOHQOL-UHFFFAOYSA-N 264.321 2.431 10 10 CECE CN(CC1(CO)CC1)c1ccc2c(c1)OCCCO2 258871557 HWVDKSZMRWQYBO-UHFFFAOYSA-N 263.337 2.057 10 10 CECE CC(C)CN1C(=O)CCc2cc(N3CCNCC3)ccc21 259420532 JPQBLDAELSZEJJ-UHFFFAOYSA-N 287.407 2.031 10 10 CECE CC1(S(=O)(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)CC1 1949754143 IADMITDYRCOHLC-SECBINFHSA-N 258.347 2.034 10 10 CECE CN(C)CC1CCN(c2ccc(CN)c(F)c2F)CC1 234229153 PQKDAOJXQHFMFV-UHFFFAOYSA-N 283.366 2.202 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H](C)[C@@H](N(C)C)C2)cc1 233886163 QVFIFUKRKHUSTP-MAZHCROVSA-N 261.413 2.483 10 10 CECE Oc1ccc(-c2nc(C3CCOCC3)no2)cc1O 236570737 VZBQJDNAKBRRGP-UHFFFAOYSA-N 262.265 2.042 10 10 CECE CCOCCOc1ccc(N2CCC[C@@H](N)C2)c(C)c1 128100983 BTVIFOQXAFXIHE-CQSZACIVSA-N 278.396 2.338 10 10 CECE Oc1cc(Cl)ccc1CNCC1[C@@H]2COC[C@@H]12 1942492578 AIFQAKGFTYKOQV-RYUDHWBXSA-N 253.729 2.028 10 10 CECE COC[C@@]1(F)CCN(Cc2cc(C)ccc2O)C1 1875797620 VIPQFJMQBDMUCC-CQSZACIVSA-N 253.317 2.261 10 10 CECE COC[C@H]1C[C@@H]1NCc1ccc(N2CCCC2)cc1 1875842610 BTLVPZHWYQULFK-ZBFHGGJFSA-N 260.381 2.411 10 10 CECE CCCN(c1ccc(OC)cc1N)C1CCNCC1 1876292772 JHPNKAPFALJNNP-UHFFFAOYSA-N 263.385 2.246 10 10 CECE CCN[C@@H](c1ccccc1O)[C@H](O)CCSC 1943690057 JHRZZQZNARFZOQ-OLZOCXBDSA-N 255.383 2.157 10 10 CECE CCOc1c(N)nsc1N(C)Cc1ccccc1O 1877523886 IHPWUPVPGNOKNI-UHFFFAOYSA-N 279.365 2.466 10 10 CECE CN(Cc1ccccc1O)C[C@H]1CCC2(CC2)[C@H]1O 1877524396 RHASUYHKSQGXDP-HIFRSBDPSA-N 261.365 2.375 10 10 CECE C[C@H](c1ccccc1O)N(C)c1ccncc1CO 1877539509 WDCXFIYAXZHTST-LLVKDONJSA-N 258.321 2.477 10 10 CECE CC(C)SC[C@@H](N)C(=O)N[C@H](C)c1ccccc1O 1877578642 ODKIRNIGRCLACL-ZYHUDNBSSA-N 282.409 2.038 10 10 CECE Oc1c(F)cccc1CN1[C@H]2CC[C@@H]1[C@H]1CC[C@H]2O1 1900464361 BLCYTDBYEKAHCF-XJFOESAGSA-N 263.312 2.426 10 10 CECE CN(CC12CC(C)(CO1)C2)c1ccc(CN)c(F)c1 1879886644 CVPQYZGDEITVFT-UHFFFAOYSA-N 264.344 2.290 10 10 CECE C[C@H](N)c1cc(F)c(N2CCO[C@@H](CF)C2)c(F)c1 1880924777 ULXPPMCONCIXTK-WPRPVWTQSA-N 274.286 2.159 10 10 CECE C[C@H](NCc1nncs1)c1cc(F)ccc1O 1945677661 LTUCEJCPJRSIEQ-ZETCQYMHSA-N 253.302 2.234 10 10 CECE Oc1cccc(Br)c1CNCc1ccnnc1 1946491892 JLABMTACZOOCAJ-UHFFFAOYSA-N 294.152 2.235 10 10 CECE Cc1cc(NS(=O)(=O)C[C@@H]2CCCCO2)cc(C)c1O 1963037655 WNFHSZCWKINJNM-ZDUSSCGKSA-N 299.392 2.320 10 10 CECE CN(C)CCOc1ccc(N(C)CCC(C)(C)O)cc1 2143457526 TZXYJTRNZHQBRG-UHFFFAOYSA-N 280.412 2.224 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccc(F)c(O)c1 1963732681 QSADGONLZAHYFP-UHFFFAOYSA-N 252.249 2.352 10 10 CECE Cc1cc(N(C)CC[C@H](C)O)ccc1CNC1CC1 135584403 MNBJRDUUKIVLTQ-ZDUSSCGKSA-N 262.397 2.454 10 10 CECE CN(C)[C@@H]1CCCC[C@@H]1NCc1ccc(F)cc1O 1964564881 YFWAAOJWKSSFRM-UONOGXRCSA-N 266.360 2.494 10 10 CECE CC(C)(C)[C@@](C)(O)CNCc1ccc(F)cc1O 1964608463 YSBLJAUGCSIJMC-AWEZNQCLSA-N 255.333 2.418 10 10 CECE Cc1ccc(S(=O)(=O)N2CCC(N=[N+]=[N-])CC2)cc1 138176739 BPTKXTOTJYUSFA-UHFFFAOYSA-N 280.353 2.458 10 10 CECE OCC1(NCc2ccc3c(c2)CCO3)CC2(CCC2)C1 1966091084 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2153069879 KIKHWKRSNUEMNZ-RWMBFGLXSA-N 277.364 2.308 10 10 CECE CN(C)C(=O)CN(C)c1ccc(CNC(C)(C)C)cc1F 62735689 FWSPJQVAOAGEEN-UHFFFAOYSA-N 295.402 2.238 10 10 CECE CCCNCc1cc(F)c(N(CC(N)=O)C(C)C)c(F)c1 62713221 SFTLVSUKEPDSOO-UHFFFAOYSA-N 299.365 2.165 10 10 CECE Nc1ccc(NC(=O)Cc2cn3ccsc3n2)cc1 237983744 CAMMYEHGENWTMW-UHFFFAOYSA-N 272.333 2.159 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CC[C@@H](C)[C@@H](O)C2)c(F)c1 2357399179 DNEIGQZFHBYFDU-BFVZDQMLSA-N 284.350 2.452 10 10 CECE CO[C@H](COc1ccc(N)cc1)C(=O)OC(C)(C)C 1951489648 WCVQLSXGFSLODN-GFCCVEGCSA-N 267.325 2.004 10 10 CECE Oc1ccc2ccccc2c1CNCCCn1ccnn1 126524081 WBVLVGPHSCZYPS-UHFFFAOYSA-N 282.347 2.317 10 10 CECE NC[C@@H](OCc1ccccc1)c1ccc(O)c(O)c1 38920271 LPPODSJDFTXGKL-OAHLLOKOSA-N 259.305 2.314 10 10 CECE COc1ccc(C(=O)N(C)Cc2ccccc2O)cc1N 40331944 BWXVAFAVXSUYFN-UHFFFAOYSA-N 286.331 2.255 10 10 CECE CCc1ccc(NC(=O)CN2C(=O)CSC2=S)cc1 82323304 KJBUNZDRZSXDDU-UHFFFAOYSA-N 294.401 2.048 10 10 CECE CCN[C@@](C)(CCN(C)c1ccc(OC)cc1)C(=O)OC 49972124 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CECE COC(=O)c1ccc(N[C@@H](C)c2ccccc2O)nn1 1187341408 XCFSWIFZQWCGRE-VIFPVBQESA-N 273.292 2.142 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H]1C(F)(F)F 2300526775 WWEBUGSTNJUDGC-NKWVEPMBSA-N 250.224 2.344 10 10 CECE C[C@H]1CCN(C(=O)C=Cc2ccc(O)c(O)c2)CCS1 2311894055 LBQNGPWFFHGODP-NSHDSACASA-N 293.388 2.465 10 10 CECE COc1ccc(N2CC[C@H](O)[C@@H](C)[C@H]2C)cc1F 2321300162 FCBZCFKMCRGDMD-CWSCBRNRSA-N 253.317 2.430 10 10 CECE CCn1cc(NC(=O)N[C@@H](C)c2ccccc2O)cn1 864422976 HQKZOIVCVNLDKM-JTQLQIEISA-N 274.324 2.491 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](CO)C[C@H]2C)cc1O 2330251023 YNXWFRMZVUYEJT-IJLUTSLNSA-N 264.369 2.009 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@@H]3CO[C@H]2C3)c(O)c1 2334548747 WRJWQCUBKVVGTB-MJVIGCOGSA-N 263.337 2.229 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1c1ccc(CNC)cc1F 2336767887 YQSQBPZRGYDTIZ-LSDHHAIUSA-N 266.360 2.285 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)CCn1nc(C)cc1C 2337775891 HJWHKJXDEVDRDM-UHFFFAOYSA-N 264.333 2.049 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@H]3C[C@@H](O)[C@H]2C3)c1C 2340847259 DKVOOWGRYIGTKK-CZPYZCIJSA-N 261.365 2.316 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2cnn(CC(F)F)c2)C1 2343188225 UICDCESSJWTCEB-SNVBAGLBSA-N 270.287 2.423 10 10 CECE Oc1c(Cl)cccc1CNC1Cc2nccnc2C1 2351580680 BHSOIHSREFFTOW-UHFFFAOYSA-N 275.739 2.093 10 10 CECE CO[C@H]1COCCN([C@H](C)c2cc(C)ccc2O)C1 2351625236 AGXVHHWJQSXFST-CHWSQXEVSA-N 265.353 2.109 10 10 CECE CSc1cc(N(C)[C@H](CCO)C(F)F)ccc1CN 2353857107 NSBXHQNHTDIXLL-LLVKDONJSA-N 290.379 2.320 10 10 CECE CSc1cc(N2C[C@H](O)C[C@H]2C(C)C)ccc1CN 2353857589 VVPVNWCLPJJMCN-KGLIPLIRSA-N 280.437 2.463 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(C)C[C@@H]3C[C@H]3C)ccc21 2354449661 WVSOLAJDMRPHCH-JRPNMDOOSA-N 273.380 2.382 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CC[C@@H]2[C@H](C1)C2(F)F 2354785371 QNMSJUBLVZDTIF-ZMJPVWNMSA-N 283.318 2.449 10 10 CECE Cc1cc(/C=C/C(=O)O)ccc1N1CCOC[C@H]1C 50546376 LYDFCSRMGGKNEG-FVOPLDGLSA-N 261.321 2.318 10 10 CECE CNCc1ccc(N2CCN(C)C[C@H]2C)cc1Cl 300544322 JOZMHHSXJFTMBG-LLVKDONJSA-N 267.804 2.200 10 10 CECE CC(C)[C@H](CNCc1ccc(N(C)C)cc1)N(C)C 20145401 KVAICGIDNRDCSQ-INIZCTEOSA-N 263.429 2.428 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H](C)COC)cc1O 250970545 DTUCLKSQBRGAMQ-MNOVXSKESA-N 252.358 2.144 10 10 CECE NC[C@H](N)c1ccc(C(F)(F)F)c(Cl)c1O 309562237 RFNPMFPHNIELKJ-LURJTMIESA-N 254.639 2.023 10 10 CECE CCCNCc1ccc(N2CCOC[C@H](O)C2)cc1Cl 399971307 YAOUZLKUXSMOCQ-CQSZACIVSA-N 298.814 2.037 10 10 CECE CC[C@]1(C(=O)O)CCCN1[C@H](C)c1c(O)cccc1O 300441656 MCFKGMMFBJAMIZ-MEBBXXQBSA-N 279.336 2.488 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](C)C[C@@H](O)C2)cc1O 401885758 FBSPSQMPUUTCMT-SGMGOOAPSA-N 278.396 2.270 10 10 CECE C[C@]1(CNCc2ccc(O)cc2O)CCCS1 126480667 DSHHOGCNDPFFLJ-CYBMUJFWSA-N 253.367 2.473 10 10 CECE COc1cccc(CN(C)[C@@H](C)c2cnn(C)c2)c1O 180978678 BYUUWXBVBVMRMA-NSHDSACASA-N 275.352 2.327 10 10 CECE COc1cc(N(C)Cc2c[nH]nc2C)cc(OC)c1OC 180756870 DMZQLHOLLFPQAN-UHFFFAOYSA-N 291.351 2.380 10 10 CECE Nc1ccc(OS(=O)(=O)c2cccs2)cc1 74405037 DLBZWXYZFFSPPX-UHFFFAOYSA-N 255.320 2.098 10 10 CECE O=C1N=C(N2CCCCC2)S/C1=C/c1cocn1 188043502 JLMKSEUPMDXCTG-UXBLZVDNSA-N 263.322 2.131 10 10 CECE Oc1ccc(CNc2ccc(-n3cccn3)nc2)c(O)c1 37019713 XSLGOVBIKGRLMS-UHFFFAOYSA-N 282.303 2.291 10 10 CECE CNC[C@@H]1CN([C@H]2C[C@@H](C)c3c(C)ccc(O)c32)CCO1 125168382 GTQWBYSQOZYMJV-MCIONIFRSA-N 290.407 2.169 10 10 CECE CCSC[C@H](C)NC(=O)Cc1ccc(N)cc1 157031157 RFAOKLITGCNCRE-JTQLQIEISA-N 252.383 2.069 10 10 CECE Cc1nn(C)c(C)c1NC(=O)CCOc1ccc(N)cc1 40313354 JBUDIAWEDREDFZ-UHFFFAOYSA-N 288.351 2.027 10 10 CECE C[C@@H]1CC[C@@H](NC(=O)c2ccn(-c3ccc(N)cc3)n2)C1 130357481 HEDSTBQPEFUHRJ-DGCLKSJQSA-N 284.363 2.373 10 10 CECE COc1ccc(CN[C@@](C)(CO)c2ccccc2)c(O)c1 227212627 REXNPJZYKDABKR-KRWDZBQOSA-N 287.359 2.398 10 10 CECE CC(C)(C)[C@H]1CCCC[C@]1(NCCN=[N+]=[N-])C(N)=O 90258172 YBRFDAPXZCLNOH-ZWNOBZJWSA-N 267.377 2.347 10 10 CECE Cc1cc(Br)cc([C@@H]2CCC(=O)N2)c1O 238531576 NWIUAKIGTQUUKD-VIFPVBQESA-N 270.126 2.414 10 10 CECE CSC[C@@](C)(O)CN[C@@H](C)c1ccc(C)cc1O 230662912 JRBOURUNEAFSNN-FZMZJTMJSA-N 269.410 2.465 10 10 CECE CN(Cc1ccccc1)C(=O)Cc1ccc(O)c(O)c1 243817627 QTJGMTCKMLOMNJ-UHFFFAOYSA-N 271.316 2.299 10 10 CECE Cc1cc(O)c(O)c(Br)c1-c1cc(N)on1 258612623 RSDRBLAUIOHZMZ-UHFFFAOYSA-N 285.097 2.406 10 10 CECE C[C@H]1[C@H](C)[C@H](N)CCN1c1ccc2c(c1)OCCO2 252592156 DYTBHQIFIUVUCX-GMXVVIOVSA-N 262.353 2.020 10 10 CECE C[C@@H]1C[C@H]1N1C[C@H](NCc2cccc(Cl)c2O)CC1=O 378455491 REFQNOTYXDPTPT-IRUJWGPZSA-N 294.782 2.145 10 10 CECE COc1cccc(CNC(=O)C2(CCF)CC2)c1O 290063005 IMIPSQCUQLSYLP-UHFFFAOYSA-N 267.300 2.157 10 10 CECE COc1ccc(N2CCC[C@@H]3CC[C@@H](O)C[C@H]32)c(N)c1 2167004151 GIUAHLDWWSPGHA-XHBSWPGZSA-N 276.380 2.407 10 10 CECE CNC(=O)[C@H](C)CN(C)c1ccc([C@@H](C)NC)c(Cl)c1 723149136 BTBMXGHCLNVOGT-GHMZBOCLSA-N 297.830 2.439 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](OC)[C@@H]1CCOC1 2163071670 QIJZVTRMPMSAOR-FVQBIDKESA-N 278.396 2.065 10 10 CECE CCN1CCc2cc([C@@H](O)CC[C@@H]3CCNC3)ccc21 2163072621 BRNMFTRDUJICRG-DYVFJYSZSA-N 274.408 2.492 10 10 CECE CN[C@@H](c1ccc(N2CCCC2)cc1)c1ccnnc1 2163100106 NXICEPDBRKWQLR-INIZCTEOSA-N 268.364 2.386 10 10 CECE CCCN(C[C@@H]1C[C@@H]2OCC[C@H]2O1)c1ccc(N)cc1 2163231570 XBZVKQFWKNKOMT-XHSDSOJGSA-N 276.380 2.432 10 10 CECE CCN(CCCCC(=O)O)Cc1ccc(O)c(O)c1 725073651 LIGLWXMCKHBAEG-UHFFFAOYSA-N 267.325 2.175 10 10 CECE Oc1ccc(F)cc1CN1CCCC[C@H]1[C@@H]1CCNC1 841088525 YWKVVVPXWFGMFB-DOMZBBRYSA-N 278.371 2.495 10 10 CECE Cc1cccc(CN2CC[C@@H]3CNC[C@@H]3CC2)c1O 843126049 FLONWDCFBNXZEB-OKILXGFUSA-N 260.381 2.132 10 10 CECE COC(=O)[C@](NCCCN=[N+]=[N-])(C(F)F)C1CCC1 1893090503 FFBUEZOYWXTZSM-LLVKDONJSA-N 276.287 2.253 10 10 CECE Cc1ccc(C(=O)NCc2cc(C3CC3)no2)c(O)c1O 923884679 RMZCMYSAAAWBOU-UHFFFAOYSA-N 288.303 2.202 10 10 CECE CC(C)(F)CCNC(=O)CCOc1ccc(N)cc1 698227312 NYAITXWMXYDCFC-UHFFFAOYSA-N 268.332 2.292 10 10 CECE C[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@](C)(C(F)F)O1 852928367 XJWRAUGPLJEEPV-BONVTDFDSA-N 298.333 2.082 10 10 CECE CCC(F)(F)CCNC(=O)c1cccc(O)c1O 697998421 BCMVTGNGNBJNDH-UHFFFAOYSA-N 259.252 2.263 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@@]23CCCOC3)cc1 1896325718 RDGDUKDVOPXWIG-HZPDHXFCSA-N 260.381 2.411 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)[C@@H]1CO[C@@H](C)C1 131467251 UWYVBHQKTXYBME-JSGCOSHPSA-N 276.380 2.431 10 10 CECE COc1ccc(N(C)Cc2nnnn2C(C)(C)C)cc1F 766797516 RPEKMKURFAOJRZ-UHFFFAOYSA-N 293.346 2.212 10 10 CECE O=C(NCCCSc1nccs1)[C@@H]1[C@@H]2CCCO[C@@H]21 780512253 VNQOCONVUFWXPC-AXFHLTTASA-N 298.433 2.167 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1Cc2cccnc2C1 1123665119 GFKWGTTZIWACHE-CQSZACIVSA-N 282.343 2.161 10 10 CECE N#Cc1ccccc1[C@H]1NCCc2ccc(O)c(O)c21 83621102 YUSLCOMUOVMBGU-OAHLLOKOSA-N 266.300 2.205 10 10 CECE Oc1ccccc1[C@@H]1NCCc2c(O)ccc(O)c21 83657744 OFYXJOHTSNCQEM-HNNXBMFYSA-N 257.289 2.039 10 10 CECE CCCOc1ccc(N2CC[C@H](CNCCCO)C2)cc1 76371013 AXABGJSWBMNWSC-OAHLLOKOSA-N 292.423 2.274 10 10 CECE Cc1cc(N2CC([C@@H](C)O)C2)ccc1CNC1CC1 719844348 BLYKBHIQTSKSRX-GFCCVEGCSA-N 260.381 2.064 10 10 CECE CC(C)(CNCc1cc(F)cc(F)c1O)n1ccnc1 708555492 NUUIXVYZQIGYAJ-UHFFFAOYSA-N 281.306 2.392 10 10 CECE C[C@H]1CN(C)C[C@H]1NCc1ccc2c(c1)CCCN2C 722293779 PTSAYXCNCRHSOO-XJKSGUPXSA-N 273.424 2.109 10 10 CECE Cc1ccc(O)c(CN2C[C@H](C(=O)O)C(C)(C)C2)c1 709914191 AUXLYIRGGULDQA-GFCCVEGCSA-N 263.337 2.243 10 10 CECE OCc1ccc(N2CC(CF)C2)cc1Br 1958340415 MAKBEJBOEIYUCX-UHFFFAOYSA-N 274.133 2.347 10 10 CECE CC(C)CNCc1ccc(N2CCC[C@@H]2CO)cc1 62736791 BNVNKZQKYVGVOV-MRXNPFEDSA-N 262.397 2.393 10 10 CECE CCC[C@]1(C(=O)N(C)Cc2ccccc2O)CCNC1 62896295 DAJGUXZIVAGXTM-INIZCTEOSA-N 276.380 2.130 10 10 CECE CC[C@H]1COC[C@H]1N(C)c1ccc(CN)c(F)c1 711158869 RUPZWYITKHEVLW-IINYFYTJSA-N 252.333 2.146 10 10 CECE Nc1ccc(CC(=O)NC2(CCO)CCCCC2)cc1 687280530 FOQMXGODHXVDQS-UHFFFAOYSA-N 276.380 2.013 10 10 CECE C[C@H](NCCc1cc[nH]n1)c1ccc(N(C)C)cc1 714512250 MSDDRSNROVVLIS-LBPRGKRZSA-N 258.369 2.369 10 10 CECE CCOc1cccc(CNC[C@H](C)C[C@H](C)O)c1O 77429288 WQHPIKGXCGBCOM-NEPJUHHUSA-N 267.369 2.288 10 10 CECE C[C@H](N)c1ccc(N2[C@@H]3CC[C@@H]2[C@H](C)[C@@H](O)C3)cc1 686186719 SLPCMVHGAMZLMM-AKSBMLQJSA-N 260.381 2.444 10 10 CECE OCc1ccc(N2CC[C@H]3COC[C@H]3C2)cc1Cl 690390017 YBNBKLWDZMTYRR-NWDGAFQWSA-N 267.756 2.305 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CCCSC1 689554414 VQBGTQHTHZNDSX-JTQLQIEISA-N 267.350 2.065 10 10 CECE CCN(Cc1cnn(C)c1C)c1ccc(CN)cc1 689540065 QJRGNJAKSVUVOS-UHFFFAOYSA-N 258.369 2.214 10 10 CECE Oc1ccc(CNC[C@@]23CCCC[C@H]2C3)c(O)c1O 693600075 OHWQAPZLXOFZSQ-NHYWBVRUSA-N 263.337 2.473 10 10 CECE CCOC[C@H]1CCCN1c1c(F)cc(CN)cc1F 696529982 IIMSLNMOZDLPBV-LLVKDONJSA-N 270.323 2.429 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)O[C@H](C)C2)cc1O 93669884 AJHWDQKTMRHFEJ-GRYCIOLGSA-N 264.369 2.286 10 10 CECE CC[C@@]1(C)CN(Cc2ccc(OC)cc2O)CCO1 191149078 UCLUOVJQGXZRIZ-HNNXBMFYSA-N 265.353 2.402 10 10 CECE CN(C[C@@H]1C[C@@H]2C[C@H]2CO1)c1ccc(CO)cc1F 2122836209 YRFXQNYXNXABPJ-AVGNSLFASA-N 265.328 2.179 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)[C@H]1CC=CCC1 2118511187 ZDKRIZOYEQQFKK-IINYFYTJSA-N 257.337 2.183 10 10 CECE CCN1CCc2cc(N(C)CCC3CNC3)ccc21 2120425899 XYQJRAUCTPTMRM-UHFFFAOYSA-N 259.397 2.115 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H](CCO)C(F)F)c(F)c1 2121997492 LISARYBMSQRMQL-PELKAZGASA-N 276.302 2.298 10 10 CECE C[C@@H]1O[C@@]2(CNCc3cccc(O)c3O)CC[C@H]1C2 1900993434 HDVACSWVSMGLPM-PGUXBMHVSA-N 263.337 2.145 10 10 CECE CC1(O)CC2(CN(c3ccc4c(c3)CC[C@@H]4O)C2)C1 2128319767 WSVIJXTVTPZEJX-AWEZNQCLSA-N 259.349 2.017 10 10 CECE C[C@H]1OCC[C@@H]1CN(C)c1ccc2c(c1)CC[C@@H]2N 2128324948 MICNKALWTHAOLI-KFNAQCHYSA-N 260.381 2.494 10 10 CECE Nc1ccc(CNC[C@H]2C[C@H](n3ccnc3)C2)cc1 2128443913 HBRJSDMGUPMNRT-CTYIDZIISA-N 256.353 2.206 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@H]2C(C)(C)C)cc1 2128675028 YMIGSLLTRIIFRI-GJZGRUSLSA-N 262.397 2.392 10 10 CECE CO[C@@H]1CC[C@H](N(C)c2c(F)cc(CN)cc2F)C1 2130714469 XFGREJAFCMPKDJ-WDEREUQCSA-N 270.323 2.427 10 10 CECE C[C@@H](N)c1ccc(N(C)CCC(=O)N(C)C)c(Cl)c1 2131958403 PQDSUYFNPHBVLT-SNVBAGLBSA-N 283.803 2.274 10 10 CECE CC(C)[C@H]1CCCN1C(=O)c1cc(O)c(O)c(O)c1 2132347992 BEQMNLWQGBAGKX-SNVBAGLBSA-N 265.309 2.064 10 10 CECE [N-]=[N+]=NC1CN(CC(=O)Nc2ccc3c(c2)CCC3)C1 1912152726 ANCFMFZGOIHRKF-UHFFFAOYSA-N 271.324 2.108 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])C[C@@H]2CCC[C@@H]21 1912159137 DHJNPBDAFCDERW-GVXVVHGQSA-N 266.345 2.398 10 10 CECE CC1([C@@H]2CCCN(CCCN=[N+]=[N-])C2)OCCO1 1912151495 IGGGAZOFJMJQQQ-LLVKDONJSA-N 254.334 2.162 10 10 CECE Cc1ccc(CNCCCCN)c(O)c1Br 1905142470 KVDNVUCCVYDQMB-UHFFFAOYSA-N 287.201 2.292 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)Cc2ccc(F)c(F)c2)C1 1912151497 IGLWEHUVSDNDLE-SECBINFHSA-N 266.251 2.419 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CCS[C@H]2CCOC2)C1 1912143880 LPSNFBHCNQWTDP-MNOVXSKESA-N 256.375 2.283 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2ccsn2)C1 1912180355 ZPIZNIFNZWTOTL-MRVPVSSYSA-N 251.315 2.306 10 10 CECE CN(CCN=[N+]=[N-])Cc1cc(F)cc([N+](=O)[O-])c1 1912189689 WAJKWCWKZPJFOW-UHFFFAOYSA-N 253.237 2.476 10 10 CECE COCC1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)CCCC1 1912173814 QYNDJPWMGPPJMV-NSHDSACASA-N 266.345 2.352 10 10 CECE C[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1442608270 KRHCYVJCQICSNX-LLVKDONJSA-N 263.337 2.289 10 10 CECE CC[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)CCO1 1913668483 JCHDXGDAFJJJMR-GFCCVEGCSA-N 279.336 2.122 10 10 CECE CCOc1cccc(CNCC(C)(C)[C@@H](C)O)c1O 1913837484 GTZKGPDOZOMIQK-LLVKDONJSA-N 267.369 2.288 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)[C@H]2C)c(Cl)c1 1914254087 ICNIGFMTXYYYSW-QMTHXVAHSA-N 268.788 2.409 10 10 CECE CNCc1ccc(N(C)C2CC(O)C2)cc1Cl 1914596871 UUKCJEMWFVRHHL-UHFFFAOYSA-N 254.761 2.019 10 10 CECE Cc1ncccc1CNC(=O)NCc1ccccc1O 1479075132 OETSYJBGKKESIJ-UHFFFAOYSA-N 271.320 2.095 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](N3CCCC3)C2)cc1O 225209492 RHBGJLSZZDPKFN-GXTWGEPZSA-N 275.396 2.086 10 10 CECE C[C@]1(CNCc2cc(F)cc(F)c2O)CSCCO1 2136548186 QXZJBPQNDOUOIB-ZDUSSCGKSA-N 289.347 2.282 10 10 CECE O=C1C[C@H](C(=O)NCc2c(O)cccc2O)c2ccccc21 1639292549 HIYJHQOYNIIGGT-LBPRGKRZSA-N 297.310 2.084 10 10 CECE CCCN(C(=O)[C@@H](CC)OC)c1ccc(N)cc1 1924096962 HGVZBDNGDHDZLE-CYBMUJFWSA-N 250.342 2.437 10 10 CECE C[C@@H](NC(=O)CCCCCO)c1ccc(N(C)C)cc1 1567777191 NMCFHHYNZXAFBE-CYBMUJFWSA-N 278.396 2.483 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](N)CC(C)(F)F 1924411055 LYBNVLDKKQIICG-GXSJLCMTSA-N 286.322 2.284 10 10 CECE Oc1ccccc1CN(CC1=NOCC1)C[C@H]1CCCO1 1642199287 AOZFIQKENQJUMR-OAHLLOKOSA-N 290.363 2.150 10 10 CECE Cc1cc(C)nc(C(=O)NCc2cc(O)ccc2O)c1 1644753789 JVWWDBXIHPUONM-UHFFFAOYSA-N 272.304 2.040 10 10 CECE CCN(CC)[C@@H](C)CNCc1ccc2c(c1)CCO2 121872195 FJZZCSKLAQDBLD-ZDUSSCGKSA-N 262.397 2.441 10 10 CECE Nc1ccc(OCc2nc3cc(O)ccc3[nH]2)cc1 161153751 JNMPVKMRMXPCEP-UHFFFAOYSA-N 255.277 2.430 10 10 CECE c1csc(SCCCNC[C@H]2CCOC2)n1 166010081 WYGJZFHWQFGALB-SNVBAGLBSA-N 258.412 2.251 10 10 CECE CNCc1ccc(N(C)[C@H]2CCCOC2)cc1OC 2139690802 QOMKSFLAMFERTL-AWEZNQCLSA-N 264.369 2.030 10 10 CECE CN(C)c1ccc(CNc2cccn(C)c2=O)cc1 902212798 KRAOSTIKZUHURE-UHFFFAOYSA-N 257.337 2.063 10 10 CECE C[C@@H]1CC[C@H](CN)N(Cc2ccc(N(C)C)cc2)C1 1205804229 MLPARYUATOGBLQ-CZUORRHYSA-N 261.413 2.312 10 10 CECE CNCc1ccc(N2CCO[C@@H](C)C2)cc1Cl 234453238 FWBPWFAWDWAUHY-JTQLQIEISA-N 254.761 2.285 10 10 CECE C[C@H](O)c1ccccc1NC(=O)c1cccc(O)c1O 126616182 VEZMYZQKXZXORZ-VIFPVBQESA-N 273.288 2.403 10 10 CECE CO[C@@H](C(=O)N[C@@H](C)c1ccccc1O)C1CCC1 827959614 CQQQQNCJQIHPKH-IINYFYTJSA-N 263.337 2.385 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@@H](N(C)C)C1 235193116 HRQKFRLKBBYTGN-VXGBXAGGSA-N 264.369 2.185 10 10 CECE CCN(C)C(=O)OCCN[C@H](C)c1cc(C)ccc1O 1876008395 PSFAMULTTYWGNC-GFCCVEGCSA-N 280.368 2.440 10 10 CECE CCc1nn(C)cc1C(=O)c1cccc2c1NCC2 1877175745 FHUOMZPJMPYEEJ-UHFFFAOYSA-N 255.321 2.182 10 10 CECE CN1CC[C@](C)(CN[C@H]2CCc3cccc(O)c32)C1 1879326276 FAOGWTYWDAKOFG-XJKSGUPXSA-N 260.381 2.311 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@H]([C@@H](C)O)C2)c(F)c1 1880488150 ULMPJJPOYBEMQI-BBBLOLIVSA-N 271.307 2.225 10 10 CECE CC(C)[C@@H](O)CN(C)c1c(F)cc([C@H](C)O)cc1F 1880488284 JOOLXMUSIGTEDS-ZANVPECISA-N 273.323 2.471 10 10 CECE Cc1ccc(CN2CC[C@@](CO)(C(F)(F)F)C2)c(O)c1 895836666 DKQWFDQBNASLOK-CYBMUJFWSA-N 289.297 2.447 10 10 CECE C[C@@H](O)c1ccc(N2CCCC[C@@H]2C(=O)N(C)C)cc1 2143664625 OYQWYXONNJBRIY-IUODEOHRSA-N 276.380 2.187 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C[C@@H]2COCCO2)cc1 2143686033 JCHQHYDMEKGPTA-XJKSGUPXSA-N 278.396 2.209 10 10 CECE CNCc1ccc(N(C)C[C@@H]2OCCO[C@@H]2C)c(Cl)c1 2143695019 OLTYJMFXVDJNRF-ABAIWWIYSA-N 298.814 2.300 10 10 CECE CNCc1ccc(N2CC[C@H](O)C(F)(F)CC2)cc1C 2150043690 VWUWRDYUSSMRQM-AWEZNQCLSA-N 284.350 2.311 10 10 CECE CN[C@H](C)c1ccc(N(CCOC)[C@@H](C)COC)cc1 42608082 HOZCQEPNEUORNZ-UONOGXRCSA-N 280.412 2.455 10 10 CECE C[C@H]1CN2CCCC[C@H]2CN1c1ccc(CN)cc1F 251893398 VTTGFFMNVTVJBT-JSGCOSHPSA-N 277.387 2.347 10 10 CECE CO[C@H]1CCC[C@H](C(=O)NCCc2ccc(N)cc2)C1 1969320886 QFCLVBQWTFBJRN-ZFWWWQNUSA-N 276.380 2.133 10 10 CECE CCCN[C@H](c1ccccc1O)[C@](C)(O)[C@@H]1CCOC1 2148149731 YIKCBYVTYIDJHT-DAXOMENPSA-N 279.380 2.220 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)c1nccn1C(C)C 2148165565 SVIYOXJGZWVECG-KGLIPLIRSA-N 275.352 2.164 10 10 CECE CC1(F)CCN(c2ccc(CO)cc2[N+](=O)[O-])CC1 1970761408 FDXKAMXTZKJQEN-UHFFFAOYSA-N 268.288 2.416 10 10 CECE C[C@H](NCc1cc2c(cc1O)OCO2)[C@H]1CC1(F)F 1972720720 RYEAYECHYCCELA-IONNQARKSA-N 271.263 2.254 10 10 CECE O=C(O)c1cc(-c2ccc(C(F)(F)F)c(O)c2O)on1 258480144 IMNFOLTZWYTBSM-UHFFFAOYSA-N 289.165 2.470 10 10 CECE C[C@@H](N)c1ccc(N2CCOC[C@H]2C(F)(F)F)cc1O 2150377492 UQMADCJCURMOFE-PELKAZGASA-N 290.285 2.179 10 10 CECE CCOC(=O)CC[C@H](N)c1c(O)cccc1SC 260044440 DALFCTSOUXAQPQ-VIFPVBQESA-N 269.366 2.457 10 10 CECE CO[C@H]1CN(c2ccc(CN)cc2C(F)(F)F)C[C@@H]1F 2146485627 XDPOAEILQOXKTD-JQWIXIFHSA-N 292.276 2.337 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](OC(=O)N(C)C)C2)cc1 2146486401 DTSVADMWLKHBCC-RISCZKNCSA-N 278.352 2.017 10 10 CECE CC(C)NCc1cc(F)c(N2CC[C@H](CO)C2)c(F)c1 167874711 KCOLCTCDKGAGDO-NSHDSACASA-N 284.350 2.281 10 10 CECE CCNCc1ccc(N2CC[C@](O)(COC)C2)cc1Cl 2151894253 HCCOUZBGTIDJLV-OAHLLOKOSA-N 298.814 2.037 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@@H](C3CC3)C2)cc1O 2152881128 MNTYZKFJIOIYGY-AAEUAGOBSA-N 276.380 2.275 10 10 CECE C[C@H](C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C(F)(F)F 2009555076 NMCBZJKBIFCRQX-RNFRBKRXSA-N 250.224 2.486 10 10 CECE CCn1nncc1CN(C)c1ccc([C@H](C)O)cc1F 2156484668 XPUDHGHWMLJJOG-JTQLQIEISA-N 278.331 2.127 10 10 CECE NCc1ccc(N2CC[C@H]3COCC[C@@H]32)cc1Cl 2028371353 ZLEHDAWYAFMGGE-FZMZJTMJSA-N 266.772 2.414 10 10 CECE Oc1ccc(CNC[C@H]2CCCOCC2)c(O)c1 2028633850 MCHKYKWPMIUIRZ-NSHDSACASA-N 251.326 2.004 10 10 CECE CNCc1ccc(N2C[C@H](F)[C@@H](OC)C2)cc1Cl 2029810009 ACVIAKKQFBADRB-STQMWFEESA-N 272.751 2.233 10 10 CECE Cc1ncoc1CNCc1cc(F)cc(F)c1O 2029906674 OOBCBCBRZAKXEW-UHFFFAOYSA-N 254.236 2.257 10 10 CECE CN(CCCc1ccc(N)cc1)C(C)(C)CCO 2030146414 DZUBWMGFEQDTEG-UHFFFAOYSA-N 250.386 2.294 10 10 CECE C[C@H]1CN(c2ccc(CN)cc2F)[C@@H](C)CCO1 2031632783 IWBFYOZVEBBCHE-QWRGUYRKSA-N 252.333 2.288 10 10 CECE C[C@H]1C[C@@H](O)[C@H](C)CN1c1ccc(CO)c(Cl)c1 2032206367 ZPGKUBBUKFCPOW-ISTVAULSSA-N 269.772 2.428 10 10 CECE CCC(C)(C)OCCNCc1cccc(O)c1O 308548319 ROYLJUCCJKFPRR-UHFFFAOYSA-N 253.342 2.393 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C2(C)C)cc1C 311901068 CKHABEJENDMXJJ-HNNXBMFYSA-N 262.397 2.454 10 10 CECE COc1cccc(CN(C)C2(C(=O)O)CCCC2)c1O 312509949 JANUAELNMOPQRL-UHFFFAOYSA-N 279.336 2.230 10 10 CECE CN(C)c1ccc(CN[C@H]2CCCC(F)(F)[C@H]2O)cc1 2160466980 BRJWNVROTXXXIO-KBPBESRZSA-N 284.350 2.391 10 10 CECE CCN(CC)C(=O)CN(C)[C@@H]1CCc2cccc(O)c21 313216568 QFOOFBIUUGGZSR-CYBMUJFWSA-N 276.380 2.180 10 10 CECE COc1cccc(O)c1CNCC(C)(C)n1ccnc1 2160701050 LYDIVERBBKTLLT-UHFFFAOYSA-N 275.352 2.122 10 10 CECE C[C@H]1C[C@@H](CN(C)CCOc2ccc(N)cc2)CCO1 2161682684 ITFCAAZIDNFXHH-KBPBESRZSA-N 278.396 2.395 10 10 CECE CCN[C@H](c1ccccc1O)c1cnc2cccnn12 2172272090 VWCUWPXOGJLIML-OAHLLOKOSA-N 268.320 2.134 10 10 CECE C[C@@H]1O[C@H](C)[C@H](CNCc2ccc(O)cc2O)[C@@H]1C 701017209 NHHZZUKWCVAXBZ-FBKDDSFISA-N 265.353 2.247 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@]23COC[C@H]2C3)c(F)c1 701814226 NYWWRSLNLFYDPQ-IXPVHAAZSA-N 265.328 2.352 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@H]4CC[C@@H](C4)C3)ccc21 703816025 DHPIXIXLMIPFFP-PGUXBMHVSA-N 271.364 2.136 10 10 CECE N[C@@H]1COC2(CCN(c3ccc4c(c3)CCC4)CC2)C1 2162643865 PWOVCKSXWWGFEL-HNNXBMFYSA-N 272.392 2.262 10 10 CECE COc1ccc(CN[C@H]2C[C@H]3C[C@H]2C[C@@]3(C)O)c(O)c1 2178196634 ILKYWIDXPLCVFK-CQJJVWNLSA-N 277.364 2.040 10 10 CECE N=c1[nH]cc([C@H](O)c2ccc(N3CCCCC3)cc2)o1 2172870553 BYSJEFYXHUHJMU-CQSZACIVSA-N 273.336 2.159 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC[C@@H]3C3CC3)ccc21 706617624 KJNXXBGFUSSRRJ-ZIAGYGMSSA-N 257.337 2.017 10 10 CECE CC1(C)CCN1c1cc2c(cc1Cl)[C@H](N)C(=O)N2 706780124 MXQRBZDPGYWQHR-NSHDSACASA-N 265.744 2.281 10 10 CECE C[C@@H]1CC[C@@H](N)CN1Cc1c(O)cccc1Br 706875310 URKSOKBZIFVRRI-NXEZZACHSA-N 299.212 2.466 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CC34CCNCC4)ccc21 2163070268 GZINHBMMDHGPKP-HOCLYGCPSA-N 272.392 2.102 10 10 CECE CCC1([C@@H](O)c2ccc3c(c2)CCN3C)CCNCC1 2163071720 QTQGPWDBZIYROL-INIZCTEOSA-N 274.408 2.492 10 10 CECE CCN1CCc2cc([C@@]3(N)CCN(C)[C@H](C)C3)ccc21 2163063080 OZYYFZWGLSTESW-CXAGYDPISA-N 273.424 2.337 10 10 CECE N[C@@H]1CCCCCN(Cc2cc(F)cc(F)c2O)C1 708503028 MTHTYDVFLFLZKN-GFCCVEGCSA-N 270.323 2.374 10 10 CECE CCNCc1cc(F)c(N(C[C@H](C)O)C2CC2)c(F)c1 691419478 FKJOFPKLQKCXLU-JTQLQIEISA-N 284.350 2.424 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H]3CN(C)CC[C@H]3C2)cc1 380406441 CTVNPAXABGPUJD-YQQAZPJKSA-N 273.424 2.484 10 10 CECE CCN1CC[C@H]1CN[C@@H](C)c1cc(OC)ccc1O 712571655 KPWIXYHJCGGUDQ-RYUDHWBXSA-N 264.369 2.146 10 10 CECE C[C@@H]1OCCN(c2ccc(CN)c(F)c2F)[C@H]1C 380501025 ZVWJRBDYDXHGJZ-IUCAKERBSA-N 256.296 2.037 10 10 CECE CN(C)c1ccc([C@H](CCC2CCOCC2)NN)cc1 383390930 RZOLKBFTJDPSGD-INIZCTEOSA-N 277.412 2.464 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CCCC2(C1)OCCO2 715758312 WUUYYCRIFUWRBB-GFCCVEGCSA-N 281.327 2.307 10 10 CECE Oc1cccc(CNC[C@@H]2CCCSC2)c1O 384101057 DZUVQTOWIUAKMV-JTQLQIEISA-N 253.367 2.331 10 10 CECE CCN1CC[C@H](N(CC)c2ccc(CO)cc2F)C1 695339901 NCNRPKBALDLJFD-ZDUSSCGKSA-N 266.360 2.239 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](O)C[C@@H]2C)cc1O 385214347 FJBFYNMSFPVAFS-DMDPSCGWSA-N 264.369 2.022 10 10 CECE CCNC[C@H]1CCN1c1ccc2c(c1)OC(F)(F)O2 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278.371 2.178 10 10 CECE Cc1cc(N(C)C[C@@H]2C[C@H]3C[C@H]3CO2)ccc1CCN 2179463112 WRGUGLGJYBEXEP-VYDXJSESSA-N 274.408 2.357 10 10 CECE CC[C@]1(CO)COCCN1c1ccc([C@@H](C)O)cc1Cl 2169034486 YECCBWKRIKILNL-ABAIWWIYSA-N 299.798 2.371 10 10 CECE CNCc1ccc(N2CC=C[C@@H]2CO)cc1C(F)(F)F 2176342318 GYAVLFCJRINCIA-GFCCVEGCSA-N 286.297 2.162 10 10 CECE CC[C@H](NC)c1ccc(N(C)CCn2cncn2)cc1 2170125318 LLMPBQVIIIECRE-HNNXBMFYSA-N 273.384 2.085 10 10 CECE Cc1cc(N(C)CCS(=O)(=O)C(C)(C)C)ccc1CO 2170465652 UUGYCVHWFUUZTF-UHFFFAOYSA-N 299.436 2.137 10 10 CECE Cc1ccc(O)c(CN2C[C@H]3CC[C@@](C(=O)O)(C3)C2)c1 2170941932 PIAMLNOLLIUFKH-BLLLJJGKSA-N 275.348 2.387 10 10 CECE CC(C)CNCc1ccc(N2C[C@H](F)[C@@H](CO)C2)cc1 2177142785 GCXLGEDJSSWLOD-ZBFHGGJFSA-N 280.387 2.199 10 10 CECE CCCN(Cc1c(O)cccc1F)[C@@H]1CCCNC1=O 2171257838 STEWZGOGBABJMU-CYBMUJFWSA-N 280.343 2.022 10 10 CECE NCc1ccc(N2CCC[C@H](n3cncn3)C2)cc1Cl 2171247912 VRZAELVXEVMKND-ZDUSSCGKSA-N 291.786 2.232 10 10 CECE O=C(O)[C@H](CCF)NCc1c(O)ccc2ccccc12 2177572509 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2.029 10 10 CECE C[C@H](N[C@H]1C[C@@H](c2ncc[nH]2)C1)c1ccc(O)cc1O 2181576775 HTCUIWIDKJAHEI-GARJFASQSA-N 273.336 2.418 10 10 CECE CP(C)(=O)[C@H]1CCN(c2ccc([N+](=O)[O-])c(CO)c2)C1 2181638309 IILCNKIBKJELTM-LBPRGKRZSA-N 298.279 2.289 10 10 CECE COC[C@H]1CC[C@@H](COC(=O)Cc2ccc(N)cc2)C1 2181882597 WOVKAANKNMQHRD-UONOGXRCSA-N 277.364 2.417 10 10 CECE CO[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C(C)C 2182496554 WQGPOBUDWGITTL-GDBMZVCRSA-N 276.380 2.083 10 10 CECE COc1ccc(N2CCC([C@@H]3CCNC3)CC2)c(N)c1 2193601905 BEXWIHRDFCMPFO-CYBMUJFWSA-N 275.396 2.103 10 10 CECE Cc1ccc([C@@H](C)NC2CC(n3cnnc3)C2)c(O)c1 2184106222 PNDHZJJSMDDRSW-PNESKVBLSA-N 272.352 2.346 10 10 CECE Cc1nccn1CCCN1CCc2cc(CN)ccc21 2189920214 RSYLHQRFOSIDRK-UHFFFAOYSA-N 270.380 2.103 10 10 CECE Cc1ccc(CCN2CCc3cc(CN)ccc32)nc1 2189919121 ZBCFWAORSZEEBG-UHFFFAOYSA-N 267.376 2.454 10 10 CECE CNC(=O)OCCNCc1cc(Cl)cc(Cl)c1O 2042962881 DZICWMUTYCTVRR-UHFFFAOYSA-N 293.150 2.145 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@@H](CO)[C@@H](F)C3)ccc21 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COc1ccc([C@H](C)NC[C@@]23CCOC[C@@H]2C3)c(O)c1 2194437382 QIDWNVBJXIAVMU-MKBNYLNASA-N 277.364 2.478 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@@H]3CN(C)C[C@@H]3C2)c(F)c1 2194513702 OOSVUUSYTKKPMO-JLLWLGSASA-N 282.334 2.016 10 10 CECE CCc1cc(N2CCNCC2)ccc1O[C@H](C)COC 2197493911 JHERHQCAXUGWDI-CYBMUJFWSA-N 278.396 2.072 10 10 CECE Cc1c([C@H](C)NC(=O)Nc2ccc(N)cc2)cnn1C 2191503328 QIRWBYDKWLJWSH-VIFPVBQESA-N 273.340 2.193 10 10 CECE COc1cc(N)c(N(C)CC[C@@H](N)C(C)C)cc1OC 2191553659 RNWOOBLIZNFKNZ-LLVKDONJSA-N 281.400 2.096 10 10 CECE CCO[C@H](CNCCc1ccc(N)cc1)C(C)C 2068143950 NLHKWBZSPQWSAT-OAHLLOKOSA-N 250.386 2.462 10 10 CECE Cc1cccc(F)c1[C@@H](NCCN=[N+]=[N-])C(=O)O 2075974159 AYPMZKSKEJVEAA-SNVBAGLBSA-N 252.249 2.160 10 10 CECE C[C@H]1OC2(C)CC1(C(=O)N1CC[C@H](CN=[N+]=[N-])C1)C2 2100447717 RRMVJYJHKRPTRK-ITSCGTHASA-N 264.329 2.103 10 10 CECE CC[C@H]1C[C@H]1CN(C)c1cc2c(cc1N)OCC(=O)N2 2200034797 SWBCBIGFKFVNPN-UWVGGRQHSA-N 275.352 2.082 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)C[C@@H]2CC=CC[C@@H]2C1 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C[C@@H]1C[C@H](C[C@@H](N)c2ccc3c(c2)CCN3C)CO1 2106852032 AYDAXNFFMINEGJ-LALPHHSUSA-N 260.381 2.494 10 10 CECE CN1CCCc2cc([C@@]3(O)CCC[C@@H](N)C3)ccc21 2106830644 IMMCABYLNXFOJB-GDBMZVCRSA-N 260.381 2.158 10 10 CECE CN1CCCc2cc([C@H](NN)[C@@H]3[C@H]4CC[C@H]43)ccc21 2106862600 WJOSJGXNKMXMGV-XNISGKROSA-N 257.381 2.229 10 10 CECE C[C@H](C[C@@H](NN)c1ccc2c(c1)CCN2C)C(F)F 2106863376 GVPOBVRBZWZQMV-BXKDBHETSA-N 269.339 2.475 10 10 CECE CN[C@H](c1ccccc1O)c1nc(C)c(C)nc1C 2107896027 DGGLKHJVSPPFPG-OAHLLOKOSA-N 257.337 2.416 10 10 CECE Cc1nc[nH]c1CCN[C@H](C)c1cc(F)ccc1O 2089617122 NDPHSVBDGGGLJH-SECBINFHSA-N 263.316 2.456 10 10 CECE C[C@@H]1CCC(F)(F)C(=O)N1CCc1ccc(N)cc1 2089775937 ZHDBQPWKNQZARF-SNVBAGLBSA-N 268.307 2.458 10 10 CECE CC[C@@](C)([C@@H](NN)c1ccccc1O)N1CCCC1 2090037149 KGAFABIGVZZWQJ-GJZGRUSLSA-N 263.385 2.161 10 10 CECE CO[C@]1([C@@H](NN)c2ccccc2O)CCC[C@@H](C)C1 2090036898 HWRJTFCSIVWNKK-BYCMXARLSA-N 264.369 2.492 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H](F)[C@H](OC)C2)c1O 2090290981 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CCCO[C@@H]1C=CCN(c2ccc(CN)c(OC)c2)C1 2204543821 SNZIQVASPLKZEB-OAHLLOKOSA-N 276.380 2.325 10 10 CECE C[C@@H](N)c1ccc(N2Cc3cc(O)nnc3C2)cc1Cl 2206104907 QIEPCPZUIYHVSH-MRVPVSSYSA-N 290.754 2.376 10 10 CECE C[C@@H]1C[C@]1(F)CN(C)C(=O)CCOc1ccc(N)cc1 2206341924 GRTHLTADGJEFBQ-ABAIWWIYSA-N 280.343 2.244 10 10 CECE CNCc1ccc(N2CC[C@@H](OCCCO)C2)c(Cl)c1 2207080068 KGFWLKHMYYBDSZ-CYBMUJFWSA-N 298.814 2.037 10 10 CECE Oc1ccccc1CNCCc1conc1Br 2216774655 DSIFMLCHMHTAME-UHFFFAOYSA-N 297.152 2.475 10 10 CECE CSc1ncc(CN[C@@H](C)C(=O)NCC(C)C)s1 2208535033 PKOSGBZTAHMBCE-VIFPVBQESA-N 287.454 2.115 10 10 CECE CSc1ncc(CNC[C@@H]2[C@@H]3CCOC[C@H]32)s1 2208723630 VLJAFBWAOHZQKW-HBNTYKKESA-N 270.423 2.237 10 10 CECE CON(C)CCCN[C@@H](C)c1ccc(F)cc1O 2218693409 KGJXUZWNYXUTQK-JTQLQIEISA-N 256.321 2.065 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NS(=O)(=O)C1CC2(CC2)C1 2218742879 DZHJHJNPPHUQNI-VHSXEESVSA-N 270.358 2.080 10 10 CECE OCC[C@H]1CN(c2ccc3c(c2)CCC3)CCS1 2219580418 ROJRCZZLRCWSSA-HNNXBMFYSA-N 263.406 2.480 10 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10 10 CECE N[C@H]1CN(Cc2cc(F)cc(F)c2O)CC2(CCC2)C1 2151122064 JFYYUBIAVDLXGL-GFCCVEGCSA-N 282.334 2.374 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)C1[C@H]2CCC[C@H]12 2151276457 UAKGIXZDRVQQSD-KBPBESRZSA-N 274.364 2.295 10 10 CECE C[C@@H](O)CCN(C)c1cc(Cl)c(CN)cc1F 2008207500 VCMYATUMAXWGAW-MRVPVSSYSA-N 260.740 2.145 10 10 CECE COCCC1CC(NC(=O)CCc2ccc(N)cc2)C1 2152401429 JETHGUPFLDRLSK-UHFFFAOYSA-N 276.380 2.133 10 10 CECE C[C@@H]1CN[C@@H](C2CC2)CN1c1ccc2c(c1)COCC2 2152796084 LXGMPRWQMGIMSX-SJKOYZFVSA-N 272.392 2.336 10 10 CECE CNCc1ccc(N2CC[C@@H]([C@H]3CCOC3)C2)c(F)c1 2153027435 FBWDASHPILKRCE-KGLIPLIRSA-N 278.371 2.408 10 10 CECE CN([C@H]1CCC12CCC2)S(=O)(=O)Cc1ccc(N)cc1 2154891498 QQTNRFUHIMHCEN-AWEZNQCLSA-N 294.420 2.363 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2CC1(O)CC(C)C1 2154823644 HSPCXRUZADMAFX-JZLYGMAVSA-N 274.408 2.491 10 10 CECE CNCc1ccc(OCC2=CSC3=NCCN23)c(C)c1 2155015172 ZSDSWPAKUJDEGJ-UHFFFAOYSA-N 289.404 2.353 10 10 CECE CC[C@@H](C)N1CCN(c2ccc(CNC)cc2)CC1 55068648 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2.157 10 10 CECE NCc1ccc(N2C[C@@H](O)[C@H](C3CC3)C2)cc1Cl 2030228347 XOQIDIKYVQFTGS-GXTWGEPZSA-N 266.772 2.006 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)C1(SC)CC1 2031145839 KSBQIDDSHYAWJS-OLZOCXBDSA-N 267.394 2.299 10 10 CECE COc1ccc(CNCCNCC(C)C)cc1C 2033018071 IVWDYDZBPHBQHN-UHFFFAOYSA-N 250.386 2.339 10 10 CECE C[C@H](N)c1ccc(N(C)CC(C)(C)CO)c(F)c1 2033575555 FCFLUKGQPRDNFY-JTQLQIEISA-N 254.349 2.300 10 10 CECE Oc1cc(Cl)ccc1CN1CCNCC12CCC2 2035790353 UJKBDHGXMVDPMC-UHFFFAOYSA-N 266.772 2.374 10 10 CECE CCN(Cc1ccc(OC)cc1O)[C@H]1CCC[C@H]1CN 249718371 XIFBWNYHVOGBBS-WFASDCNBSA-N 278.396 2.350 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCCN2CCC[C@H]2C1 300439516 FZUYKOBJBNVEEO-OLZOCXBDSA-N 276.380 2.329 10 10 CECE COc1cc(N)c(N(C)C2CCC(O)CC2)cc1OC 2160134313 TXTOCLXEPRAROV-UHFFFAOYSA-N 280.368 2.026 10 10 CECE C[C@@H]1CCC[C@H](CN)N1Cc1ccc2c(c1)CCN2C 70151195 CTRLXUHWKPKGBI-CZUORRHYSA-N 273.424 2.381 10 10 CECE CC(C)NCc1ccc(N2CCN(CCF)CC2)cc1 402661548 OMSVYODKEBUWIK-UHFFFAOYSA-N 279.403 2.276 10 10 CECE 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295.814 2.164 10 10 CECE [N-]=[N+]=NCCNC(=O)Cc1csc(-c2ccco2)n1 701318223 ZXICIJQNGZRDBN-UHFFFAOYSA-N 277.309 2.372 10 10 CECE Cn1ccnc1[C@@H]1CCN(c2ccc(CN)cc2F)C1 2171706759 MDNYTYDIWMGQEA-GFCCVEGCSA-N 274.343 2.012 10 10 CECE CCCN(CC(C)(C)O)c1ccc(OC)cc1N 708500175 RAVRMUVTTJTKRW-UHFFFAOYSA-N 252.358 2.265 10 10 CECE CCOc1cccc(CN2CC(CCC(=O)O)C2)c1O 709372813 DKUHQCMZHIEPHV-UHFFFAOYSA-N 279.336 2.088 10 10 CECE CC[C@@H]1CN(c2ccc(OC)cc2N)C[C@@H](C)O1 689066003 GXMBHZQCZKHKQG-GHMZBOCLSA-N 250.342 2.281 10 10 CECE Nc1ccc([C@@H](O)c2ccc(N3CCCC3)cc2)nc1 2163096854 ZNMPPLHJUCTPJY-INIZCTEOSA-N 269.348 2.346 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CCC[C@@H](F)C3)ccc21 689394291 WIGKKTCNXSADJT-QMTHXVAHSA-N 277.343 2.228 10 10 CECE CN1CCCc2cc([C@H](O)CCn3cccn3)ccc21 2163111914 XDBACQUQOYIUAD-MRXNPFEDSA-N 271.364 2.389 10 10 CECE CN1CCCc2cc([C@@]3(O)CCN4CCC[C@H]43)ccc21 2163111011 NSQRUWIJPSRMSL-IRXDYDNUSA-N 272.392 2.125 10 10 CECE COC(C)(C)COc1ccc(N2CCC[C@H](N)C2)cc1 381800048 PROHBQDKWRCKEW-ZDUSSCGKSA-N 278.396 2.418 10 10 CECE CN(Cc1cccc(F)c1O)[C@@H]1CN(C)C(C)(C)C1 694144469 VVVNDJCUPRXNQZ-LBPRGKRZSA-N 266.360 2.446 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@H]2C)cc1C 384824499 UNGIZAZHVPLZAY-CJNGLKHVSA-N 262.397 2.454 10 10 CECE C[C@@H](N(C)C(=O)COc1ccc(N)cc1)C1(C)CC1 385324732 ILXBODIRTKRSAX-LLVKDONJSA-N 262.353 2.295 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](C)C2)cc1Cl 388009585 CGUGAYJHODOXHI-GPCCPHFNSA-N 268.788 2.437 10 10 CECE C[C@H](CCCCO)N[C@H](C)c1ccc(O)cc1O 398766188 GQGDWCGFTMMEOK-GHMZBOCLSA-N 253.342 2.300 10 10 CECE CC[C@H]1CCOCC[C@H]1NC(=O)c1ccc(O)c(O)c1 2165382482 KIZIFHKICZGXGP-CMPLNLGQSA-N 279.336 2.033 10 10 CECE COC[C@@]12CN(c3ccc(CN)c(F)c3F)C[C@]1(C)C2 2165477242 VSUSTNDARGNRTH-LSDHHAIUSA-N 282.334 2.286 10 10 CECE Cc1cc(CN)ccc1N1C[C@H]2[C@@H](C1)[C@@H]2C(F)F 2072208133 CVYSRVIESSHHLP-PJXYFTJBSA-N 252.308 2.401 10 10 CECE CO[C@@H]1CC(N[C@@H](C)c2cc(F)ccc2O)C[C@H]1OC 2166090958 BPEUYROMEXUYSF-TZTCFGBESA-N 283.343 2.374 10 10 CECE 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258.365 2.306 10 10 CECE CNC[C@@H]1CN(Cc2cc(Cl)ccc2O)CC12CC2 2340549603 CHZDZTRQICYQJA-GFCCVEGCSA-N 280.799 2.477 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H](O)C[C@H](F)C2)c1C 2340854121 YXLNHSQOQHSIPT-AVGNSLFASA-N 266.360 2.232 10 10 CECE CC[C@@H]1CC[C@]1(C(=O)O)N(C)Cc1ccccc1O 2351137143 MZKBBZCSUAJMGV-DOMZBBRYSA-N 263.337 2.467 10 10 CECE C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCS1 171721818 YEGWOYOMRKXNFV-LBPRGKRZSA-N 293.436 2.400 10 10 CECE COCCNCc1ccc(N2C[C@H](C)OC[C@@H]2C)cc1C 62735863 YMNQWCLSCANBGY-GJZGRUSLSA-N 292.423 2.345 10 10 CECE CCOC(=O)[C@@H](CCCc1ccc(N)cc1)OC 1951490464 IWFRLVZXKKIFRX-CYBMUJFWSA-N 251.326 2.170 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@](C)(N)C1CC1 37807436 PARMDSMIKLOYAY-KRWDZBQOSA-N 289.423 2.229 10 10 CECE CCCN(Cc1ccc(N)cc1)S(=O)(=O)CCC 35064509 CYYOFWPHZDVASJ-UHFFFAOYSA-N 270.398 2.221 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC(F)(F)C3)c(Cl)cc21 313454036 SEISSQOWWMAQMK-SNVBAGLBSA-N 287.697 2.137 10 10 CECE C[C@H](NC[C@@H](C)N1CCOCC1)c1cc(Cl)ccc1O 184934144 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297.420 2.143 10 10 CECE C[C@@H](c1cc(O)ccc1O)N(C)CCC1CCNCC1 2163251173 LDKPAVDGWBYHHV-LBPRGKRZSA-N 278.396 2.480 10 10 CECE CCc1nc(N2CCN(c3ccc(N)cc3)CC2)ns1 2163383188 HJNMRDOKIDULRE-UHFFFAOYSA-N 289.408 2.009 10 10 CECE CN1CCN(c2ccc(CNC3C[C@@H]4C[C@H]4C3)cc2)CC1 818238864 PTTIZPWJJZUKCL-HOTGVXAUSA-N 285.435 2.327 10 10 CECE CO[C@H]1C[C@@H](CN2CCc3cc([C@H](C)N)ccc32)C1 721909825 SRGQTKOVQJKWAV-SLEUVZQESA-N 260.381 2.494 10 10 CECE CCc1cccc(CN[C@@H]2CN(C)CC2(C)C)c1O 722312760 WRSBBAJGKSJJDE-CQSZACIVSA-N 262.397 2.384 10 10 CECE CCOc1ccc(O)c(CNC2(CF)CCOCC2)c1 824690855 NZWFBNFBPVMBLW-UHFFFAOYSA-N 283.343 2.399 10 10 CECE COCC1CC2(C1)CN(c1ccc(CN)c(C)c1)C2 2130000485 KFCLCVNZVSOYQH-UHFFFAOYSA-N 260.381 2.317 10 10 CECE C[C@@H]1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CCS1 588590626 LBQNGPWFFHGODP-USEMIUTHSA-N 293.388 2.465 10 10 CECE CC(C)[C@@H](C)CNC(=O)NCCc1ccc(N)cc1 841831277 SKSUDRJFVPGZLV-LBPRGKRZSA-N 263.385 2.403 10 10 CECE Cc1cc(Cl)cc(CNC[C@@H]2CCCN2)c1O 841036170 PGDXMRSFDHQXKK-LBPRGKRZSA-N 254.761 2.196 10 10 CECE Cc1cc(Cl)cc(CN[C@H](CO)CCF)c1O 846098332 ACTMNJBVKNKALV-NSHDSACASA-N 261.724 2.164 10 10 CECE COC[C@@H](CC(C)(C)C)NC(=O)Cc1ccc(N)cc1 848434933 OHKBAKHRHJIAFG-CQSZACIVSA-N 278.396 2.379 10 10 CECE C[C@@H](N[C@@H]1CNOC1)c1cc(Cl)c(Cl)cc1O 925862159 MIIYPWMSBKWHSD-RNFRBKRXSA-N 277.151 2.253 10 10 CECE CN(C)c1cccc(NC(=O)N2Cc3cccc(O)c3C2)n1 866100469 WURUHXRODBVEDF-UHFFFAOYSA-N 298.346 2.401 10 10 CECE CC[C@@H](C)NC(=S)N1Cc2cccc(O)c2C1 865258471 FJFBTHXKXYRJID-SECBINFHSA-N 250.367 2.381 10 10 CECE CCOc1ccc(CNCC2(CCO)CC2)c(O)c1 778215926 GVSWXQYRLIMAPQ-UHFFFAOYSA-N 265.353 2.043 10 10 CECE CCC(CC)CNC(=O)[C@H](N)c1cc(C)ccc1O 83479295 JMMNGTSFCFJOBF-CQSZACIVSA-N 264.369 2.253 10 10 CECE CCCCc1nnc([C@@H](N)c2cccc(F)c2O)o1 83481243 ODIMSNHCDBYOLM-NSHDSACASA-N 265.288 2.305 10 10 CECE COc1ccnc(NCc2cccc(OC)c2O)c1 83439592 DOICWXYPNHHUTQ-UHFFFAOYSA-N 260.293 2.417 10 10 CECE CC(C)c1nnc([C@@](C)(N)Cc2ccc(O)c(O)c2)o1 83580670 UOTZUZZHHLOVOU-AWEZNQCLSA-N 277.324 2.021 10 10 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260.406 2.447 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)C[C@@H]2C[C@@H]2C(F)(F)F)C1 2065525193 FTFIUOODPFFVPG-RNJXMRFFSA-N 262.235 2.486 10 10 CECE O[C@H]1CCc2cc(N3CCC[C@@H](C4(O)CC4)C3)ccc21 2187045991 BOAHXHFDZLHZNN-CJNGLKHVSA-N 273.376 2.408 10 10 CECE CC1(C)OCCC[C@@H]1C(=O)N1CC[C@H](N=[N+]=[N-])C1 2066889852 MJZPTKZPFKBNFG-VHSXEESVSA-N 252.318 2.103 10 10 CECE CC[C@]1(C)C[C@H](NCc2cccc(O)c2O)CO1 2069118095 QEWLAZOEIAUDQR-SMDDNHRTSA-N 251.326 2.145 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@H]4C[C@H]3CN4C)ccc21 2187590285 CJKBVNXNKFTIKR-VYDXJSESSA-N 271.408 2.176 10 10 CECE C[C@H](OC(C)(C)C)[C@@H](NN)c1ccc2c(c1)CCN2C 2192185628 DTBGHDZIEGCLNJ-XHDPSFHLSA-N 277.412 2.387 10 10 CECE CCCN(CCO)c1c(F)cc([C@H](C)N)cc1F 2074222279 WXHVVXHVFYCJAV-VIFPVBQESA-N 258.312 2.193 10 10 CECE N[C@H]1CCc2cc(N3CC[C@@H](C(F)(F)CO)C3)ccc21 2197753382 DCBYNNIAUVEIEC-RISCZKNCSA-N 282.334 2.087 10 10 CECE Nc1ccc(CCNC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1 2100661577 NLCVXICCTFDRCF-GHMZBOCLSA-N 272.270 2.126 10 10 CECE Nc1ccc(O)c(CN2CCCC23CCOCC3)c1 2102220199 TXASGHUDHLVIHB-UHFFFAOYSA-N 262.353 2.119 10 10 CECE C[C@H]1C[C@@H](O)CCN(c2ccc([C@@H](C)O)cc2F)C1 2103310077 LDZDGNDLCHJYLO-LOWVWBTDSA-N 267.344 2.476 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H](O)C[C@@H](C)C2)c(F)c1 2103310080 LDZDGNDLCHJYLO-NTZNESFSSA-N 267.344 2.476 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@]2(C)COC[C@@H]12 2103593756 DHTBZIAAXXMMOW-HZPDHXFCSA-N 260.381 2.459 10 10 CECE CCNCc1ccc(N2CC(F)(F)C2)cc1OC 2084013295 CCJLSVATYYQZJE-UHFFFAOYSA-N 256.296 2.260 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CC[C@@]12CCCO2 2104364731 FWPVRTATTFBASS-RISCZKNCSA-N 262.309 2.091 10 10 CECE Oc1c(Cl)cccc1CNC[C@@]12COC[C@H]1C2(F)F 2105577161 LJJNUVPYEGVEMM-ZYHUDNBSSA-N 289.709 2.417 10 10 CECE C[C@H](N)c1nc([C@@H](O)c2ccc(N(C)C)cc2)cs1 2106794033 SJTOUARRSWYCHQ-ZANVPECISA-N 277.393 2.311 10 10 CECE C[C@H]1C[C@@H](C)NC[C@H]1[C@@H](O)c1ccc(N(C)C)cc1 2106796440 QQMLBAIIAHKECF-OJDYBEQGSA-N 262.397 2.420 10 10 CECE CNC1([C@H](O)c2ccc3c(c2)CCN3C)CCCC1 2106801031 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CCN(Cc1ccc(N)cc1)c1ncc(OC)cn1 2109330981 IYTGGYGQODNDGR-UHFFFAOYSA-N 258.325 2.094 10 10 CECE C[C@@H](c1ccccc1O)N(C)Cc1ccc(=N)[nH]c1 2109349783 RTLOKYUQLPNKID-NSHDSACASA-N 257.337 2.393 10 10 CECE O=C(O)[C@@H]1[C@@H]2CCCCN(Cc3ccccc3O)[C@H]21 2090511698 JXERGAYQXBDSDP-IACUBPJLSA-N 261.321 2.077 10 10 CECE Cc1cccc(O)c1CNc1cnc2nccn2c1 2111278414 ZQGYPNXGZVYWBM-UHFFFAOYSA-N 254.293 2.355 10 10 CECE CN1CCc2cc([C@@H](O)[C@H](N)c3ccsc3)ccc21 2091344134 BWJPMHDUQDCAIA-HUUCEWRRSA-N 274.389 2.474 10 10 CECE CN[C@@H](C)c1ccc(N2CCOC3(CC3)C2)c(F)c1 2112011112 ZFTSCONHFSEINZ-NSHDSACASA-N 264.344 2.475 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1C[C@H]2CCCCN2C1 2092468300 DEYYHRFPCACWOE-HZPDHXFCSA-N 259.397 2.327 10 10 CECE CN(CC1CC(F)C1)C(=O)CCc1ccc(N)cc1 2092518180 SGMDEOIPABMWEF-UHFFFAOYSA-N 264.344 2.408 10 10 CECE COC[C@@H]1[C@@H]2CCN(c3ccc(CO)cc3F)C[C@H]21 2093138808 XJCLFSKQMCDEDN-JHJVBQTASA-N 265.328 2.037 10 10 CECE CC(C)(C)[C@@H]1CCN1c1ccc2c(c1)NC(=O)[C@@H]2N 2095971359 PMZQPQXJAKARTN-QWHCGFSZSA-N 259.353 2.263 10 10 CECE CCn1nnnc1Sc1ncc(CNCC(C)C)s1 2099107979 VFKGMVQIMUVTTQ-UHFFFAOYSA-N 298.441 2.046 10 10 CECE Oc1c(F)cccc1CNC1CN(C2CCCC2)C1 2112963126 FEXFBUKBZDZLRL-UHFFFAOYSA-N 264.344 2.248 10 10 CECE CN1CC[C@H]2[C@H](CCN2c2ccc(CN)c(Cl)c2)C1 2114499834 FYWVBEWWCRNQDX-DOMZBBRYSA-N 279.815 2.329 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3CCC(F)(F)[C@@H]32)C1 2114411456 XJVLLYMWAFJHSR-QEYWKRMJSA-N 270.283 2.437 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3CN(C)CC[C@H]32)cc1 2114501473 STKKNWNCIAIOOF-DUVNUKRYSA-N 259.397 2.237 10 10 CECE CCN(Cc1cccc(Cl)c1O)[C@@H]1CCCNC1=O 2114764897 QZTPYVYNQBOUMZ-GFCCVEGCSA-N 282.771 2.146 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@H](O)C34CCC4)ccc21 2201407580 AVBJKGUXORBYHE-CVEARBPZSA-N 272.392 2.387 10 10 CECE CN[C@H]1CCCc2cc(N3C[C@@H](O)C34CCC4)ccc21 2201410537 GYRJDKCNCHDSKF-JKSUJKDBSA-N 272.392 2.387 10 10 CECE Cc1scnc1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213598119 QPSAYSNENUDHTF-HTQZYQBOSA-N 251.315 2.413 10 10 CECE CCNCc1ccc(N2CCC[C@]2(C)CO)cc1OC 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Cc1cc([C@H](C)O)ccc1N1C[C@H]2C[C@H]1CC[C@H]2O 2232102734 PIPOJEQWFZJCTN-ADSMDIBLSA-N 261.365 2.398 10 10 CECE CC[C@@H](C)NCc1ccc(N(C)CCO)cc1C 2223531707 NJXADYHSQOGEMU-CYBMUJFWSA-N 250.386 2.312 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCCCO)c(C)c1 2223971105 IOVATMQNSSPNMW-ZDUSSCGKSA-N 250.386 2.484 10 10 CECE C[C@@H]1C[C@H](C(=O)O)[C@@H](C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2234171862 PJEVUYCBUKJMHB-LSJOCFKGSA-N 280.328 2.035 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@@H]2C(F)(F)F)c(O)c1O 2224404615 JHOAIRXYWGDWLP-JGVFFNPUSA-N 277.242 2.234 10 10 CECE OCC[C@H]1COCCN1c1ccc(OC(F)(F)F)cc1 2234893185 GTTZPIVJONWLNN-NSHDSACASA-N 291.269 2.173 10 10 CECE OC[C@H]1CN(c2ccc3c(c2)OCCO3)CC12CCC2 2235096008 GFFDSGBRSTTXFG-GFCCVEGCSA-N 275.348 2.057 10 10 CECE NCc1ccc(N2CCC[C@H](CCCO)C2)cc1F 2225802424 ZXFKUDMAONVSMC-GFCCVEGCSA-N 266.360 2.273 10 10 CECE CCNCc1cc(OC)ccc1N(C)[C@H]1CCC[C@H]1O 2235966681 WLIKFCMBDQLOID-JKSUJKDBSA-N 278.396 2.154 10 10 CECE COc1ccc(N(C)C[C@H](OC)C2CCC2)c(CO)c1 2235999961 PJWOAWXYAFMFFJ-INIZCTEOSA-N 279.380 2.439 10 10 CECE COc1ccc(N2CC=CC[C@@]23CCOC3)c(C=O)c1 2235984626 BSQRNSOMDZXWOD-INIZCTEOSA-N 273.332 2.433 10 10 CECE COc1ccc(N(C)[C@@H](C)C2CCOCC2)c(CN)c1 2235974983 OQJOFTMQWUUWCD-LBPRGKRZSA-N 278.396 2.405 10 10 CECE CC[C@@H](CN(C)c1ccc(OC)cc1C[C@@H](C)N)OC 2235972551 BEWREXYVSLGLSK-OCCSQVGLSA-N 280.412 2.446 10 10 CECE CC[C@H]1CN(C)CCCN1c1ccc(OC)cc1CN 2235962529 KXVVTLZCWUEKSC-AWEZNQCLSA-N 277.412 2.074 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)CC[C@@H]1O 2226812329 WXSIBSICSKLGKV-AAEUAGOBSA-N 263.337 2.055 10 10 CECE COc1ccc(N2C[C@@H]3[C@H](CO)[C@@H]3C2)cc1C(C)C 2226829842 LJATXEIVRVSWBO-QDMKHBRRSA-N 261.365 2.493 10 10 CECE COc1cc(N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@H]3C2)ccc1CO 2236991724 YHOQYUAHOCGTJG-CRJCFHLZSA-N 271.360 2.446 10 10 CECE CN(C)c1ccc(OC[C@H](O)c2ccc(N)cc2)cc1 2237699119 XZIKPTSOCIRNGM-INIZCTEOSA-N 272.348 2.447 10 10 CECE CN(C)c1ccc(OC[C@](N)(CO)CC2(C)CC2)cc1 2237698438 PUTGTMWINFWUPE-MRXNPFEDSA-N 278.396 2.011 10 10 CECE C[C@@H](NCCOc1ccc(N(C)C)cc1)[C@H]1CCCO1 2237690187 UPLAQXGGJSVHNZ-CZUORRHYSA-N 278.396 2.289 10 10 CECE CN(C)c1ccc(OC[C@H]2CCC[C@](N)(CO)C2)cc1 2237699254 ZLZOINAMDXSMIA-XJKSGUPXSA-N 278.396 2.011 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H]3[C@@H]3C[C@@H]32)c(CCN)c1 2227688452 QPGHSWXGAUCGCA-PCBIJLKTSA-N 258.365 2.041 10 10 CECE CN[C@H](C)c1ccc(N2CC3(CCC(=O)N3)C2)cc1Cl 2238033272 ZQRDMIQZZZHNAK-SNVBAGLBSA-N 293.798 2.089 10 10 CECE Cc1cc(N2C[C@H](C)N(C)C[C@H]2C)ccc1C[C@@H](C)N 2238047079 FJBSKNLSDVFRHN-QLFBSQMISA-N 275.440 2.414 10 10 CECE OCc1ccc(N2C[C@H]3CCCC[C@]3(CO)C2)c(F)c1 2238823893 OKMRUQBINDEBSS-CZUORRHYSA-N 279.355 2.307 10 10 CECE CC[C@H](C)NCc1cc(F)c(N2C[C@H](O)[C@H]2C)c(F)c1 2240030294 BVIXBFMERAWQOA-RBZYPMLTSA-N 284.350 2.422 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCN(CCCF)CC1 2240765237 XGXUTHOEIFLHAX-AWEZNQCLSA-N 279.403 2.496 10 10 CECE Nc1ccc(N[C@@H]2CCN[C@H](C(F)(F)F)C2)cc1 2253623062 SIVQEKAOUDGNHC-MNOVXSKESA-N 259.275 2.364 10 10 CECE CN(CCCN=[N+]=[N-])CC12CC(C(F)F)(CO1)C2 2255026157 HXPLBKIBMMKZOB-UHFFFAOYSA-N 260.288 2.433 10 10 CECE CSc1ncc(CNC[C@@H]2CCNC23CC3)s1 2248742462 HTAGEVZZYKOWGB-VIFPVBQESA-N 269.439 2.097 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H](C)CF)c(Cl)cc21 2270219400 DWPDULDNWLXVJN-KRTXAFLBSA-N 285.750 2.347 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H](C2)[C@@]3(C)O)c(F)c1F 2270721636 UCLWTKSAXMFIRA-ICCCGROCSA-N 269.291 2.181 10 10 CECE N[C@@H]1CN(c2ccc(OCF)cc2)C[C@H]1C(F)F 2263923797 NOPAWFDPGXHCNA-GHMZBOCLSA-N 260.259 2.021 10 10 CECE Nc1ccc(C[C@@H](O)c2ccn(CC(F)F)n2)cc1 2278638150 UFQXXAYRXZBEKG-GFCCVEGCSA-N 267.279 2.007 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@](C)(OC)CC[C@@H]2O)cc1 2279044995 VPRKFMWRUZKUQI-OWCLPIDISA-N 279.380 2.450 10 10 CECE CSc1ncc(CNC(=O)Cc2ccc(N)cc2)s1 2269123469 JBVPQSZGKICLFM-UHFFFAOYSA-N 293.417 2.306 10 10 CECE Cc1cc(N(C)C[C@@]2(C)COCCO2)ccc1[C@H](C)N 2285143375 HDPQOLYWBIJFNS-BBRMVZONSA-N 278.396 2.256 10 10 CECE Cc1cc(N(CCS(C)(=O)=O)C2CC2)ccc1[C@H](C)N 2285126262 AEWGCDSKQUQZGR-LBPRGKRZSA-N 296.436 2.028 10 10 CECE Cc1cc(N2C[C@@H]3CN(C)CC[C@H]3C2)ccc1[C@@H](C)O 2285149842 IVNNGPSCDRTYEM-ILXRZTDVSA-N 274.408 2.436 10 10 CECE CO/C(=C/c1ccc(N2CCCC2)cc1F)C(=O)O 2295343926 JZNFMKGUZIAAIL-MDWZMJQESA-N 265.284 2.498 10 10 CECE Nc1ccc(CC(=O)c2ccn(CC(F)(F)F)n2)cc1 2296117110 XGXJJSPILLNGIT-UHFFFAOYSA-N 283.253 2.453 10 10 CECE O[C@H](c1ccc(N2CCNCC2)cc1)[C@@H]1CCC[C@@H]1F 2286071122 JCOXJEFUQULHDX-OWCLPIDISA-N 278.371 2.268 10 10 CECE COc1cc(OC)c(N2CCC[C@H](O)[C@H]2C)c(OC)c1 2287071458 XUCJDSYBDCBRBQ-PWSUYJOCSA-N 281.352 2.062 10 10 CECE COc1ccc(N2CCc3ncsc3CC2)c(CN)c1 2287059891 SUNLLVMOBWFSCX-UHFFFAOYSA-N 289.404 2.216 10 10 CECE COc1ccc(N2CCSC2)c(C[C@H](C)N)c1 2303501944 VFSHGQMKKDNFLB-JTQLQIEISA-N 252.383 2.096 10 10 CECE CC=CC[C@@H](CO)NCc1cccc(Cl)c1O 2309546434 HYYQSGDZRPLOFS-NSHDSACASA-N 255.745 2.462 10 10 CECE CCCNCc1ccc(N(C)CC(=O)NC(C)C)cc1 42609363 HWQLOIASARHWTP-UHFFFAOYSA-N 277.412 2.147 10 10 CECE OC[C@H]1C[C@H](NCc2c(O)cccc2Cl)[C@@H]2C[C@H]12 2309228615 JDZWYNJCSGMYII-PRFIWBCESA-N 267.756 2.152 10 10 CECE CSc1ncc(CNC[C@H]2CCCC23CNC3)s1 2317238883 ZLOBCURBEFGVIO-SNVBAGLBSA-N 283.466 2.344 10 10 CECE CSc1cc(N2CC[C@@H](C)[C@@H]2CO)ccc1CN 2328548687 JOEWCPZYXMZSBV-MFKMUULPSA-N 266.410 2.074 10 10 CECE CSc1cc(N2CCC[C@H](O)[C@@H]2C)ccc1CN 2328547303 YWZRGBHRWVIPGO-GWCFXTLKSA-N 266.410 2.217 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@@]2(O)c1ccc(N(C)C)cc1 2329487132 WSCHHAGXLSXCAM-UIBBOPPKSA-N 261.365 2.385 10 10 CECE CS[C@@H]1CN(C(=O)c2cccc(O)c2O)C(C)(C)C1 2335257484 WUQNTPFQTAZZHQ-VIFPVBQESA-N 281.377 2.454 10 10 CECE Oc1ccc(CN[C@H]2C[C@H]3CC[C@H](C3)C2)c(O)c1O 2336027887 NJWCANNBDKZKRY-PEGIJTEDSA-N 263.337 2.472 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC(F)(F)[C@@](C)(N)C1 2336771301 JYUWJZXJZDCNOH-PELKAZGASA-N 274.286 2.261 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccccc1C(=O)O 2337777628 VFLVLUSQTFHMAJ-UHFFFAOYSA-N 262.269 2.157 10 10 CECE NCc1ccc(N2C[C@@H]3COC[C@H]3C2)cc1C1CC1 2339160492 MEASNCKNYCVUTM-ZIAGYGMSSA-N 258.365 2.105 10 10 CECE CCN1CCN(c2ccc([C@H](C)O)c(C)c2C)CC1 2340849505 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251556607 RLYSAUKAPKHKRX-NQMOMTLDSA-N 288.391 2.285 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](C)[C@@H](O)C2)c(F)c1 300005036 KVTUNWUDYHMDTF-RWSFTLGLSA-N 266.360 2.313 10 10 CECE CC(=O)C(=O)COC(=O)CO[C@@H]1C[C@H](C)CC[C@H]1C(C)C 808492992 NCKNZLAFRLYTHM-OSAQELSMSA-N 298.379 2.165 10 10 CECE CCc1cccc(CN2C[C@H]3CN(C)C[C@]3(C)C2)c1O 702452440 NIXHFTQLROFJNK-NVXWUHKLSA-N 274.408 2.338 10 10 CECE CO[C@]1(CN(C)c2ccc([C@H](C)N)cc2)CCCOC1 2166145248 WMTFVBKAPWLLBW-BBRMVZONSA-N 278.396 2.338 10 10 CECE CC[C@](C)(CO)NCc1cc(Cl)c(F)cc1O 293501220 BLNOXBIJIUUURK-GFCCVEGCSA-N 261.724 2.435 10 10 CECE CN[C@@H](Cn1ccnc1)c1ccc2c(c1)CCCN2C 2163105024 HINQQCXAFVZPFW-HNNXBMFYSA-N 270.380 2.226 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@]23COC[C@@H]2C3)cc1 2163156921 WLTZRKAQHTTXCF-BPUTZDHNSA-N 275.396 2.074 10 10 CECE CN(CCC1CCNCC1)Cc1cc(F)cc(F)c1O 2163243740 DRPGZYDRDWEDJD-UHFFFAOYSA-N 284.350 2.492 10 10 CECE CN(C)c1ccc(CN2C[C@@]3(C)C[C@@]3(C(=O)O)C2)cc1 2165498100 XWQAZCXBIJFUFX-CVEARBPZSA-N 274.364 2.049 10 10 CECE CN[C@H](Cc1cnsn1)c1ccc(N(C)C)cc1 399885349 VGKCBRHUBVEHQA-CYBMUJFWSA-N 262.382 2.107 10 10 CECE CC[C@@]1(C)CCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 399333292 QAVALUPFBXMOIF-ZFWWWQNUSA-N 259.353 2.265 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc2nc(Cl)ccc2c1 808505116 SQMBNXZAKMRCMK-UHFFFAOYSA-N 291.690 2.203 10 10 CECE CC(=O)C(=O)COC(=O)c1cc2ccc(Cl)cc2[nH]1 808501807 OZKKIOMQALGSNN-UHFFFAOYSA-N 279.679 2.136 10 10 CECE CC[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)CCO1 817770003 YEKBRPXGQVPJFQ-WPRPVWTQSA-N 255.339 2.141 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@H]1CCC(=O)NC1(C)C 813857975 RLBGTLFBYRQIRG-HNNXBMFYSA-N 289.423 2.208 10 10 CECE C[C@H]1CCC[C@H](C)N1CCNC(=O)Cc1ccc(N)cc1 828949823 PGIUNBNZASISHE-KBPBESRZSA-N 289.423 2.190 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1COc2ccccc21 588404785 PZNRBHWOFNJUHK-WOLRVDTOSA-N 297.310 2.361 10 10 CECE CCOc1ccc(O)c(CN2C[C@H](C)C(O)[C@@H](C)C2)c1 827151443 BEHKENYUCFGNEH-RYUDHWBXSA-N 279.380 2.240 10 10 CECE C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)CCCO1 738159205 ATDJTKMKFXRDJZ-GFCCVEGCSA-N 261.365 2.492 10 10 CECE Cc1cc(CN[C@@H]2CCc3cccc(O)c32)ncn1 2130070555 BTJUPOMRRCJVFZ-CYBMUJFWSA-N 255.321 2.268 10 10 CECE C[C@@H]1CCN(C/C=C/c2ccc(N(C)C)cc2)[C@@H]1CO 835046029 QIBGPDRSTPWOIH-XUOJHOASSA-N 274.408 2.469 10 10 CECE CCOCc1cc(CN[C@H](C)C(C)(C)O)ccc1OC 734841394 NMNLPQBFGILVDT-GFCCVEGCSA-N 281.396 2.481 10 10 CECE O=C(c1cc(O)cs1)N1CCC(CN2CCCC2)CC1 743539924 LOLORSOJUILPPS-UHFFFAOYSA-N 294.420 2.402 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](C(F)(F)CO)C2)cc1 1892714897 KAGWNMQOMWHGTG-ZYHUDNBSSA-N 271.307 2.194 10 10 CECE CCN(CCN(C)C)c1ccc(/C=C\C(=O)O)cc1F 688292058 HVKRYRROEGTTCH-VURMDHGXSA-N 280.343 2.311 10 10 CECE CC(=O)NCCN(C)Cc1ccc(N2CCCCC2)cc1 741712365 UWNMRNCLPFFIES-UHFFFAOYSA-N 289.423 2.245 10 10 CECE CN(C)c1ccc(CN2CC[C@@H]3CNC[C@@H]3CC2)cc1F 843126633 MGHRSPXBOFKERQ-GASCZTMLSA-N 291.414 2.323 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CNCCC1(F)F 841075098 LRLRQCPFASNJJH-SNVBAGLBSA-N 276.714 2.132 10 10 CECE CC[C@H](NC(=O)c1ccc(C)c(O)c1O)[C@@H]1CCCOC1 922133833 CGDABOKBYXFENB-YPMHNXCESA-N 293.363 2.341 10 10 CECE CO[C@@H]1CCC[C@H]1CNC(=O)NCc1c(O)cccc1F 921804465 KSTMBIPJRDBUQC-IINYFYTJSA-N 296.342 2.146 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NS(=O)(=O)CCCC1CC1 2218747803 ZVTKHVJWNIOEHC-QWRGUYRKSA-N 272.374 2.327 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)C3CCC3)C2)cc1 855235152 ZIBIQQHHTVIUAI-ZDUSSCGKSA-N 274.364 2.190 10 10 CECE [N-]=[N+]=NCCNC1(C(=O)O)CCC(C2CC2)CC1 2218894109 SZVXQIXUVBGLFT-UHFFFAOYSA-N 252.318 2.310 10 10 CECE COc1cccc([C@H](C)N[C@@H]2C[C@@H](C)n3ncnc32)c1O 850499456 PYBYDRZKWWWHLW-JFGNBEQYSA-N 288.351 2.349 10 10 CECE CN(C)Cc1cc([C@H](CCN)C(F)(F)F)ccc1O 1952685475 MKQXYKOZNITWOL-NSHDSACASA-N 276.302 2.449 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC34CC4)C2)cc1 855225100 NVLRJMLEEYRBCS-IUODEOHRSA-N 286.375 2.190 10 10 CECE COc1ccc(N2CC[C@@H](Nc3ncc(F)cn3)C2)cc1 853758924 NADDBKKWLCGKFM-GFCCVEGCSA-N 288.326 2.315 10 10 CECE CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2ccccc2O)C1 850353966 RCBHOTJBRHTHET-BPLDGKMQSA-N 279.380 2.048 10 10 CECE CC(C)[C@H](N)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 854230367 NXXASKDPZNSSHR-ZWNOBZJWSA-N 281.356 2.324 10 10 CECE C[C@H](NC(=O)c1nc([C@H]2C[C@H]2C)no1)c1ccccc1O 866161896 YWWKVRFNECPSJT-YWVKMMECSA-N 287.319 2.390 10 10 CECE O=C(NCC[C@@H]1CCCOC1)c1cc(O)cs1 862393725 YCXJVMJFKQTBBH-VIFPVBQESA-N 255.339 2.000 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@H]1CNCc1ccccc1O 1955965126 YTWGGGVFKGEBLE-STQMWFEESA-N 292.379 2.395 10 10 CECE Cc1nn2c([C@H](C)Cc3ccc(N)cc3)nnc2s1 82585094 RBLNXKYROCTLOK-MRVPVSSYSA-N 273.365 2.423 10 10 CECE CC[C@]1(c2c(O)cc(F)c(F)c2F)CO[C@@H](C)CN1 83543024 HDGBZKMAKVLDSF-WPPNPWJKSA-N 275.270 2.423 10 10 CECE COc1ccc(O)c([C@H](N)c2nnc(C3CCC3)o2)c1 83543999 KTVOQGARMYQRQS-LBPRGKRZSA-N 275.308 2.099 10 10 CECE Oc1cc2c(cc1O)[C@H](COc1ccccc1)NCC2 83724962 DQHWTWYKJZTSCA-AWEZNQCLSA-N 271.316 2.364 10 10 CECE CCN1C[C@H](C(=O)O)Cc2cc(OC)c(Cl)cc21 84802730 YCOWHAOAOOMRNH-SECBINFHSA-N 269.728 2.432 10 10 CECE Cc1cccc(O)c1CNCC1CC2(CC[C@@H]2O)C1 1882897958 SVYXVMBUIVCWOZ-NRAUKZCXSA-N 261.365 2.341 10 10 CECE Oc1c(F)cccc1CN1CC[C@@H](CN2CCCC2)C1 272294591 OOHQGURTTLIVDQ-ZDUSSCGKSA-N 278.371 2.449 10 10 CECE C[C@H]1CN(c2nc(-c3ccc(O)c(O)c3)cs2)CCO1 793993671 XPYCJRWBAQJZKI-VIFPVBQESA-N 292.360 2.446 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H]2C[C@]2(C(=O)O)C1 703462252 WCRZSEZBDRORJZ-NVBFEUDRSA-N 261.321 2.250 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](C)[C@H](O)C3)cc1O 686170714 UQKSANPTCJYAAP-XBMQVOARSA-N 277.364 2.184 10 10 CECE CCNCc1ccc(N(C)CCn2cccn2)c(C)c1 708301036 HGMRMPAZORCKBM-UHFFFAOYSA-N 272.396 2.437 10 10 CECE CN1CCC[C@H]1CCNCc1cc(F)cc(F)c1O 708516508 IXRVOPJYLVPSPW-LBPRGKRZSA-N 270.323 2.244 10 10 CECE CO[C@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 799351712 FPRJSBNRECHSEB-JSGCOSHPSA-N 280.324 2.348 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ncc(Cl)s1 1142533673 PKVFKKNVIIDNPW-UHFFFAOYSA-N 284.724 2.138 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@H](C(F)F)CC2)cc1O 687554054 JIGMMGVXISMMNB-RNCFNFMXSA-N 287.306 2.306 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](CO)CC[C@H]2C)c(F)c1 688707317 ZELVOHDYEMASNQ-GRYCIOLGSA-N 266.360 2.443 10 10 CECE C[C@@H](N)c1ccc(N2CCSC[C@H]2CCO)cc1 689726361 KFRSMLJMFJHTGQ-BXUZGUMPSA-N 266.410 2.011 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2C[C@H]1CCN(C)C1 691398717 AKLTYBWJTWWNEU-KBPBESRZSA-N 273.424 2.411 10 10 CECE COc1ccc(N(C)Cc2cc(NN)ccn2)cc1 92421106 QUZGVHCMSISZDJ-UHFFFAOYSA-N 258.325 2.012 10 10 CECE CN(C)c1ccc(N)c(OCCOCC(F)(F)F)c1 93641529 OCUWXKHQDYUJMY-UHFFFAOYSA-N 278.274 2.293 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2CCCN(C)C2)cc1O 93671430 XZRYNDGVJUHIIQ-TZMCWYRMSA-N 277.412 2.203 10 10 CECE C[C@H](Nc1ccc(=O)n(C)c1)c1cc(F)ccc1O 94617717 OZGPXSTUQLBDKZ-VIFPVBQESA-N 262.284 2.403 10 10 CECE Nc1ccc(OC[C@@H](O)CSc2ccncc2)cc1 94613971 NQRMBSHFWWGHOD-GFCCVEGCSA-N 276.361 2.196 10 10 CECE CCCNCc1ccc(N2CC[C@@](F)(CO)C2)c(F)c1 1917079065 BPDLVURSXHXMSK-HNNXBMFYSA-N 284.350 2.236 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H]3CC[C@H]3N)ccc21 2126622533 RGQOOMVYWMRQAA-SGIREYDYSA-N 260.381 2.230 10 10 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O[C@@H]1COC2(CCN(c3ccc(OCF)cc3)CC2)C1 2295980498 KHESTTMJLGBZOK-ZDUSSCGKSA-N 281.327 2.113 10 10 CECE COc1cc(OC)c(N2CC[C@H](O)C2(C)C)c(OC)c1 2287122597 BYXNFJYXEGZUOX-ZDUSSCGKSA-N 281.352 2.062 10 10 CECE CN(C)CC=CC(=O)NCc1c(O)ccc2c1CCCC2 2297716839 XVFGTAFIPQDWKL-UHFFFAOYSA-N 288.391 2.005 10 10 CECE Cc1ccc(CNc2nn(C)nc2Br)c(O)c1 2303354797 DPAULZUXJBCNIE-UHFFFAOYSA-N 297.156 2.204 10 10 CECE CC(C)[C@@H](CO)N(C)c1ccc(CO)cc1Cl 2302554954 NEJPHOGOSQCBKZ-CYBMUJFWSA-N 257.761 2.285 10 10 CECE CSc1ncc(CN[C@H]2CN[C@@H](C(C)C)C2)s1 2304147038 BEUHSRNAYIETQH-MWLCHTKSSA-N 271.455 2.341 10 10 CECE Cc1ccc(CN[C@@H]2CC[C@H]2CN)c(O)c1Br 2307479491 IVHOKXQRFKYHPS-GXSJLCMTSA-N 299.212 2.290 10 10 CECE COc1ccc(N(C)C[C@H](N)CP(C)(C)=O)cc1 2313908835 OICSYEFWSOQXJA-NSHDSACASA-N 270.313 2.081 10 10 CECE C[C@]12C[C@H](C1)[C@H](NCc1cccc(F)c1O)CO2 2315971250 YUDNRHMJOYCKIN-QKCSRTOESA-N 251.301 2.188 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)C1CC2(CCC2)C1 2315993034 VUJJBIUKEGIPCG-UHFFFAOYSA-N 272.374 2.281 10 10 CECE CC[C@H](C(F)F)N1CCc2cc(O)c(O)cc2C1 2318675523 REHUEIMFAMSMMB-SNVBAGLBSA-N 257.280 2.500 10 10 CECE COc1ccc(N2CCSC2)c(C=CC(=O)O)c1 2320232221 RBTBHKLRDQPMJT-UHFFFAOYSA-N 265.334 2.304 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@H]1CC[C@@H]2C[C@@H]2C1 2329708571 UTTJBSVPWRYFRX-MXWKQRLJSA-N 261.321 2.358 10 10 CECE CCc1cccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@H]3O)c1O 2330917739 UJRWQXXSJKIYAR-ZQDZILKHSA-N 261.365 2.204 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@]3(CO)CC[C@H]2C3)cc1 2336496288 GFWXZNDDZPVKOW-HRCADAONSA-N 260.381 2.448 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc(OC)c(OC)c1 2336813496 QESFZORUQHBUEQ-HUUCEWRRSA-N 265.353 2.444 10 10 CECE NCc1ccc(N2CC[C@@H]3COC[C@@H]32)cc1C1CC1 2339161960 WLCQLVCBNJHWBY-CJNGLKHVSA-N 258.365 2.248 10 10 CECE C[C@@H](c1ccccc1O)N1CC(F)(F)[C@](C)(CN)C1 2351602762 FIVVKYMSAIRJQU-GXFFZTMASA-N 270.323 2.369 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3CC[C@H]4C[C@@H]3CO4)ccc21 2354608429 YHKSBKZVHIBMDZ-JYYAWHABSA-N 272.392 2.494 10 10 CECE Cc1noc(CCNCc2cccc(Cl)c2O)n1 224800484 VMKFZVUMOZWVEX-UHFFFAOYSA-N 267.716 2.069 10 10 CECE C[C@H](N[C@H](C)c1cc(O)ccc1O)[C@@H]1CCCO1 20207051 PTFBXFHQKVXRSK-BFVZDQMLSA-N 251.326 2.316 10 10 CECE Cc1c(Br)c(=O)oc2c(O)c(O)ccc12 29132221 BNOVFUCZOQOXSU-UHFFFAOYSA-N 271.066 2.275 10 10 CECE C[C@H](NC[C@@H](C)N1CCOCC1)c1ccc(N(C)C)cc1 123303623 JTJFNZQGSUUQHU-CABCVRRESA-N 291.439 2.124 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1C[C@H]2CC[C@H]1O2 252740065 IMPQQSWJMJJOGU-YUSALJHKSA-N 253.729 2.455 10 10 CECE CSCC[C@@H](C)NC(=O)CCc1ccc(N)cc1 128973411 YQYWHUKVNMCQJO-LLVKDONJSA-N 266.410 2.459 10 10 CECE Cc1cc(N2CCCC(C)(C)[C@@H]2CO)ccc1CO 2129317700 ZRBFXGJUKWWPSX-HNNXBMFYSA-N 263.381 2.475 10 10 CECE CCOCCN(C)Cc1cc(C(C)=O)ccc1O 158081264 IUYRJLPVLGCBBM-UHFFFAOYSA-N 251.326 2.063 10 10 CECE COc1ccc(N(C)C[C@](CO)(NC(C)C)C2CC2)cc1 70338516 CBZZLLMIZGEUEK-QGZVFWFLSA-N 292.423 2.271 10 10 CECE CC(C)(C)CC(=O)NCCOc1ccc(N)cc1 38079535 SWAOYAGNAHZBQE-UHFFFAOYSA-N 250.342 2.200 10 10 CECE COc1ccc(CN(CC(=O)O)c2ccccc2)c(O)c1 86738837 CKMWMYOARFJNRB-UHFFFAOYSA-N 287.315 2.492 10 10 CECE CCN1CCN([C@H](C)c2cc(F)ccc2O)CC1 131706755 YKQROVRKWQCWOL-LLVKDONJSA-N 252.333 2.230 10 10 CECE C[C@H](N[C@@H](C)c1nnc2n1CCC2)c1cc(F)ccc1O 94617537 DQOTZADAUXTRPG-UWVGGRQHSA-N 290.342 2.481 10 10 CECE CN[C@@]1(CO)CCC[C@H]1CCN(C)c1ccc(OC)cc1 93615413 MCIJNHLLMVEAPZ-WMLDXEAASA-N 292.423 2.272 10 10 CECE N[C@@H](CCCO)c1cc(F)cc(Br)c1O 95706830 GXJZMIOZBLZLQP-VIFPVBQESA-N 278.121 2.066 10 10 CECE CN1CCc2cc(CN[C@H]3CC[C@H](O)CC3)ccc21 252702519 HSEWKTPFPOLJFC-SHTZXODSSA-N 260.381 2.072 10 10 CECE C[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)CC1 276508048 ARWCWKJYEKWBEH-VIFPVBQESA-N 267.300 2.499 10 10 CECE c1cc2c(cc1N1CCN[C@H]3CCCC[C@@H]31)COCC2 2162842920 BNEPKKLMJXRTES-IRXDYDNUSA-N 272.392 2.480 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@](O)(CC)COC)cc1 2163157554 DTMALVBQNZVFIS-JKSUJKDBSA-N 280.412 2.320 10 10 CECE C[C@@]1([C@H](NN)c2ccc(N3CCCC3)cc2)CCOC1 2163157867 ISMBJJFHCPVWQS-HZPDHXFCSA-N 275.396 2.218 10 10 CECE CO[C@H]1C[C@@H](N(C)Cc2ccc(N3CCOCC3)cc2)C1 809693232 QVOPNDKWTPUJNP-CALCHBBNSA-N 290.407 2.132 10 10 CECE CC(=O)C(=O)COC(=O)c1cccc(OCC=C(C)C)c1 808520945 BBMRIEDCMOUPPY-UHFFFAOYSA-N 290.315 2.347 10 10 CECE CO[C@H]1C[C@H](N(C)c2ccc(CO)cc2C)C[C@H]1OC 2166101711 HJEJDGVVSCJVQD-MKZZRHPPSA-N 279.380 2.116 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)[C@@H]1NCC[C@@H]1C 2164127511 LHUBRHOVENIYPL-JCURWCKSSA-N 273.424 2.328 10 10 CECE CN(C[C@H]1CC2(CC2)CO1)c1ccc(CN)c(F)c1F 2166408486 OVXJTVBZVFGCQM-LLVKDONJSA-N 282.334 2.429 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCCCNC2)c1 817984128 NQIRRRJKZGPKPT-RYUDHWBXSA-N 264.369 2.194 10 10 CECE OCc1ccc(N2C[C@H]3[C@@H]4CC[C@@H](O4)[C@H]3C2)cc1Cl 718311539 UAGBDMCJJJZGTH-IKARSPCKSA-N 279.767 2.446 10 10 CECE CO[C@H]1C[C@@H](COC(=O)CCOc2ccc(N)cc2)C1 721939467 IBQMZCNYLRIVIJ-VDISTLRHSA-N 279.336 2.006 10 10 CECE C[C@@H]1CN([C@@H](C)c2cc(O)ccc2O)C[C@@H]1CC(=O)O 722650119 UQWPYKSYRZKZGH-VWYCJHECSA-N 279.336 2.201 10 10 CECE CN(C)c1ccc(/C=C/CN(C)C2(CO)CC2)cc1 827897920 BQJHPASDNGOPBR-SNAWJCMRSA-N 260.381 2.223 10 10 CECE C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H](C)C1O 827152313 RILLRJDKYKSACO-NXEZZACHSA-N 269.772 2.494 10 10 CECE COc1cc(O)c(CN[C@@H]2[C@H]3CCC[C@H]32)cc1OC 827488442 HFRNPDVCPROBIK-HBYGRHMLSA-N 263.337 2.298 10 10 CECE Cc1cc(Cl)cc(CN(C)[C@H]2CCNC2)c1O 843049937 ZBVJWTLLVNIKPZ-LBPRGKRZSA-N 254.761 2.148 10 10 CECE O=C(NCc1c(O)cccc1F)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 928711031 ZFHQROSUVWPJFJ-WTPMCQDGSA-N 275.323 2.440 10 10 CECE CC[C@@H]1C[C@@H](NC(=O)NCc2c(O)cccc2F)CCO1 922933980 MLIFAKOOXFKZMP-WDEREUQCSA-N 296.342 2.288 10 10 CECE CCCCC[C@@H](O)C(=O)NCc1c(O)cccc1F 928705881 MGLZTQPEQUPQHY-CYBMUJFWSA-N 269.316 2.089 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N(CC3CC3)C3CC3)cc21 131399895 BDVMOHZBCNWMDB-HNNXBMFYSA-N 271.364 2.042 10 10 CECE O=C(O)C[C@H](c1cc(O)c(O)c(O)c1)C1CCC1 1952215008 URZQYDXUHSAHCJ-VIFPVBQESA-N 252.266 2.162 10 10 CECE CC[C@H](COCC1CC1)NC(=O)c1cccc(O)c1O 855283880 HYACHNRWXILEMQ-LLVKDONJSA-N 279.336 2.033 10 10 CECE 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C[C@H](O)c1cc(F)c(N2CCN(C)[C@H]3CC[C@@H]32)c(F)c1 2194522020 ZHGPDZIVUWHKTP-HERUPUMHSA-N 282.334 2.301 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H](C)NC(=O)C2(C)C)cc1 2186204140 UCQZWZCXMRUSFT-SMDDNHRTSA-N 275.396 2.200 10 10 CECE O[C@H]1CCc2cc(N3C[C@@H]4[C@@H](C3)C4(F)F)ccc21 2065080836 OAKSOJGIOIFETI-UPJWGTAASA-N 251.276 2.368 10 10 CECE CC(C)NCc1ccc(N(C)C[C@@H]2CCN2C)c(F)c1 2186456220 ZBBIQMAGMQBIPH-AWEZNQCLSA-N 279.403 2.464 10 10 CECE CC[C@@](CCC(C)C)(NCCCN=[N+]=[N-])C(N)=O 2066038514 QELIWCAOMFMOOA-LBPRGKRZSA-N 255.366 2.347 10 10 CECE C[C@@H](COC(F)F)N[C@@H](C)c1ccc(O)cc1O 2067271454 OYESCRVGCUIHGN-YUMQZZPRSA-N 261.268 2.376 10 10 CECE C[C@H]1CCOCC[C@H]1N(C)Cc1cc(N)ccc1O 2109094128 WSLUBICPAGVCRA-SMDDNHRTSA-N 264.369 2.221 10 10 CECE CC(C)[C@H](NCc1ccc(O)c(O)c1O)C(F)F 2072015160 ZCMRDMVWKJAEAD-VIFPVBQESA-N 261.268 2.183 10 10 CECE CN(CC[C@@H]1CCOC1)c1ccc(CO)cc1F 2075502750 HMYUKXRJWICZAX-LLVKDONJSA-N 253.317 2.181 10 10 CECE CC[C@@H]1C[C@@H]1CN(C)c1cc2c(cc1F)[C@H](O)C(=O)N2 2200011228 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[N-]=[N+]=NCCCNC(=O)/C=C\c1ccc2c(c1)CCO2 701285722 BQIRHAOVPKOLNL-HYXAFXHYSA-N 272.308 2.451 10 10 CECE Cc1cc(C)nc([C@@H](N)c2ccc3c(c2)CCN3C)n1 2163068213 FSFKNCGKFPMSAB-HNNXBMFYSA-N 268.364 2.134 10 10 CECE CCN(CC)c1ccc([C@](O)(CCCN)COC)cc1 2163098855 DYNAZUMARYGRRW-INIZCTEOSA-N 280.412 2.106 10 10 CECE Cc1nccnc1[C@H](N)c1ccc(N2CCCC2)cc1 2163127814 QTCWMKXMIOGTRK-OAHLLOKOSA-N 268.364 2.433 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H]1C[C@@H]2C[C@@H]2C1 2163146194 SQEQXYGTSPWDKD-AEKWLRTRSA-N 274.408 2.420 10 10 CECE CCC(=O)NCc1cc(Br)ccc1O 804738009 YTIUUFJFJBFIDT-UHFFFAOYSA-N 258.115 2.181 10 10 CECE CCN(Cc1ncoc1COC)c1ccc(CN)cc1 2163550743 CKUTTZBVYZCSIA-UHFFFAOYSA-N 275.352 2.306 10 10 CECE O=C(O)[C@H](O)c1cc(S)c2scc(O)c2c1 396377875 ORSAUTKHWJWBED-MRVPVSSYSA-N 256.304 2.014 10 10 CECE CCNCc1ccc(N2C[C@]3(C)C[C@]3(CO)C2)c(C)c1 2165463126 HYPHHCDZPIXKLP-DLBZAZTESA-N 274.408 2.313 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1CC2(CC2)CO1 2166464827 PKBFHOYLPVXZLW-CQSZACIVSA-N 274.364 2.186 10 10 CECE COc1cc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)cc(C)n1 2166947683 GGLOYUNLDDQSKG-JTQLQIEISA-N 275.312 2.171 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H](C)c2cnn(C)c2)cc1O 710071014 KNHSGQYZQGKGAU-WDEREUQCSA-N 274.368 2.343 10 10 CECE COc1cccc(CNC(=O)COc2ccsc2)c1O 800519103 LREXHRONPUOFMQ-UHFFFAOYSA-N 293.344 2.158 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1n[nH]c(C)c1C 819761434 QGPBBKZJHWZJAG-UHFFFAOYSA-N 294.351 2.148 10 10 CECE CNCc1ccc(N(C)[C@H](C)c2cnn(C)c2)cc1 710166062 GFJZRMFXLYWNGJ-GFCCVEGCSA-N 258.369 2.337 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)/C=C/[C@H]1CCCO1 819290759 HQOYKMCEOVHKDQ-ROJDOSBLSA-N 288.391 2.412 10 10 CECE OCC[C@H](NCc1ccc(O)cc1O)C1CCCC1 725103990 KYDXNMIXMLDBLV-AWEZNQCLSA-N 265.353 2.129 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CCN(C)C2=O)c(Cl)c1 723197565 FRXUMFSHDWWJAG-YGRLFVJLSA-N 295.814 2.287 10 10 CECE COC(=O)[C@@H]1CCCC[C@@H]1NCc1cccc(OC)c1O 824854157 OPOZHKQDYATEOG-OLZOCXBDSA-N 293.363 2.222 10 10 CECE C[C@@H](CC1CC1)NC(=O)/C=C\c1ccc(O)c(O)c1 588406477 FDWAPPRKCHMQLP-BXKUYDPTSA-N 261.321 2.416 10 10 CECE Oc1cc2c(cc1CN[C@H](C(F)F)C1CC1)OCO2 1893194215 CLOJPRCPVDHMKO-LBPRGKRZSA-N 271.263 2.254 10 10 CECE O=C(NCc1c(O)cccc1F)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 923939295 ZRHQZEXDXIXASP-AHMQBVQWSA-N 290.338 2.375 10 10 CECE CC[C@@H](N[C@H]1CCc2nnn(C)c2C1)c1ccccc1O 927144812 JKLLZLZNBDICAE-WCQYABFASA-N 286.379 2.119 10 10 CECE CO[C@H](CNC(=O)OC(C)(C)C)Cc1ccc(N)cc1 1952456031 JIJRMKOJRHQSQB-ZDUSSCGKSA-N 280.368 2.351 10 10 CECE C[C@H](N[C@@H]1C[C@@H](C)n2ncnc21)c1ccccc1O 850499517 QXXCSQYRNQXEQB-JFGNBEQYSA-N 258.325 2.340 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@@]23CCOC3)c(O)c1 1896292416 JSYXHLJXNGIVCK-NZVBXONLSA-N 263.337 2.230 10 10 CECE CCN(C[C@H](COC)OC)c1ccc(OC)c(OC)c1 851827360 DQTZJJZJYQDEDX-CYBMUJFWSA-N 283.368 2.192 10 10 CECE CNC[C@H](COCc1ccccc1)Oc1ccc(N)cc1 1896302414 CAFAETVCEIWDEC-QGZVFWFLSA-N 286.375 2.452 10 10 CECE CC(C)N(C)CCNC(=O)N[C@@H](C)c1ccccc1O 868219079 RQHNWVJVMMVYIS-LBPRGKRZSA-N 279.384 2.093 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)NCCCC1CC1 779518202 JUDGEZDFAIKIJG-SOFGYWHQSA-N 261.321 2.417 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCCS[C@H]1C 94480053 IYKRGSYLUJRYKI-CMPLNLGQSA-N 286.401 2.494 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1[C@@H]2CCCO[C@@H]21 780322825 XBJFTXBJBOPATI-XHSDSOJGSA-N 288.391 2.136 10 10 CECE C[C@@H](NC(=O)c1ncccc1F)c1ccccc1O 1587447505 URHVOYCCSBCOSJ-SECBINFHSA-N 260.268 2.417 10 10 CECE CCC(CC)CNC(=O)[C@H](N)c1ccc(C)cc1O 83479309 GGTBECOYQDJZPL-CQSZACIVSA-N 264.369 2.253 10 10 CECE Oc1ccc([C@H]2NCCc3ccc(O)c(O)c32)cc1F 83621010 RASNEHXQARULDZ-CQSZACIVSA-N 275.279 2.178 10 10 CECE CN(Cc1ccsn1)c1ccc(CO)cc1F 705691135 AELCQYQDIJTWKV-UHFFFAOYSA-N 252.314 2.411 10 10 CECE Nc1ccc(NC(=O)N2CC(OCC(F)(F)F)C2)cc1 707220846 IJOAFBKXWQEQAP-UHFFFAOYSA-N 289.257 2.064 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H]2CCC[C@@H]2O)cc1O 709190246 BCTGBBMHYNNILP-DFBGVHRSSA-N 278.396 2.412 10 10 CECE COc1ccc(O)c(CNC[C@@H]2CCC[C@@H](C)O2)c1 688873190 CLKYOQQPDBQBIK-RISCZKNCSA-N 265.353 2.448 10 10 CECE NCc1cc(F)c(N2C[C@H]3CSC[C@@H]3C2)c(F)c1 711602572 XOCIIPGZUXDOPU-UWVGGRQHSA-N 270.348 2.223 10 10 CECE C[C@@H](NC1CC(CC(N)=O)C1)c1ccc(N(C)C)cc1 718456740 JUGBTAMOIKNVGJ-LKSINWNRSA-N 275.396 2.057 10 10 CECE COc1cc(N)c(N(C)[C@H]2CCC[C@H]2OC)cc1OC 687425282 MLLRJVOUOILBIQ-WCQYABFASA-N 280.368 2.290 10 10 CECE CN1CCCc2cc(CN(C)C(C)(C)C(=O)O)ccc21 86762294 WWSXGMVVHNNQBV-UHFFFAOYSA-N 276.380 2.364 10 10 CECE CCNCc1ccc(N2CC3(COC3)C2)cc1Cl 697097110 BJAMAKSYCCCKLM-UHFFFAOYSA-N 266.772 2.286 10 10 CECE CC(C)[C@@H]1CCCN1C[C@H](O)COc1ccc(N)cc1 88835367 XRCRKPWIFAMSJQ-HOCLYGCPSA-N 278.396 2.129 10 10 CECE C[C@H]1COC[C@@H]1Nc1c(N)cccc1Br 699519409 GTXWOJLSCBTAPE-XVKPBYJWSA-N 271.158 2.478 10 10 CECE COCCN(Cc1cccc(Cl)c1O)[C@H]1CCOC1 787334132 DWNSPBPUYFAEOY-LBPRGKRZSA-N 285.771 2.283 10 10 CECE CON[C@@H](c1ccccc1)c1ccc(O)c(O)c1O 133419694 GLBKUJKTRWJJFA-LBPRGKRZSA-N 261.277 2.044 10 10 CECE [N-]=[N+]=NCCCCN1CCC[C@@H](N2CCCC2=O)C1 2115109884 JHVSYAVQXSQMLQ-GFCCVEGCSA-N 265.361 2.164 10 10 CECE CNCc1ccc(N(C)Cc2cncnc2)cc1Cl 2122274855 CNYKEHWZNUITDM-UHFFFAOYSA-N 276.771 2.486 10 10 CECE CCOC(=O)C(F)(F)CCN1CCC[C@H]1CN=[N+]=[N-] 2123018828 HZKNIBMRCXWCGF-VIFPVBQESA-N 276.287 2.350 10 10 CECE Cc1cc(N2CC[C@H]2[C@@H](C)O)ccc1CNC1CC1 2125825643 YINUGCWHRPPJKS-WBMJQRKESA-N 260.381 2.207 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3C=CCCN3)ccc21 2126015305 RAKIPYXWYLSFHV-GOEBONIOSA-N 258.365 2.021 10 10 CECE O=[N+]([O-])c1cc(N2CC[C@@H]2CC2CC2)ccc1CO 2132058579 QPDVDRKHTVENFG-CYBMUJFWSA-N 262.309 2.466 10 10 CECE CC[C@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)CCS1 2132052921 GQUZBSNSZHMPCN-LBPRGKRZSA-N 282.365 2.419 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C2(CO)CC2)cc1O 2128186644 YBYGQDQPJLNJFN-NSHDSACASA-N 264.369 2.024 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H]4CO[C@@H](C4)C3)ccc21 2128273559 LKSCCZSBJSVFHW-PJODQICGSA-N 258.365 2.248 10 10 CECE O[C@H]1CCCc2cc(N3C[C@H]4OCC[C@@H]4C3)ccc21 2128276959 HSAKFCAEABZPPU-UHOFOFEASA-N 259.349 2.281 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@H]4OCC[C@H]4C3)ccc21 2128308349 CVHWGOVDYIFFIE-APHBMKBZSA-N 258.365 2.248 10 10 CECE Nc1ccc(CCCN2CC[C@@H]3CCO[C@@H]3C2)cc1 2128429515 FCVJKEVAPKOZBG-GDBMZVCRSA-N 260.381 2.312 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3CCO[C@@H]3C2)c(F)c1 2128420922 NIKGGDPXYYRKJQ-JRPNMDOOSA-N 264.344 2.461 10 10 CECE CC[S@@](C)(=O)=NCCN[C@H](C)c1cc(C)ccc1O 2130750502 AKMSFVHTRLDKJW-CWTRNNRKSA-N 284.425 2.469 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3COC[C@@H](C3)C2)c(F)c1 2132519424 JNDVIXKGTHLNSJ-SRVKXCTJSA-N 265.328 2.352 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@H](CN)CC1(C)C 2132470590 FJCOAQPCVFFSED-GHMZBOCLSA-N 264.369 2.218 10 10 CECE C[C@H]1CC[C@H](N(C)C(=O)c2cc(O)c(O)c(O)c2)C1 2132405184 XMCYBKYHVMJLPW-WPRPVWTQSA-N 265.309 2.064 10 10 CECE Cc1nc2c[nH]c(=NCc3ccccc3O)nc2s1 2132649773 XLYKZYOAKXNNTN-UHFFFAOYSA-N 272.333 2.134 10 10 CECE CC(C)CC1(O)CN(c2ccc([C@H](C)N)cc2F)C1 2131838936 KPPRVZHKYCDIDD-NSHDSACASA-N 266.360 2.443 10 10 CECE COCc1nc(CN2CC[C@@H](N=[N+]=[N-])C2)cs1 1912207158 MQLXJJWCNTZSGZ-MRVPVSSYSA-N 253.331 2.174 10 10 CECE Nc1ccc(OCC(=O)OC[C@@H]2CC[C@@H]3C[C@@H]23)cc1 2134521171 UZILOHGXRUHMLP-UHIISALHSA-N 261.321 2.237 10 10 CECE C[C@@H](NC1CC([C@@H](F)CO)C1)c1ccc(F)cc1O 1907309321 DDPCLXREJNLHOR-CGVOHUCKSA-N 271.307 2.291 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H]2C(C)(C)O)c(F)c1 2134635283 USZVFSZVDVKCKS-HZMBPMFUSA-N 266.360 2.456 10 10 CECE CN1CCN(c2ccc(C=CC(=O)O)c(Cl)c2)CC1 1911961500 VGHUUONMWUGPHA-UHFFFAOYSA-N 280.755 2.190 10 10 CECE O=C(O)C=Cc1ccc(N2CCC[C@@H]3COC[C@@H]32)cc1 1911982029 CZTJBGKMKXGOJD-HIFRSBDPSA-N 273.332 2.400 10 10 CECE Cc1csc(NC(=O)CN2CCC(N=[N+]=[N-])CC2)n1 1912193140 MEVGADCKTDBQTA-UHFFFAOYSA-N 280.357 2.165 10 10 CECE [N-]=[N+]=NCC1CCN(C[C@@H]2[C@@H]3CCOC[C@H]32)CC1 1912187109 FKZXQNBWPJDHBB-YNEHKIRRSA-N 250.346 2.291 10 10 CECE CC(C)n1ccnc1CNCc1ccc(O)c(O)c1 1913291129 NVLJYRKJYDMHCE-UHFFFAOYSA-N 261.325 2.165 10 10 CECE CCC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1 107943562 ZKMFZUZACVRHEA-NSHDSACASA-N 261.321 2.263 10 10 CECE CC[C@H]1CN(c2ccc([C@@H](C)NC)cc2)CCN1C 110723614 ATBQNFWUYZMGHI-HIFRSBDPSA-N 261.413 2.497 10 10 CECE Cc1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)nc1 1469396696 WJVZBZSMYINNDI-QPJJXVBHSA-N 284.315 2.131 10 10 CECE CCc1conc1CN[C@@H](C)c1ccc(O)cc1O 2136050114 AGKGAKFCHZAQDX-VIFPVBQESA-N 262.309 2.499 10 10 CECE CCOc1ccc(NC(=O)c2ccc(O)c(O)c2)cn1 227039111 VPUBXAGHQSHEQC-UHFFFAOYSA-N 274.276 2.144 10 10 CECE Cc1ccc(O)c(CNC(=O)/C=C\c2nccs2)c1 1629740298 DQZPJXZBTQPDLP-PLNGDYQASA-N 274.345 2.487 10 10 CECE Nc1cc2c(cc1N1CC3(CC=CC3)C1)OCCO2 1925238069 YYZRZISWGKNADC-UHFFFAOYSA-N 258.321 2.196 10 10 CECE C[C@H]1CC/C(=C\C(=O)NCc2cc(O)ccc2O)C1 1637126194 NRVJQWZZSIJHLZ-VUBLIPMDSA-N 261.321 2.460 10 10 CECE CC1(C)CC[C@H](O)[C@@H](CNCc2ccc(O)cc2O)C1 1927051202 OFMYTCZVYXHDSY-OCCSQVGLSA-N 279.380 2.375 10 10 CECE COc1ccc(CN[C@H](C)CNC(=O)C2(C)CC2)cc1C 1567019244 QFVAGSLQWWKVMC-CYBMUJFWSA-N 290.407 2.398 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H](CN)CC(C)(C)C 231146310 IZTIRRWNJFKEQE-ZDUSSCGKSA-N 278.396 2.362 10 10 CECE CCn1ncnc1CN1CCc2cc([C@@H](C)NC)ccc21 162129463 UBNTUGZRDSDIMA-GFCCVEGCSA-N 285.395 2.141 10 10 CECE COc1cc(N(C)[C@H]2CCO[C@H](C)C2)ccc1CO 2139684608 AUGZSMMGTMWFCZ-RISCZKNCSA-N 265.353 2.191 10 10 CECE Cc1ccc(CN2CC[C@]3(CCCNC3)C2)c(O)c1 2139775785 PRHJQFQUGPJTIU-INIZCTEOSA-N 260.381 2.276 10 10 CECE N[C@H]1CCN(Cc2ccc(F)cc2O)CCC1(F)F 2139769051 LOLQPSROIGDWTN-LBPRGKRZSA-N 274.286 2.090 10 10 CECE COc1cc(CNC(=O)Cc2ccc(N)cc2)ccc1C 152854728 DDILXQKTEVLBNF-UHFFFAOYSA-N 284.359 2.445 10 10 CECE CCc1cnccc1C(=O)NCCc1ccc(O)c(O)c1 157832795 HSJARIDVEGXVSU-UHFFFAOYSA-N 286.331 2.028 10 10 CECE COc1ccc(N(C)C[C@@H](CO)C(C)C)c(OC)c1 258922894 HAAKVKMPFDSBIF-LBPRGKRZSA-N 267.369 2.405 10 10 CECE Cc1cc2c(cc1N(C)C[C@H](C)CCN)OCO2 259008560 XJZNBJQMDSMQMO-SNVBAGLBSA-N 250.342 2.145 10 10 CECE CNCc1ccc(N2CCC[C@@H](O)C2)cc1Br 234439681 FEJJDNHDVBDZHD-GFCCVEGCSA-N 299.212 2.130 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2COC[C@@H](C1)C2(F)F 1237492475 QVPUDLATCNQTRF-TXEJJXNPSA-N 283.318 2.414 10 10 CECE COC[C@@H]1CC[C@H]1NCc1ccc2c(c1)CCN2C 2142417513 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10 10 CECE Oc1cccc(F)c1CNC[C@@H]1CCCC[C@H]1O 1964579928 SXZJTWVVEQZHKZ-GXFFZTMASA-N 253.317 2.172 10 10 CECE CN1CCc2cc(CN(C)[C@@H]3CCC[C@H]3CN)ccc21 250371522 IUTGAHJHCRXZQW-JKSUJKDBSA-N 273.424 2.238 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@H](N)C1CC1 137339493 RDCJHIGKQFAQMJ-MFKMUULPSA-N 262.353 2.039 10 10 CECE C[C@H](N[C@H]1CC[C@@H](C(=O)O)CC1)c1cc(O)ccc1O 2144494652 MABMFIGKGMIHEM-GARJFASQSA-N 279.336 2.392 10 10 CECE C[C@H](NC[C@@H]1COCC(C)(C)O1)c1ccc(F)cc1O 1967468916 DRHFQZDEISEWST-CMPLNLGQSA-N 283.343 2.376 10 10 CECE CNC(=O)[C@@H]1CCCCN1[C@H](C)c1cc(F)ccc1O 251745798 PZLUYAAJQSTMDW-MFKMUULPSA-N 280.343 2.193 10 10 CECE COc1cccc(CN2CC[C@@H](CCN)C[C@H]2C)c1O 2148111486 YVGGKAQJTRJHNT-CHWSQXEVSA-N 278.396 2.350 10 10 CECE N[C@H](c1ccccc1O)[C@]1(O)CCCc2cccnc21 2148161267 LOFLDCGNUCNEDZ-GDBMZVCRSA-N 270.332 2.011 10 10 CECE COc1cc(Cl)cc(CN2CC[C@H](C(=O)O)[C@H]2C)c1O 252873470 VPEJQVSTTHKHBG-KCJUWKMLSA-N 299.754 2.349 10 10 CECE Oc1ccc(Cl)cc1CN1CCN[C@@H](CC(F)F)C1 1972766503 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SYZYOKOZRAFDGX-UHFFFAOYSA-N 278.396 2.396 10 10 CECE O[C@@H]1CCc2cc(N3CCC4(CC[C@H]4O)CC3)ccc21 2187420886 AGNWWZXQBFVJPU-HZPDHXFCSA-N 273.376 2.408 10 10 CECE CC1(C)CC(COC[C@@H](O)COc2ccc(N)cc2)C1 2192294688 ZWPVJSVZAMJSEG-CQSZACIVSA-N 279.380 2.461 10 10 CECE COC1(OC)CCN(c2ccc(CN)c(F)c2F)CC1 2187693407 PNQKEMDOZIWRRV-UHFFFAOYSA-N 286.322 2.013 10 10 CECE C[C@H](O)c1cc(F)c(N(C)CC(C)(C)O)c(F)c1 2074084148 VCVSAWQRZAGMEW-QMMMGPOBSA-N 259.296 2.225 10 10 CECE CC(C)COC1CN(c2ccc([C@@H](C)N)c(O)c2)C1 2102488885 CYUSYASZZTZSNE-LLVKDONJSA-N 264.369 2.273 10 10 CECE CC(C)OC1CN(CCCOc2ccc(N)cc2)C1 2102486227 KQWYFFKIHOPMKS-UHFFFAOYSA-N 264.369 2.147 10 10 CECE CCN1CCN(c2ccc([C@@H](C)O)c(Cl)c2)CC1=O 2102558855 MYFKLVJZQLVUCQ-SNVBAGLBSA-N 282.771 2.062 10 10 CECE COc1cc(N2C[C@H](C)S[C@H](C)C2)ccc1CN 2084006873 XRUJWSLQVKZUPU-PHIMTYICSA-N 266.410 2.484 10 10 CECE C[C@@H]1CC[C@H](C(=O)O)CN1Cc1c(O)cccc1F 2104510561 JIJJDRULETVFQD-ZJUUUORDSA-N 267.300 2.216 10 10 CECE C[C@@]1(C(F)(F)F)C[C@H]1NC(=O)Cc1ccc(N)cc1 2105438433 GGMJFDPCZJBLRR-ZYHUDNBSSA-N 272.270 2.268 10 10 CECE C[C@]1(C(F)(F)F)C[C@@H]1C(=O)NCc1ccc(N)cc1 2105509859 DXWLIWURMNDQFZ-PWSUYJOCSA-N 272.270 2.474 10 10 CECE CN1CCc2cc([C@H](O)[C@]3(C)CCC[C@@H]3N)ccc21 2106790240 GKPDVGSPTUYQQG-HRCADAONSA-N 260.381 2.230 10 10 CECE CN1CCc2cc([C@@]3(O)CC[C@H]4CC[C@H]3O4)ccc21 2106791344 QYNBRFZHLJBUMR-BMFZPTHFSA-N 259.349 2.208 10 10 CECE CN1CCCc2cc([C@]3(O)CCC[C@@H](N)C3)ccc21 2106830647 IMMCABYLNXFOJB-ZBFHGGJFSA-N 260.381 2.158 10 10 CECE CC[C@@]1([C@H](NN)c2ccc(N(C)C)cc2)CCCO1 2106829163 UEARUIQDGQAWCS-CABCVRRESA-N 263.385 2.216 10 10 CECE NC[C@@H]1C[C@@H]2CCC[C@@H]2N1c1ccc2c(c1)CCO2 2108548508 MCLWHGFPCDDJKN-CQDKDKBSSA-N 258.365 2.328 10 10 CECE CCN(C(=O)[C@H]1CCCOCC1)c1ccc(N)cc1 2089071797 XFRXUUXENQLYND-LBPRGKRZSA-N 262.353 2.438 10 10 CECE CO[C@H]1C[C@@H](OC)CN(c2ccc(CO)cc2Cl)C1 2109203207 SHWRWCIFFAGDRA-TXEJJXNPSA-N 285.771 2.072 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)C2(CF)CCC2)cc1 2110197697 FFIJWMXXBICYSM-UONOGXRCSA-N 266.360 2.253 10 10 CECE CC[C@@H](CS(C)(=O)=O)N[C@H](C)c1cc(F)ccc1O 2090093711 GJCHDEYKPIOHBG-KOLCDFICSA-N 289.372 2.005 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H](CO)C3CC3)ccc21 2110682784 MTWPYFUXGGTAPF-HOCLYGCPSA-N 260.381 2.087 10 10 CECE Nc1ccc(CCC(=O)Nc2ncccc2F)cc1 2090508401 DYFFMLSHFWRSQQ-UHFFFAOYSA-N 259.284 2.374 10 10 CECE Cn1cnc(Cl)c1CNCc1cc(F)cc(F)c1O 2111847257 CNUIOLPTGXUTGN-UHFFFAOYSA-N 287.697 2.347 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](COC)[C@@H]3C2)cc1 2093140101 JYRMASFMXMQFBJ-XHSDSOJGSA-N 260.381 2.125 10 10 CECE C[C@H]1CC[C@H](C(=O)NCCOc2ccc(N)cc2)C1 2094428976 NRSWWWHHMVUIGQ-RYUDHWBXSA-N 262.353 2.200 10 10 CECE COc1ccc2c(c1)NC(=O)CN2CCC(F)(F)F 2096537809 FFYVUCLRZCQUNC-UHFFFAOYSA-N 274.242 2.406 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC2(CCC[C@@H]2N)C1 2098261608 VGJBGQDEJCAWSW-YGRLFVJLSA-N 264.344 2.406 10 10 CECE COCCNCc1ccc(N2C[C@H](O)C2(C)C)cc1Cl 2201312384 ZZYWEVFZSISHEH-AWEZNQCLSA-N 298.814 2.036 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(F)c2)C[C@@H]1N(C)C 2114132409 YXXKGTLUSHWAMN-ABAIWWIYSA-N 265.376 2.061 10 10 CECE CCN(C)[C@@H]1CCCN(c2ccc(CO)c(C)c2)C1 2114840563 SKBUGPSWHIRJON-MRXNPFEDSA-N 262.397 2.408 10 10 CECE CO[C@H]1CCN(c2ccc(CO)cc2Cl)C[C@]1(C)OC 2201530114 FRGOZLHUEHLEOC-GJZGRUSLSA-N 299.798 2.463 10 10 CECE COc1cc(N2CC[C@H](O)[C@H]2C)ccc1CNC(C)C 2204541059 HCHRLMKXQZLGQU-DOMZBBRYSA-N 278.396 2.153 10 10 CECE Cc1cccc(CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1O 2204608032 BJMJNEKJZCYDRH-BETUJISGSA-N 273.332 2.376 10 10 CECE Cc1cccc(CNC(=O)C[C@@H]2CC[C@H](CN)C2)c1O 2204624696 VHKRHCGKZDEHHU-OLZOCXBDSA-N 276.380 2.082 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@]1(C)CC(=O)N1 2206201046 UTAUTWNYDXRESO-GDLVEWKHSA-N 274.364 2.117 10 10 CECE C[C@@H](O)c1ccc(N2CCC(OCCCO)CC2)cc1 2207520660 ZAZYLUSRQDZWBF-CYBMUJFWSA-N 279.380 2.108 10 10 CECE CO[C@@H](CNCc1ccc(N(C)C)cc1)CSC 2218736010 UJKIVDOBFUSWIC-AWEZNQCLSA-N 268.426 2.220 10 10 CECE CO[C@@H]1CC[C@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2218739074 DISMKOVKEAAQCX-ZDCRXTMVSA-N 252.318 2.149 10 10 CECE OC[C@@H]1CCN(c2ccc(OCC(F)F)cc2)C1 2219563708 VWPRSAQFUWEYCP-SNVBAGLBSA-N 257.280 2.149 10 10 CECE CC[C@@]1(C)CN(c2ccc(OC)cc2F)CCN1 2220312087 GRSKQXOIOYLLDG-AWEZNQCLSA-N 252.333 2.413 10 10 CECE OCc1ccc(N2C[C@H]3CCCC[C@@]3(CO)C2)cc1 2230620251 DRNSJUHUOWYHFY-ZBFHGGJFSA-N 261.365 2.168 10 10 CECE CCn1ncc(N)c1N(C)[C@H](C)c1ccccc1O 2231864462 BTDVGRSLGTWVQF-SNVBAGLBSA-N 260.341 2.388 10 10 CECE CNCc1ccc(N2C[C@H](O)CC23CCCC3)cc1 2232245283 GNXWVBWPECQZGA-OAHLLOKOSA-N 260.381 2.290 10 10 CECE Cc1nn(C)c(CNCc2ccc(O)cc2O)c1Cl 2232212213 KAGGQOLSFZBTLD-UHFFFAOYSA-N 281.743 2.083 10 10 CECE CC[C@H](NC[C@H](C1CC1)S(C)(=O)=O)c1ccccc1O 2232822849 DQBJDWNOVWGDGT-DZGCQCFKSA-N 297.420 2.256 10 10 CECE CC[C@H](C)NCc1ccc(N(C)CCCO)cc1 2223527893 AGNWUXXVPPXEBQ-ZDUSSCGKSA-N 250.386 2.393 10 10 CECE C[C@]1(O)C[C@H]2[C@@H]1CCN2c1ccc2c(c1)CCC[C@@H]2O 2233826808 OXBLTLUHEZPKMU-QAETUUGQSA-N 273.376 2.406 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)O)cc2C)C[C@@H]1F 2223976927 FZNXOVMHUSYPPJ-JKOKRWQUSA-N 253.317 2.221 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1CCCCC[C@@H]1C(=O)O 2234165328 BDXYPZRLGMMGPP-QWRGUYRKSA-N 282.344 2.474 10 10 CECE CN1CCc2cc(N3CCC[C@]4(CC[C@H]4O)C3)ccc21 2235127193 PMAJOMNRYOGOBZ-SJORKVTESA-N 272.392 2.420 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1cnn(C2CC2)c1 2225792145 KJSWBFFJKLWCNJ-WDEREUQCSA-N 260.301 2.179 10 10 CECE CC[C@](C)(CC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-])C(=O)O 2225795893 RJGOBEBJWUBOCC-KBVBSXBZSA-N 268.317 2.225 10 10 CECE COc1ccc(N(C)[C@H]2CCOC[C@H]2C)c(C(=O)O)c1 2235958179 MGSJMNQKEJZFTC-MFKMUULPSA-N 279.336 2.255 10 10 CECE COc1ccc(N(C)C[C@@H]2CC(C)(C)CO2)c(CN)c1 2235969901 KFKZPBWOFRDGEY-AWEZNQCLSA-N 278.396 2.405 10 10 CECE CCCNCc1cc(OC)ccc1N1CCO[C@H](C)C1 2235953455 BAMAPIAHHHHEAW-CYBMUJFWSA-N 278.396 2.420 10 10 CECE COc1ccc(N(C)Cc2cnco2)c(C[C@@H](C)N)c1 2235969873 JUMZHETWOHNPID-LLVKDONJSA-N 275.352 2.209 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CC[C@@H]3C[C@@H]3C)ccc21 2236507900 ILHJVUMZQFSIQG-RWSFTLGLSA-N 273.380 2.382 10 10 CECE COc1ccc(N2CC[C@@H](C(F)(F)CO)C2)cc1C 2226858787 PKJZHLQBHGNIQQ-LLVKDONJSA-N 271.307 2.458 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2C[C@H](O)P(C)(C)=O 2237212662 WZCOPQCCCMMUBZ-IAQYHMDHSA-N 296.351 2.400 10 10 CECE CCN1CCc2cc(C3(O)CC(N)(CSC)C3)ccc21 2238928154 KJAYWEFFUFYFNH-UHFFFAOYSA-N 292.448 2.111 10 10 CECE CN[C@H](c1ccccc1O)[C@](C)(O)c1scnc1C 2229620828 GXMLCSKRKNNYDU-OCCSQVGLSA-N 278.377 2.325 10 10 CECE CCNCc1ccc(N2CC[C@H](C)[C@H]2CO)cc1C 299946969 BGCFAHUOUDMCAK-BLLLJJGKSA-N 262.397 2.312 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@@H](C)O[C@H](CCO)C1 2240831482 XOCBPVXZYOAIGO-UMVBOHGHSA-N 279.380 2.024 10 10 CECE CC[C@@]1(C)CN(Cc2cnc(SC)s2)CCN1 2248693897 SXCCALVOEMLQGO-LBPRGKRZSA-N 271.455 2.439 10 10 CECE COc1ccc(N(C)Cc2ccnnc2C)c(N)c1 2274307178 ZJGCGXXEMMNHQF-UHFFFAOYSA-N 258.325 2.012 10 10 CECE Cc1cccc(O)c1CNC[C@@H](C)Cc1cn[nH]c1 2274637950 IFVKMPWDXSOJOW-NSHDSACASA-N 259.353 2.392 10 10 CECE O[C@H]1C[C@H]2CC[C@@H]([C@H]1F)N2c1ccc(OCF)cc1 2278511630 VKHGHNFKIAETBJ-VZZFWQQMSA-N 269.291 2.433 10 10 CECE Nc1ccc(C[C@H](O)c2ccn(CC(F)F)n2)cc1 2278638151 UFQXXAYRXZBEKG-LBPRGKRZSA-N 267.279 2.007 10 10 CECE Cc1cc(N2CC(O)(C(F)(F)F)C2)ccc1[C@H](C)O 2269688987 NJFLKNSIOOPNJW-VIFPVBQESA-N 275.270 2.162 10 10 CECE Cc1nnccc1CN1CCc2cc([C@H](C)N)ccc21 2290102782 UQHVMVZSGYLQTD-NSHDSACASA-N 268.364 2.367 10 10 CECE COC(=O)N[C@H](C)CN[C@H](C)c1ccc(N(C)C)cc1 2290365591 ODVQKEJPWDWHQF-VXGBXAGGSA-N 279.384 2.148 10 10 CECE OC[C@]1(NCc2cc(F)cc(F)c2O)C[C@H]2CC[C@H]1C2 2283866075 IEIVHTJOYGKFFC-CCUNJIBTSA-N 283.318 2.311 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)c2ccn(C(F)(F)F)n2)C1 2295233942 GMQHJTJARVYSCG-SSDOTTSWSA-N 288.233 2.132 10 10 CECE Cc1cc(N(C)CCS(=O)(=O)C(C)C)ccc1[C@H](C)N 2285122209 QNEPBBZHAYJUTJ-ZDUSSCGKSA-N 298.452 2.274 10 10 CECE CCN(c1ccc([C@@H](C)N)c(C)c1)[C@H]1CCS(=O)(=O)C1 2285123422 DXZAWCCETZQHEN-OCCSQVGLSA-N 296.436 2.028 10 10 CECE CCN(CC(=O)N(C)C)c1ccc([C@H](C)NC)c(C)c1 2285138838 ZZPCFKXJWVAJGI-ZDUSSCGKSA-N 277.412 2.190 10 10 CECE Cc1cc(N2C[C@H](C)NC(=O)C2(C)C)ccc1[C@@H](C)N 2285145697 HHEHDDZWIZNJHE-NWDGAFQWSA-N 275.396 2.118 10 10 CECE Cc1cc(N(CCS(C)(=O)=O)C(C)C)ccc1[C@@H](C)N 2285127808 LAFRZVJOQLXEHY-CYBMUJFWSA-N 298.452 2.274 10 10 CECE Cc1ccc(CNC[C@H](C)Cc2cnn(C)c2)c(O)c1 2295514616 KZASRYSMPYVVRH-CYBMUJFWSA-N 273.380 2.403 10 10 CECE CN(Cc1ccccc1O)c1ccc2c(n1)CC[C@H]2N 2286102164 PNRJEYISADMMPU-CYBMUJFWSA-N 269.348 2.370 10 10 CECE CCOCCN(CCOCC)Cc1c(O)cccc1F 1137839128 SKYPKEWUYZQWFZ-UHFFFAOYSA-N 285.359 2.406 10 10 CECE CC(C)[C@@H](CO)N(C)c1cc(Cl)c(CN)cc1F 2318781493 HCRIGQGXYQGAHR-CYBMUJFWSA-N 274.767 2.391 10 10 CECE CN1CC[C@@H](CNCc2ccc3c(c2)CCCN3C)C1 50286681 ZEOUCLINOLYVIZ-HNNXBMFYSA-N 273.424 2.110 10 10 CECE Oc1cccc(F)c1CNC[C@H]1C[C@@H]2CC[C@H]1O2 2309346322 MPHRTFCJGKKHMJ-ISTVAULSSA-N 251.301 2.188 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)c1ccc(OC)s1 2315992958 UTYSVWWWUVZBRD-UHFFFAOYSA-N 290.370 2.078 10 10 CECE CCC1=NN(C)C(=O)C1=Cc1cc(OC)ccc1OC 2332114767 OKJBPFNUUKKQRD-UHFFFAOYSA-N 274.320 2.325 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1C[C@H]2[C@H]3CC[C@H](O3)[C@H]21 2331777831 CAVVFNSVWYUDQO-CQJMVSDSSA-N 258.365 2.267 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@H]2C[C@H]1C[C@H](N)C2 2332112525 SDYKCPNQWDOHHK-DJIHRAIXSA-N 264.344 2.404 10 10 CECE C[C@@H]([C@H]1C[C@@H]2CCO[C@@H]21)N(C)c1ccc(CN)cc1 2333157361 XLUJBFBBZIJAAK-YUDUHTQSSA-N 260.381 2.395 10 10 CECE C[C@@H](N[C@H]1CC[C@@H]2C[C@H]1CO2)c1ccc(O)cc1O 2334122069 DKPZBPREACNWHY-JCRCQARHSA-N 263.337 2.316 10 10 CECE O=C(NC[C@@H]1C[C@@H]2CC[C@H]1C2)c1cccc(O)c1O 2334291000 DVKDPEQCMOMZIF-VWYCJHECSA-N 261.321 2.264 10 10 CECE C[C@H](NC[C@]1(C)CC=CCO1)c1c(O)cccc1O 2340200683 NINQHQDIHJJLFQ-NHYWBVRUSA-N 263.337 2.484 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H](C)[C@H](CO)C2)c1C 2340862841 ZZDGDGRTHQDDHS-SWHYSGLUSA-N 262.397 2.388 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]2C[C@@H]3N(C)C)ccc1CO 2340992726 QWECBTJZRAFMIZ-BPUTZDHNSA-N 260.381 2.016 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC([C@H](F)CO)C2)c1C 2341065331 RCDITALBINEFLY-SMDDNHRTSA-N 266.360 2.090 10 10 CECE CC(C)[C@@H](CO)N(C)c1ccc2c(c1)CCC[C@@H]2N 2341384268 KTAQOOKBCPKGAX-JKSUJKDBSA-N 262.397 2.476 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1C[C@H]2C[C@@H]1C2 2341995395 HBSSURXCVIHRFA-KXNHARMFSA-N 266.345 2.254 10 10 CECE CCN1CCc2cc([C@H](NN)[C@H]3C[C@H](F)C3)ccc21 2352519398 VOYNLDAFGCDTRV-YDHLFZDLSA-N 263.360 2.322 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@H]2COC[C@H]2OC)c(Cl)c1 2355628388 RJAUQNISIQGWOM-COLVAYQJSA-N 298.814 2.470 10 10 CECE COc1ccc([C@@H](C)NC[C@H]2C[C@@H]3C[C@@H]3CO2)c(O)c1 2355827996 OGKLPIQUKTVUQD-GFQSEFKGSA-N 277.364 2.476 10 10 CECE COc1cc(N2[C@@H]3CC[C@@H]2CC(=O)C3)cc(OC)c1OC 108032820 WIXDZTVKSGSRQU-GHMZBOCLSA-N 291.347 2.413 10 10 CECE C[C@H]1CCC[C@H](S(=O)(=O)NCc2ccccc2O)C1 407298640 KAPWZTRNLITAKQ-AAEUAGOBSA-N 283.393 2.390 10 10 CECE CCNC(=O)CN(C)c1ccc(CNCC(C)C)c(C)c1 62737470 UJHJZJCIOFLVAP-UHFFFAOYSA-N 291.439 2.313 10 10 CECE COc1ccc(O)c([C@H](C)N(C)CCCC(=O)O)c1 86802137 BICKIDVIWUPQAD-JTQLQIEISA-N 267.325 2.258 10 10 CECE COc1ccc(CN2CCC[C@@H](CCC(=O)O)C2)c(O)c1 86809148 VBKICEKJTOWVMV-LBPRGKRZSA-N 293.363 2.478 10 10 CECE [N-]=[N+]=NCCNC(=O)c1ccc(OC(F)F)cc1 42012268 CFRBMVXTNSLCTB-UHFFFAOYSA-N 256.212 2.328 10 10 CECE CN(Cc1ccccc1O)C(=O)COc1ccccc1N 40331939 HBYXZVKEEZWKRJ-UHFFFAOYSA-N 286.331 2.012 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCC[C@@H]3CNC[C@@H]32)c1 221316491 NTPMOEWSAZCFLA-NFAWXSAZSA-N 260.381 2.445 10 10 CECE Nc1ccc(OCCC(=O)OCC(F)(F)F)cc1 41100754 XRYMWPHTNVRWMF-UHFFFAOYSA-N 263.215 2.143 10 10 CECE COc1ccc(CNCC2C[C@@H]3CC[C@H](C2)N3C)c(O)c1 40906799 MMLXANWAVRHUAV-LQDVMPOASA-N 290.407 2.363 10 10 CECE CCN[C@](C)(CCCSc1nccs1)C(=O)O 45596060 AORVQYSGAZTVLC-LLVKDONJSA-N 274.411 2.468 10 10 CECE C[C@H]1C[C@@H](N(CC(N)=O)Cc2ccc(N)cc2)CC[C@H]1C 85027181 GVKUDRMXYDTFLM-WWGRRREGSA-N 289.423 2.381 10 10 CECE C[C@@](NCCN=[N+]=[N-])(C(=O)O)c1c(F)cccc1F 90256456 LDLBROHANRMLHT-NSHDSACASA-N 270.239 2.165 10 10 CECE Cc1cc(O)c([C@@H](N)[C@@H](C)O)c(C)c1Br 95712142 XBTIIZKNWIYCFJ-HQJQHLMTSA-N 274.158 2.152 10 10 CECE CN(C)CCN(C)c1ccc(/C=C/C(=O)O)c(Cl)c1 234225790 NNVLFORLMIBIKB-FNORWQNLSA-N 282.771 2.436 10 10 CECE NC1(c2cc(O)c(O)c(Br)c2)CCC1 258282756 ASJZLNOOGBSYFB-UHFFFAOYSA-N 258.115 2.198 10 10 CECE Cc1cc(N2C[C@@H](CO)OC[C@H]2C)ccc1CNC(C)C 251047462 QOHKQCZCDNUSHZ-PBHICJAKSA-N 292.423 2.079 10 10 CECE O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cc(Cl)ccc1O 250751392 KUIFEXFAMIKYBG-GRYCIOLGSA-N 281.739 2.483 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCNC12CCC2 530179186 QIVBPNSKKSYMAU-LBPRGKRZSA-N 266.772 2.420 10 10 CECE CN(C)C1CN(c2ccc(/C=C/C(=O)O)c(Cl)c2)C1 382730696 KHEXPQFRTGNZNW-GQCTYLIASA-N 280.755 2.188 10 10 CECE COc1cc(N2CC[C@H]3C[C@H]32)c([N+](=O)[O-])cc1OC 804688764 SELGPPIXZZNTQW-DTWKUNHWSA-N 264.281 2.211 10 10 CECE Oc1c(Cl)cccc1CNC1[C@H]2CC3C[C@H]1CN(C3)C2 2164468514 YVAPFJDZNAYUNG-YXRRJCKBSA-N 292.810 2.475 10 10 CECE COc1ccc(CNCC2CC3(CC(O)C3)C2)c(O)c1 2164528221 NZJBJDKQCFDWGA-UHFFFAOYSA-N 277.364 2.042 10 10 CECE Nc1ccc(OCCNc2cn3c(n2)CCCC3)cc1 2162484950 RHKQQWZOOLJMGM-UHFFFAOYSA-N 272.352 2.293 10 10 CECE COC(=O)c1cccc(N)c1NC1CCC(CO)CC1 2165036505 KLYDTBXKDQAWNK-UHFFFAOYSA-N 278.352 2.018 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](CN)C3)c(OC)c1 2162634399 FXAVPHANXFXKTD-XYYAHUGASA-N 276.380 2.410 10 10 CECE CN1CCCc2cc(N3C[C@H](N)[C@H](C(F)F)C3)ccc21 2163094982 QEOGJINZQWFYIE-OLZOCXBDSA-N 281.350 2.098 10 10 CECE NN[C@H](C[C@H]1CCOC1)c1ccc(N2CCCC2)cc1 2163104115 BCJKUCAWFZRRDM-CZUORRHYSA-N 275.396 2.218 10 10 CECE CO[C@H](C)[C@H](N)C[C@H](O)c1ccc(N2CCCC2)cc1 2165784929 MRHKUFAMJHMOGJ-WQVCFCJDSA-N 278.396 2.073 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)Cc1ccc(OC)cc1O 2163624564 OTCQETHMDRUSMV-WFASDCNBSA-N 278.396 2.221 10 10 CECE Nc1ccc(CCN2Cc3ccc(CO)cc3C2)cc1 2167511203 CXWDCLPUUIIEJE-UHFFFAOYSA-N 268.360 2.319 10 10 CECE CCc1nsc([C@@H](NC)c2ccc3c(c2)CCN3C)n1 2164139527 CNCQFAZRHCVFNS-AWEZNQCLSA-N 288.420 2.402 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H](N)[C@H](C(F)(F)F)C1 720911049 NCTGWRSTWOSGDB-FBIMIBRVSA-N 274.286 2.275 10 10 CECE CCN(C)CCCN1CCCc2cc(CN)ccc21 2129784661 MQXWVOYFQXUNMV-UHFFFAOYSA-N 261.413 2.240 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](C)C(O)[C@H](C)C2)c1 827151444 BEHKENYUCFGNEH-VXGBXAGGSA-N 279.380 2.240 10 10 CECE CC1CCN(CCN(C)c2ccc(CN)cc2)CC1 723462330 FZFRNIPKMXNZJA-UHFFFAOYSA-N 261.413 2.313 10 10 CECE Cc1cc(O)c(CN(C)Cc2cn(C)nn2)c(Cl)c1 827304931 JXMPKPPWVYGWOQ-UHFFFAOYSA-N 280.759 2.115 10 10 CECE O=C(COC(=O)c1cc(O)cs1)NC1CCCCC1 731911288 JGGPMDNRLXSHHQ-UHFFFAOYSA-N 283.349 2.059 10 10 CECE COc1cccc(O)c1CN1CCC[C@H]([C@@H]2CCCN2)C1 843045446 QQGVDPCZHGIWMU-ZFWWWQNUSA-N 290.407 2.365 10 10 CECE COc1cccc(CN2CCO[C@]3(CCSC3)C2)c1O 843418385 SMYOFUNBNRASQO-OAHLLOKOSA-N 295.404 2.109 10 10 CECE CO[C@@](C)(CO)CN[C@@H](C)c1cc(Cl)ccc1O 848558230 KHNBMAIDDSPWTJ-TVQRCGJNSA-N 273.760 2.094 10 10 CECE Cc1cc(CCN[C@@H](C)c2ccccc2O)nn1C 926916407 WSNGIARFNSVJGB-LBPRGKRZSA-N 259.353 2.327 10 10 CECE COc1ccc(N2CC[C@H](Nc3nccnc3F)C2)cc1 858621701 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O=[N+]([O-])c1cc(CNc2ccncc2)cc(O)c1O 83443290 CKLBZWPCBTXYMD-UHFFFAOYSA-N 261.237 2.013 10 10 CECE CC(C)(C)c1nnc([C@@H](N)c2cc(F)ccc2O)o1 83481258 WSJMDCSWUQBMAL-JTQLQIEISA-N 265.288 2.260 10 10 CECE N[C@H](c1nnc(-c2cccc(O)c2O)o1)C1CCCC1 83543426 QZOBQYYRHUBMOC-NSHDSACASA-N 275.308 2.338 10 10 CECE O=C(O)C=C1CCN(c2ccc3c(c2)OCCO3)CC1 71616113 UYUDCMAWBRLZHT-UHFFFAOYSA-N 275.304 2.069 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccncc1Br 395943966 LFNGWWJJYOLBNY-UHFFFAOYSA-N 284.117 2.274 10 10 CECE CO[C@H]1CCC[C@@H](OC(=O)COc2ccc(N)cc2)C1 70323037 AICNISWNVJLECJ-UONOGXRCSA-N 279.336 2.148 10 10 CECE Cc1cc(N(C)CC2(C)COC2)ccc1C[C@H](C)N 702953164 GEARSVICKKWFLU-ZDUSSCGKSA-N 262.397 2.357 10 10 CECE CCNCc1ccc(N2CC(n3cccn3)C2)cc1 707669466 QYWXBKFNJWATEX-UHFFFAOYSA-N 256.353 2.054 10 10 CECE C[C@@H]1COC[C@H]1N(C)c1ccc(CO)c(Cl)c1 688209479 RGJPPHZMJAFXES-NOZJJQNGSA-N 255.745 2.303 10 10 CECE CC(C)N(CCCc1ccc(N)cc1)CCN(C)C 708491141 ULGKBSULYVEWFV-UHFFFAOYSA-N 263.429 2.473 10 10 CECE Cc1cc(CNC(C)(C)C)ccc1N1CC[C@@H](O)C1 61711157 SLZIXRIONIDQLF-CQSZACIVSA-N 262.397 2.454 10 10 CECE Oc1cccc(Cl)c1CN1CC2(CCCNC2)C1 709872245 YWCBXWAAWVQLKP-UHFFFAOYSA-N 266.772 2.231 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CCCCCN1 80997041 YSTJTHLARQTLND-TZMCWYRMSA-N 276.380 2.444 10 10 CECE COc1ccc(O)c([C@H](C)NCC[C@@H](O)C(F)F)c1 716697637 GSODKLXGZVHGPX-QPUJVOFHSA-N 275.295 2.068 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)C2CC3(CCC3)C2)C1 717748518 XMAKTQNJYFICOM-JTQLQIEISA-N 284.385 2.424 10 10 CECE Fc1cc(CNC2CC2)ccc1N1C[C@H]2COC[C@H]2C1 718230853 SJYOFIBMUWOPFW-BETUJISGSA-N 276.355 2.160 10 10 CECE Cc1c(C)n(C[C@@H]2COCCO2)c2ccc(CN)cc12 690631490 ZUDIANYSZMPZBN-CQSZACIVSA-N 274.364 2.132 10 10 CECE COc1ccc(N(CCCN)CCCCN(C)C)cc1 690867246 HITYJWFMENHXCB-UHFFFAOYSA-N 279.428 2.192 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)c1ccc(F)cc1 692825427 UCMFVTVQXSVBNQ-SNVBAGLBSA-N 284.316 2.289 10 10 CECE Cc1cc(CN)ccc1N1CC[C@@H](N(C)C)[C@@H](C)C1 693663036 SLDIVMNNIHFRMK-DZGCQCFKSA-N 261.413 2.230 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2CCC23CCCC3)cc1 693850284 RYWCIDLFHWTLTI-CQSZACIVSA-N 274.364 2.487 10 10 CECE C[C@H]1CN(Cc2ccc3c(c2)CCCN3C)[C@@H](C)CN1 86467221 QGNUGNMRCSQXRC-KBPBESRZSA-N 273.424 2.251 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCC(C)(C)C1 94795839 NFRHXLKYJYMPPC-NSHDSACASA-N 261.369 2.328 10 10 CECE C[C@@H](C[S@](C)=O)N(C)Cc1ccc(Cl)cc1O 1462058254 FATIDRYZHFHZBG-XYZCENFISA-N 275.801 2.244 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)Cc2ccccc2)CC1 2117724317 KGRSTJIEJBOQAU-UHFFFAOYSA-N 280.353 2.197 10 10 CECE Cc1cc(NS(=O)(=O)c2ccccc2O)ccc1O 2118181346 FKVJPOQQTMTGCG-UHFFFAOYSA-N 279.317 2.207 10 10 CECE Oc1ccc(Cl)cc1CNC1CC(n2cnnc2)C1 2127664370 IATUCWWASZJWFA-UHFFFAOYSA-N 278.743 2.130 10 10 CECE NCc1ccc(N2CC3(CCC(O)CC3)C2)cc1F 2124670315 CKFAQKGQWMVAFF-UHFFFAOYSA-N 264.344 2.026 10 10 CECE COc1cc(N)c(N2C[C@@H]3CC=CC[C@H]32)cc1OC 2120639348 GJOOMCKMHRTDMD-CMPLNLGQSA-N 260.337 2.441 10 10 CECE CCC[C@H](CO)CN[C@H](C)c1cc(OC)ccc1O 2120746955 DXLKZVAOLRXOKZ-NEPJUHHUSA-N 267.369 2.460 10 10 CECE CN(CCCc1ccc(N)cc1)[C@@H]1COC2CC1C2 2126703544 HBIZKMJFLGJEES-AVVWSFFYSA-N 260.381 2.311 10 10 CECE Nc1cc2c(cc1N1CC[C@@H]3CC[C@@H]3C1)OCCO2 2132009632 XLMUKZYLYZWBHZ-WDEREUQCSA-N 260.337 2.276 10 10 CECE C[C@H]1C[C@H](CO)CCN1c1ccc2c(c1)CC[C@@H]2O 2128319109 ZQQXKCFGHAQUBU-OZVIIMIRSA-N 261.365 2.263 10 10 CECE CCO[C@H]1C=CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128323620 VQNVYROQBLUERV-GOEBONIOSA-N 259.349 2.448 10 10 CECE C[C@@H](O)[C@@H]1CCCCN1c1ccc2c(c1)CC[C@@H]2N 2128317822 HDIQUCLITKXVIL-RLCCDNCMSA-N 260.381 2.372 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CS[C@H](C(F)(F)F)C1 2132708705 RRDCIWYRHBAVHU-XPUUQOCRSA-N 298.290 2.168 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H](N3CCC3)C2)cc1 1912037535 HEBWOQITDUYNQY-HNNXBMFYSA-N 272.348 2.069 10 10 CECE CN(CCCN=[N+]=[N-])[C@H]1CCOC2(CCOCC2)C1 1912190677 HIOBPBLPUPARHP-LBPRGKRZSA-N 268.361 2.347 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(CC(=O)NC2CCCCC2)C1 1912146712 DOCDWWYXWUFPQG-LBPRGKRZSA-N 279.388 2.458 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@H]2CCCC(=O)N2)C1 1912206420 JSMUHVBCWKJTRF-NWDGAFQWSA-N 265.361 2.068 10 10 CECE CO[C@H](C)CN(C)c1ccc(C=CC(=O)O)cc1F 1911908637 VXURNUIMDVWJRW-SNVBAGLBSA-N 267.300 2.395 10 10 CECE CCN(c1ccc(C=CC(=O)O)cc1)[C@H]1CCN(C)C1 1911919088 BPTPGCCHURUOJD-HNNXBMFYSA-N 274.364 2.315 10 10 CECE CSc1ncc(CN[C@H](C)C2CCNCC2)s1 2248708010 MQEIVRUZSRYZGV-SECBINFHSA-N 271.455 2.343 10 10 CECE Nc1ncc(F)cc1OCc1cnn(C(F)(F)F)c1 2135044894 HCVYOSHNYDETAR-UHFFFAOYSA-N 276.193 2.055 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC3(C[C@H]3C(=O)O)C2)c1 1914767639 IZHZQVBNXIHADY-PWSUYJOCSA-N 261.321 2.168 10 10 CECE C[C@H](N)C1CCN([C@@H](C)c2ccc(O)cc2O)CC1 110644047 RJYBGOQGOFZVCJ-QWRGUYRKSA-N 264.369 2.218 10 10 CECE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1[C@H](CO)N=[N+]=[N-] 1535985922 PGPBIQSUZSSLED-CIUDSAMLSA-N 274.296 2.005 10 10 CECE CC[C@@H]1CC[C@H](C)N1C[C@@H](O)COc1ccc(N)cc1 224118495 DESPNXQSTVHTMT-NWANDNLSSA-N 278.396 2.271 10 10 CECE CC1(C)[C@H](O)CN1c1ccc(CNC2CC2)cc1F 2136627194 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CCc1sc(C(=O)O)c(O)c1Br 2080393000 GKBPQWYALPYCBH-UHFFFAOYSA-N 251.101 2.477 10 10 CECE Cc1cccc([C@H](N)[C@@H](O)c2ccc(N(C)C)cc2)n1 2174405530 GLWDBZQCXLVDGM-HOTGVXAUSA-N 271.364 2.189 10 10 CECE Cc1ccc(CN[C@H]2CCc3nccn3C2)c(O)c1 877000941 ZHFMATPNXVDXNZ-ZDUSSCGKSA-N 257.337 2.002 10 10 CECE COC(=O)c1cc(C)nn1Cc1cc(Cl)ccc1O 2069938729 OVWCPBPCFSDPFJ-UHFFFAOYSA-N 280.711 2.385 10 10 CECE Oc1ccc(CNCc2cnn(C(F)(F)F)c2)c(O)c1 2175131604 FOYHQPXKKKHTDL-UHFFFAOYSA-N 287.241 2.060 10 10 CECE C[C@H](N)c1ccc(N(C)CCCn2ccnc2)cc1O 2170116082 FQPUXWIANMDAFO-LBPRGKRZSA-N 274.368 2.135 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1N(C)CCCc1ccc(N)cc1 2170373861 CHPDJJGJLJCKNG-PBHICJAKSA-N 275.440 2.473 10 10 CECE CC[C@H]1CN(Cc2cccc(OC)c2O)C[C@H]1N(C)C 2170469155 ZCMJDIWJZPUGCQ-GXTWGEPZSA-N 278.396 2.173 10 10 CECE C[C@H](O)c1ccc(N2CCS[C@H]3COCC[C@H]32)cc1O 2170501250 AWZFUFJVVFALRQ-ZBINZKHDSA-N 295.404 2.156 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@H]1CC[C@H](C(=O)O)O1 2192598029 LLRUAESOJSIBNQ-JTNHKYCSSA-N 279.336 2.017 10 10 CECE C[C@H](c1ccccc1O)N(C)c1nccnc1C(=O)O 2192592006 NWFWGRSLLNSSLU-SECBINFHSA-N 273.292 2.078 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cc(N(C)C)ncn1 2192600933 SGMFXHMGBWUMCV-NSHDSACASA-N 272.352 2.446 10 10 CECE C[C@H](Nc1cc(N)c([N+](=O)[O-])cn1)c1ccccc1O 2192621837 HDIHSPPPHIIOQH-QMMMGPOBSA-N 274.280 2.451 10 10 CECE CC(C)[C@H]1CNC(=O)CN1c1ccc([C@H](C)N)cc1Cl 2181163482 SNTLQXYTJLTBQQ-IINYFYTJSA-N 295.814 2.321 10 10 CECE C[C@H](c1ccccc1O)N1C[C@H]2C[C@H]1CN2CC(F)F 2188347310 DWOZPYJALVVWPC-UTUOFQBUSA-N 282.334 2.477 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@@H]1CCC(=O)N(C)C1 2188464464 RVIXJXNRUOEVHX-CMPLNLGQSA-N 280.343 2.145 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])C1C[C@@H](C)O[C@H](C)C1 2181520494 DOJUVLFHFGDUSY-CKYFFXLPSA-N 284.360 2.022 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCCC12CC2 1648390372 VKXATPIOIGNTBE-LBPRGKRZSA-N 275.348 2.337 10 10 CECE CCC(=O)N1CCN(c2ccc(CNC)c(Cl)c2)CC1 2182603221 AJBNPSNFQXLPFD-UHFFFAOYSA-N 295.814 2.118 10 10 CECE Cc1cccc(O)c1CNC[C@@H]1CC2(CCOCC2)O1 2189482743 IATHHFDUGDSULU-ZDUSSCGKSA-N 277.364 2.128 10 10 CECE C[C@@H](NCc1ccnn1C1CC1)c1c(O)cccc1O 2194145150 MIHXQOSHHVISSF-SNVBAGLBSA-N 273.336 2.480 10 10 CECE CCNCc1ccc(N2CC[C@H](O)[C@@H]3CC[C@H]32)c(C)c1 2190250062 OVYCUWQIUIVHRA-OIISXLGYSA-N 274.408 2.454 10 10 CECE OC[C@H]1[C@H]2CN(c3ccc4c(c3)CCC[C@@H]4O)CC[C@H]21 2184689117 KZRWXIQRBSLVAJ-TWMKSMIVSA-N 273.376 2.121 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@@H]4COC[C@@H]4C3)ccc21 2184693269 OVYMMUSULVATOY-JKIFEVAISA-N 272.392 2.495 10 10 CECE CN(C)c1ccc([C@@H]2N[C@@](C)(C(F)F)CO2)cc1 2043151981 WWGLUBWAEOBGTP-DGCLKSJQSA-N 256.296 2.395 10 10 CECE COc1ccc(N(C)C[C@H]2CCCNC2)c(F)c1 2044282907 CMSHRFKVGIREND-NSHDSACASA-N 252.333 2.270 10 10 CECE CCCNCc1ccc(N2C[C@H]3C[C@H](O)C[C@H]3C2)cc1 2185193888 KZRVZDUCCXERFN-QLPKVWCKSA-N 274.408 2.393 10 10 CECE C[C@@H]1CC[C@H](CC(=O)NCC2(CN=[N+]=[N-])CC2)O1 2054034770 ZMKWVFCILJWODR-NXEZZACHSA-N 252.318 2.151 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)[C@H]1CCCC[C@@H]1F 2055325110 MDVMAXRGLWIAKI-UWVGGRQHSA-N 278.353 2.277 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@@H](O)CC23CCC3)c(F)c1 2194708854 KTCZWIDWUARRMH-KOLCDFICSA-N 282.334 2.478 10 10 CECE C[C@H]1CCC[C@@H]1S(=O)(=O)N1CCC[C@H]1CN=[N+]=[N-] 2059050798 KRCYKAGYPWEZNZ-DCAQKATOSA-N 272.374 2.280 10 10 CECE COCCOCCCN(C)c1ccc2c(c1)CC[C@H]2N 2186310976 CSQXCTXVQPIEIW-MRXNPFEDSA-N 278.396 2.122 10 10 CECE CN1C[C@H]2CC[C@H]1CN2c1ccc2c(c1)CCC[C@@H]2O 2186700158 RAILRUHMZZQDOT-UXLLHSPISA-N 272.392 2.339 10 10 CECE CN1CCCc2cc([C@H](NN)[C@@]34CC[C@@H]3C4)ccc21 2106861820 MWBFHVMFWRWDJH-VNQPRFMTSA-N 257.381 2.374 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@]2(C)C[C@@H]12 2065645450 PJPUGEVVEFXBGG-JLLWLGSASA-N 252.318 2.008 10 10 CECE CCN1C[C@@H]2C[C@H]1CN2c1ccc2c(c1)CCC[C@H]2N 2187594693 WLZICTNOTGITSN-YQQAZPJKSA-N 271.408 2.306 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@H](CC(=O)O)C(F)F 2100593543 NSEMIPJSOUFYOW-PSASIEDQSA-N 273.279 2.493 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CO[C@H](C)C2)cc1O 2101855667 UKUAETGKRSPEDE-GRYCIOLGSA-N 264.369 2.273 10 10 CECE CC[C@H](N)c1ccc(N(C)Cc2noc(C)n2)cc1 2104151409 WWIKFYYJKFHLEG-ZDUSSCGKSA-N 260.341 2.424 10 10 CECE COc1cccc(O)c1CNC[C@H](OC)C1CCC1 2104434177 RILDWISOGRQUID-HNNXBMFYSA-N 265.353 2.306 10 10 CECE C[C@H](N[C@H]1CC[C@@]12CCCO2)c1c(O)cccc1O 2104414302 JHWBFLSVKSEXHE-XEGUGMAKSA-N 263.337 2.460 10 10 CECE CCN(C[C@@H]1CCCN1)c1ccc(OC)cc1OC 2106343308 CALBBKZRAJRNLS-LBPRGKRZSA-N 264.369 2.282 10 10 CECE C[C@H]1Cc2cc(N3C[C@H](C)[C@@H](N)[C@H](C)C3)ccc2O1 2106344918 FXACAMRRUBEYMW-MEQWQQMJSA-N 260.381 2.430 10 10 CECE CC[C@@](N)(c1ccc2c(c1)CCN2C)[C@H]1CCOC1 2106792244 AZNJLMLMMSRSND-GOEBONIOSA-N 260.381 2.279 10 10 CECE Cc1nc([C@@H](O)c2ccc3c(c2)CCN3C)[nH]c1C 2106794560 YENITPOGQJYYAD-AWEZNQCLSA-N 257.337 2.101 10 10 CECE Cc1ncsc1[C@H](O)[C@H](N)c1ccc(N(C)C)cc1 2106852411 FTYPLOHXPFNAND-CHWSQXEVSA-N 277.393 2.251 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@](C)(N)C(F)F)ccc21 2106800228 FQBLSCOBWUQIQB-TZMCWYRMSA-N 270.323 2.085 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@]1(O)CSC[C@H]1C 2106854623 FYFQAGBXMFOCCW-DFBGVHRSSA-N 280.437 2.127 10 10 CECE C[C@@H]1CC[C@](O)(c2ccc3c(c2)CCCN3C)CN1 2106826340 SBXGDNJNLWCNMV-MLGOLLRUSA-N 260.381 2.029 10 10 CECE CCN1CCc2cc([C@](C)(O)CCCCN)ccc21 2106801578 OXOCLOBVJZKTDX-MRXNPFEDSA-N 262.397 2.406 10 10 CECE CCN1CCc2cc([C@H](O)c3ncoc3C)ccc21 2106802045 RVPVSMZASAOWLB-HNNXBMFYSA-N 258.321 2.447 10 10 CECE C[C@H]1C[C@@H](C)C(=O)N(CCOc2ccc(N)cc2)C1 2088997574 KWOGLVQUYOQCSH-NWDGAFQWSA-N 262.353 2.152 10 10 CECE CN1CC(N(C)c2ccc(CNC3CC3)cc2Cl)C1 2089247084 OSYRUCXVFLAEGT-UHFFFAOYSA-N 279.815 2.342 10 10 CECE C[C@@H](CCNC(=O)c1cccc(O)c1O)C(F)(F)F 2110287403 ITJVYTNFZCGGQW-ZETCQYMHSA-N 277.242 2.416 10 10 CECE OCc1ccc(N2C[C@]34CC[C@]3(COC4)C2)cc1Cl 2090383641 APCBIAAGSYHCQR-GASCZTMLSA-N 279.767 2.449 10 10 CECE CNCc1ccc(N2C[C@@H](C)CC[C@@H]2CO)c(C)c1 2110617095 OQEZTZIPZVPMDQ-SWLSCSKDSA-N 262.397 2.312 10 10 CECE CN(C[C@@H]1[C@H]2CCOC[C@H]21)c1ccc(CN)c(F)c1 2093781000 DGSXHZXDMCGGOU-MGPQQGTHSA-N 264.344 2.003 10 10 CECE COCC1(CNCc2cccc(O)c2O)CCCC1 2094228056 BIWCILGLNFMANW-UHFFFAOYSA-N 265.353 2.394 10 10 CECE Nc1ccc(CCN2CC3(CCC3)C[C@H]2CO)cc1 2095173852 SKGZQVWNTSBIHW-HNNXBMFYSA-N 260.381 2.048 10 10 CECE COc1cc(C)c([C@@H](O)Cc2ccc(N)cc2)cn1 2095569541 JRCFAGCQHTWZHO-AWEZNQCLSA-N 258.321 2.257 10 10 CECE CN[C@H](C)c1ccc(N2CC(N3CCC3)C2)c(F)c1 2095923595 FEAWDXQMVLMAGX-LLVKDONJSA-N 263.360 2.000 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]3CC3CC3)ccc21 2097780390 FXENQRHAPFUZPY-FZMZJTMJSA-N 257.337 2.017 10 10 CECE CN(C)[C@@H]1CCCCN(c2ccc(CN)c(F)c2)C1 2098761077 PQYTWUXGDPHVEI-CQSZACIVSA-N 265.376 2.205 10 10 CECE CO[C@@H]1CCCN(C(=O)Nc2ccc(N)cc2)[C@H]1C 2099125309 LTGYUGQFLSNKHU-GXFFZTMASA-N 263.341 2.300 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2[C@H]3CCC(F)(F)[C@H]32)cc1 2114373085 KGDWJBUJYNLMGX-HBNTYKKESA-N 267.279 2.434 10 10 CECE CCCN(Cc1ccc(Cl)cc1O)[C@@H]1CCNC1=O 2114770493 SIGBVVZASZYZLD-GFCCVEGCSA-N 282.771 2.146 10 10 CECE COc1cc(N(C)[C@@H]2COC[C@@H]2C(C)C)ccc1CO 2204552983 HQNAJBVYHYTQIT-HUUCEWRRSA-N 279.380 2.295 10 10 CECE COc1ccc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1Cl 2214342160 CAECJABQGLYUFH-URLYPYJESA-N 253.729 2.023 10 10 CECE C[C@H](Nc1nn(C)nc1Br)c1ccccc1O 2214727470 RXOKZHVGVXEKKU-ZETCQYMHSA-N 297.156 2.456 10 10 CECE CN(c1ccc(CO)cc1)C1CSCCSC1 2215579574 INUCACUXYXMGQY-UHFFFAOYSA-N 269.435 2.464 10 10 CECE C[C@@H]1C[C@]1(F)CN(C)c1cc2c(cc1N)NC(=O)CC2 2206342918 JNGGSUIMOXDAPG-PSLIRLAXSA-N 277.343 2.338 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)ccc1[C@H](C)O 2269687237 JLSCIQWYQNTZJE-VCOSZWKGSA-N 261.365 2.377 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](O)C[C@H](F)C2)c(Cl)c1 2219165601 JABPXVHYLNLYFN-LSJOCFKGSA-N 273.735 2.302 10 10 CECE COc1ccc(N(CCO)CC(C)C)c(OC)c1 2219639407 UCFNAUYGHNUCMZ-UHFFFAOYSA-N 253.342 2.159 10 10 CECE CN1CCc2cc(N3CCNC(C)(C)CC3)ccc21 2231317859 HVFQCWZYWKGMMP-UHFFFAOYSA-N 259.397 2.257 10 10 CECE OC[C@H]1CCN1c1ccc(CNC2CCC2)cc1F 2231478789 SISOCWRWSVMXSY-CYBMUJFWSA-N 264.344 2.039 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1OCC[C@@H]1C(F)(F)F 2231792620 VENXOBNXDUWQPW-JGVFFNPUSA-N 280.250 2.113 10 10 CECE Nc1ccc(CCNC(=O)CCCC(F)F)cc1 2222458714 FHOGNZQWOBBMTD-UHFFFAOYSA-N 256.296 2.363 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C[C@H](O)C(C)C 2223980012 RWCWYAVEGKRXKQ-WFASDCNBSA-N 250.386 2.468 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)[C@@H]1C[C@H]2COC[C@H](C2)C1 2234168114 ZGZRWSLDSVIFIZ-KSSYENDESA-N 278.356 2.397 10 10 CECE CCOC1(CO)CN(c2ccc(OC3CCC3)cc2)C1 2234886920 NQYIOHUAYZFZDD-UHFFFAOYSA-N 277.364 2.206 10 10 CECE OC[C@@]12C[C@@H]1CN(c1ccc(OCC(F)(F)F)cc1)C2 2235087928 OHHONCDROKYKIK-MFKMUULPSA-N 287.281 2.446 10 10 CECE CC1(O)CC2(CN(c3ccc4c(c3)OCCCO4)C2)C1 2235129461 OEIXSSGJEGEKOG-UHFFFAOYSA-N 275.348 2.199 10 10 CECE Nc1ccc(CCNC[C@@H]2OC[C@H]3CCC[C@H]32)cc1 2225104647 LAXLGSXLMMBVPY-BMFZPTHFSA-N 260.381 2.216 10 10 CECE C[C@@H](N)c1ccc(N2CC(N3CCOC3=O)C2)c(Cl)c1 2235665006 FWNYSBOPIMQHMX-SECBINFHSA-N 295.770 2.001 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)C[C@@H]1O 2226700124 KKVPAOIJWWJAKF-WPRPVWTQSA-N 271.263 2.215 10 10 CECE OC1(c2cccs2)CN(c2ccc3c(c2)CCO3)C1 2226756119 ZSAMYZAVMNIPJC-UHFFFAOYSA-N 273.357 2.391 10 10 CECE CN=c1[nH]cc(COc2ccc(N(C)C)cc2)cc1C 2237686279 BYFOCVXLOOIYOO-UHFFFAOYSA-N 271.364 2.499 10 10 CECE CCN(CCCN(C)C)c1ccc(OC)cc1C=O 2227694784 DCFPBRGKOPGDRO-UHFFFAOYSA-N 264.369 2.286 10 10 CECE Cc1cnc2c(N(C)Cc3ccccc3O)cnn2c1 2241103621 LQGHAIBBBSHOAY-UHFFFAOYSA-N 268.320 2.380 10 10 CECE CSc1ncc(CN2CCC(=O)[C@@H](C)C2)s1 2243840781 TYBJCQBEHPPJKO-QMMMGPOBSA-N 256.396 2.276 10 10 CECE Cc1cc(N2C[C@H](CO)OCC2(C)C)ccc1[C@@H](C)O 2285171577 YCZCDJUHKVLVAK-TZMCWYRMSA-N 279.380 2.024 10 10 CECE CSc1ncc(CN[C@@H]2CN[C@H]3CCC[C@H]32)s1 2248712946 ZZHIDOZLTSUVSB-OUAUKWLOSA-N 269.439 2.095 10 10 CECE CSc1ncc(CNC[C@H](F)C2CC(N)C2)s1 2248739962 VQGWCQQPEBXYSA-KTOWXAHTSA-N 275.418 2.030 10 10 CECE COc1cc(OC)c(N2CCNC[C@H](C)C2)cc1Cl 2270358516 KGVPPHCNSCJIJT-JTQLQIEISA-N 284.787 2.403 10 10 CECE c1cc2c(cc1CN[C@@H]1C[C@H]3CO[C@H]1C3)CCCO2 2270740996 JVEWBWNXHMZJTC-XPKDYRNWSA-N 259.349 2.279 10 10 CECE CSC1CC(COC(=O)COc2ccc(N)cc2)C1 2272045363 BXJPUICCRSMUCY-UHFFFAOYSA-N 281.377 2.332 10 10 CECE CS(=O)(=O)c1cscc1NCc1ccc(O)c(O)c1 2272711230 LDNGNJCPPBOTSU-UHFFFAOYSA-N 299.373 2.175 10 10 CECE C[C@H](CO)CC1CN(c2ccc(OCF)cc2)C1 2263854139 RLUQJOIUHZQGMB-NSHDSACASA-N 253.317 2.447 10 10 CECE COCC1(C)CC(NCc2cc(OC)ccc2O)C1 2273956042 KCFPWCLBPKKXEH-UHFFFAOYSA-N 265.353 2.306 10 10 CECE CN(CC[C@@H]1CCO1)c1ccc(C=CC(=O)O)cc1 2278552947 WDIYOTHFGSVBMX-CQSZACIVSA-N 261.321 2.400 10 10 CECE CSc1ncc(CNC(=O)C[C@H]2CCC[C@@H](N)C2)s1 2269091551 YJDBVMWVEBWCCW-VHSXEESVSA-N 299.465 2.389 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)C23CCC3)cc1C 2269662700 TWIQTNKSTWDCQM-IUODEOHRSA-N 260.381 2.379 10 10 CECE Cc1cc(N2C[C@H]3C[C@H]2CN(C)C3)ccc1[C@@H](C)O 2269686942 IMKFWQFAQSEXCF-IPYPFGDCSA-N 260.381 2.189 10 10 CECE C[C@H](OCCOC(F)(F)F)C(=O)Nc1ccc(N)cc1 2279794754 MCKAHJPYCVXOBD-QMMMGPOBSA-N 292.257 2.149 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10 CECE CC[C@H](C)NCc1cc(F)c(N(C)CCO)c(F)c1 2231470869 DAHHTICEXOWNQZ-JTQLQIEISA-N 272.339 2.281 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(N(C)C)C2)c(C)c1 2232094842 XKJLIDSJXBIASY-ZDUSSCGKSA-N 261.413 2.416 10 10 CECE CNCc1ccc(N2CC[C@H]3C[C@]3(F)C2)c(F)c1 2222695708 AFCSRUHVTOLEEC-FZMZJTMJSA-N 252.308 2.483 10 10 CECE CC(C)(CC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1)C(=O)O 2234167302 VJNGPEAFAQBZRL-JTQLQIEISA-N 282.344 2.426 10 10 CECE CCN(c1ccc2c(c1)CC[C@@H]2O)[C@H]1CCC[C@H]1O 2224414413 PKAJRQWGJJYRJE-HRCADAONSA-N 261.365 2.406 10 10 CECE O[C@@H]1CN(c2ccc3c(c2)CCC3)CC12CCOCC2 2235092272 QPAYFBAQHMTGEO-MRXNPFEDSA-N 273.376 2.153 10 10 CECE COc1ccc(N2CC3(CO)CCC2CC3)c(OC)c1 2235122917 SXLKNQSZJQFWFU-UHFFFAOYSA-N 277.364 2.445 10 10 CECE CC(C)Oc1ccc(N2CCO[C@@H]3C[C@H](O)C[C@H]32)cc1 2235102569 ZKPRYPHIQBZOAA-FVQBIDKESA-N 277.364 2.202 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cnc(N(C)C)nc1 2235214243 XALQPAPZMRMDEZ-NSHDSACASA-N 272.352 2.446 10 10 CECE COC[C@@H]1C[C@H]1CN(C)c1ccc(OC)cc1C(=O)O 2235956167 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2.327 10 10 CECE Nc1ccc(CNCc2cccn3ccnc23)cc1 2095191655 ZCHJXMURWKOWFB-UHFFFAOYSA-N 252.321 2.206 10 10 CECE OCc1ccc(N2CCC[C@H]3OCC[C@@H]3C2)c(F)c1 2095524138 ISJBXOHIPMKBDP-IUODEOHRSA-N 265.328 2.323 10 10 CECE C[C@@H]1CCOC[C@@H]1N(C)c1c(F)cc(CN)cc1F 2096253915 YYBQOSWFEQBTMG-RNCFNFMXSA-N 270.323 2.285 10 10 CECE C[C@@H](O)c1ccc(N2CCCN(C)CCC2)c(F)c1 2096274973 XGKWQXPDSLTHOY-GFCCVEGCSA-N 266.360 2.411 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCCN(C)CCC1 2096284721 FBAIZLCWCYLQDY-GFCCVEGCSA-N 264.369 2.186 10 10 CECE CN1CCC[C@]1(C)CNCc1cc(F)cc(F)c1O 2098732344 NSBWXVNOVSIGIO-CQSZACIVSA-N 270.323 2.244 10 10 CECE COCCNCc1ccc(N2C[C@H](C)[C@H]2C)cc1OC 2204544552 CPWCSGCVPZGYNV-QWHCGFSZSA-N 278.396 2.276 10 10 CECE CC[C@@H]1CN(c2ccc(CNC)c(OC)c2)[C@H](C)CO1 2204540248 VYHAXGLJJSHHGG-IUODEOHRSA-N 278.396 2.418 10 10 CECE CNCc1ccc(N(C)Cc2cc(C)on2)cc1OC 2204552935 BSWUHXMJDSNHRX-UHFFFAOYSA-N 275.352 2.347 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CCC4(CCC4)N3)ccc21 2205734048 FIGWFBIFTVKFSQ-HOCLYGCPSA-N 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2230668910 HDARWSYTCKVCAC-QMMMGPOBSA-N 279.233 2.484 10 10 CECE CC[C@H](C)NCc1ccc(N2CC(N(C)C)C2)cc1 2231468663 ZHRXHVDJRYOESE-ZDUSSCGKSA-N 261.413 2.325 10 10 CECE Cc1nc(CN(C)c2ccc([C@H](C)N)cc2C)no1 2232029342 XOZBQUZDNOBJOR-JTQLQIEISA-N 260.341 2.343 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@@]3(CO)C2)c(C)c1 2232028713 TXFFBZGVFVITSY-BJJXKVORSA-N 260.381 2.094 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@@H]2CC[C@@H](O)[C@H]2C1 2232092293 QXNHJYAGHKQBQK-ATVPRXPUSA-N 260.381 2.222 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H](O)CC12CCCC2 2232298251 VPDCORTVEWMCJH-AWEZNQCLSA-N 261.365 2.371 10 10 CECE OCc1ccc(N2CC[C@H](OC(F)(F)F)C2)cc1 2222976289 PVQFLVXUTSPACI-NSHDSACASA-N 261.243 2.294 10 10 CECE C[C@H](CC(=O)O)CC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2234166917 ROTJPVPDBBICIM-WDEREUQCSA-N 282.344 2.426 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21 2224951701 ZPCQZPXLGJVVIS-WHOHXGKFSA-N 264.329 2.103 10 10 CECE OC[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CC12CC2 2235061791 KHHPKDRYAXYFOM-SECBINFHSA-N 283.274 2.217 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CC[C@@H]1CO 2235066966 KYKMJSORLBUHSY-VHSXEESVSA-N 285.290 2.463 10 10 CECE CCn1c(-c2c[nH]nc2CCN)nc2ccc(F)cc21 2235331753 RQXZLQBHOLRAGT-UHFFFAOYSA-N 273.315 2.087 10 10 CECE C[C@H]1[C@@H](O)C[C@@H](C)CN1CCCOc1ccc(N)cc1 2235889815 DICJRLYQYIYIJM-WWGRRREGSA-N 278.396 2.129 10 10 CECE COc1ccc(N(C)CC2(OC)CCC2)c(C(=O)O)c1 2235959524 YDIDVLCGHFKTGK-UHFFFAOYSA-N 279.336 2.399 10 10 CECE COc1ccc(N(C)CC[S@](C)=O)c(CNC(C)C)c1 2235969406 DHNCWZWRANUUGD-FQEVSTJZSA-N 298.452 2.008 10 10 CECE CCCNCc1cc(OC)ccc1N1CC[C@](C)(O)C1 2235954012 JFUJUDYTWXJKQR-INIZCTEOSA-N 278.396 2.156 10 10 CECE COc1ccc(N(C)[C@H]2COCC[C@H]2C)c(CCN)c1 2235981604 QLMINCHCTFDXEP-WBMJQRKESA-N 278.396 2.058 10 10 CECE CC[C@@H]1C[C@@H](N(C)c2ccc(OC)cc2CNC)CO1 2235964892 WCEYDNBMYUDKJA-ZIAGYGMSSA-N 278.396 2.418 10 10 CECE CCOc1ccc(N2CC[C@]2(C)CO)cc1OCC 2226539298 VKNXJOMAWOIFRR-OAHLLOKOSA-N 265.353 2.445 10 10 CECE CCN(c1ccc2c(c1)OCCO2)[C@@H]1CCC[C@@H]1O 2226777904 XKBOHZPILSBNHP-OLZOCXBDSA-N 263.337 2.198 10 10 CECE CCN(CCOC)c1ccc(OC)cc1C[C@@H](C)N 2227679725 NCYRNZLBKSBBSU-GFCCVEGCSA-N 266.385 2.058 10 10 CECE COc1ccc(N2CC[C@@H](OC)[C@H]2C)c(C(=O)O)c1 2227668412 PCBHWRYRCPRAGO-NOZJJQNGSA-N 265.309 2.007 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H]2C(F)F)c(CN)c1 2227675600 JZKLGEGKTOSEPB-JQWIXIFHSA-N 270.323 2.491 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@@]2(F)CCOC2)c1 2238270878 WMBKWRLBYFFGBS-HNNXBMFYSA-N 281.327 2.155 10 10 CECE CN(C)CCOc1ccc(N(C)CCOCCF)cc1 2241068287 JGBOVTRJHRLVHJ-UHFFFAOYSA-N 284.375 2.049 10 10 CECE CC1CC(C[S@@](=O)CC(=O)N(C)c2ccc(N)cc2)C1 2283800605 SSJHTSANTQJRCU-YNBSLNEISA-N 294.420 2.026 10 10 CECE CSC1CC(C(=O)NCc2ccc(N)cc2)C1 2248489861 NGDWRKPABWCIAX-UHFFFAOYSA-N 250.367 2.027 10 10 CECE CCCN[C@@H]1CCN(Cc2cnc(SC)s2)C1 2248705842 SKJPEUKAVAMZGN-SNVBAGLBSA-N 271.455 2.439 10 10 CECE COc1cc(C(=O)CCc2ccc(N)cc2)ccn1 2270811563 IDIFVJVMWSZOOI-UHFFFAOYSA-N 256.305 2.488 10 10 CECE FCOc1ccc(N2CC[C@@H]3CCN[C@H]3C2)cc1 2263918597 MZGMOHUHADVJGQ-FZMZJTMJSA-N 250.317 2.181 10 10 CECE Nc1ccc(CN2CCCC(C(=O)O)CCC2)cc1 2273839052 JSGSRPDGHYIYTO-UHFFFAOYSA-N 262.353 2.346 10 10 CECE Cc1cc(N(C)Cc2nncs2)ccc1C[C@@H](C)N 2266591553 UEGPWPXANXUCRY-LLVKDONJSA-N 276.409 2.373 10 10 CECE COc1ccc(N(C)[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1 2279055195 XTQJDHIKIPSLQJ-ZFWWWQNUSA-N 297.420 2.487 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)[C@H]1CC2C[C@@H]3C1[C@@H]3C2 2279157590 QMLVFPQAXJZSJR-HRLFTLCMSA-N 270.376 2.314 10 10 CECE COC[C@@]1(C)C=CCN1c1c(F)cc(CN)cc1F 2269203946 SXMMOLLBTRRDPY-CQSZACIVSA-N 268.307 2.205 10 10 CECE Cc1cc(N2C[C@H]3C[C@H]2CN(C)C3)ccc1[C@H](C)O 2269672889 IMKFWQFAQSEXCF-YDHLFZDLSA-N 260.381 2.189 10 10 CECE Cc1cc(N2Cc3ncnc(O)c3C2)ccc1[C@@H](C)O 2285168740 QAFCMMCMXXXUNT-SNVBAGLBSA-N 271.320 2.064 10 10 CECE CCNC(=O)CN(CC)c1ccc([C@H](C)NC)c(C)c1 2285132403 OWXCWDRZAMNIPV-ZDUSSCGKSA-N 277.412 2.238 10 10 CECE Cc1cc(N(C)[C@H]2CS(=O)(=O)C2(C)C)ccc1[C@@H](C)N 2285130806 GSETXGAOKXYQQU-RISCZKNCSA-N 296.436 2.027 10 10 CECE COc1ccc(N2C[C@H](C)C(O)[C@@H](C)C2)c(OC)c1C 2295378474 PUPKPHGSNRASIO-QWRGUYRKSA-N 279.380 2.465 10 10 CECE OC[C@@H]1C[C@@H]2OCC[C@H]2N1c1ccc(OC(F)F)cc1 2295976671 AVMRHAKCCVVPHO-UHTWSYAYSA-N 285.290 2.017 10 10 CECE C[C@@H]1CC[C@H](NCc2ccc(N3CCNCC3)cc2)C1 2286066809 YLFCSYTYKKCPQB-ZBFHGGJFSA-N 273.424 2.374 10 10 CECE CS[C@H]1C[C@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2299298626 LULPGSPIJQIWJW-OPRDCNLKSA-N 254.359 2.429 10 10 CECE CN1[C@H]2CCC[C@@H]1C[C@@H](NCc1ccc(O)c(O)c1)C2 1172110344 MNNHRBIXQKJDGV-ZSOGYDGISA-N 276.380 2.203 10 10 CECE Cc1cc(NS(=O)(=O)[C@H]2C[C@@H]2C)cc(C)c1O 2302227865 WYMAMCRCYGEPJM-CPCISQLKSA-N 255.339 2.159 10 10 CECE COc1ccc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)c(F)c1 2312393003 UWRKHTYYDATQBY-BFVZDQMLSA-N 251.301 2.184 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)[C@@H]1CCCC[C@@H]1F 2315986443 DCRMOJFUEHYKPM-VHSXEESVSA-N 278.353 2.229 10 10 CECE CCOC(=O)[C@H]1CCCN(N=Nc2cccnc2)C1 2330246499 SCJMCEFSHPLGGZ-NSHDSACASA-N 262.313 2.355 10 10 CECE CS[C@@H]1CC[C@@H]1OC(=O)COc1ccc(N)cc1 2327446805 UTAASNJVUPNKBX-NWDGAFQWSA-N 267.350 2.085 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@@H]1CC[C@@H]2C[C@@H]2C1 2330225363 VSLDGMCHARJMGI-BQJFBPGXSA-N 261.365 2.450 10 10 CECE COc1ccc([C@@H](C)NC[C@H]2[C@@H]3CCO[C@@H]32)c(O)c1 2330702708 GVMZPIRUUYIMQW-IRIUXVKKSA-N 263.337 2.086 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@]2(CO)C3)c(F)c1 2336574394 JHQCKUGJGXGDTL-HFAKWTLXSA-N 265.328 2.230 10 10 CECE C[C@@H]1CC[C@@H](O)CN1c1ccc(CN)c(C2CC2)c1 2339158165 RLIMAVGYVDJWBA-IAQYHMDHSA-N 260.381 2.372 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2c1c(F)cc(CN)cc1F 2340782865 JKXUBFMWKBRZHD-OUJBWJOFSA-N 268.307 2.037 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)[C@@H]2CC23CCC3)cc1 2341457924 RJADTCFOYFVPFA-KKUMJFAQSA-N 260.381 2.304 10 10 CECE CSc1cc(N2C[C@@H](CO)C[C@@H](C)C2)ccc1CN 2353852137 RCJJXYHJFXWDOK-NEPJUHHUSA-N 280.437 2.322 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1CN2c1ccc(CN)c(SC)c1 2353857325 QTUDYPMHDYUHFZ-YUTCNCBUSA-N 278.421 2.481 10 10 CECE CSc1cc(N2CCC[C@](F)(CO)C2)ccc1CN 2353859646 GZLDLFAMIJFFPM-CQSZACIVSA-N 284.400 2.168 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@]34CNC[C@]3(C)C4)ccc21 2354741279 BDGLJTXNVBEDCJ-IXDOHACOSA-N 272.392 2.102 10 10 CECE Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)C[C@H]2O 895953 FSYDWKPCKNCRDI-OLZOCXBDSA-N 290.271 2.066 10 10 CECE endogenous,in-man Cc1cc(N(C)[C@@H]2C[C@H]3[C@H]4CC[C@H](O4)[C@H]32)ccc1CN 2356957514 XONDNOGIUOSSFO-JZAWBGDQSA-N 272.392 2.456 10 10 CECE COc1ccc(O)c(CN2C[C@H]3CCCCN3C[C@@H]2C)c1 211283053 OFIFKXZWESHERD-DZGCQCFKSA-N 290.407 2.459 10 10 CECE C[C@H](Nc1ccc(CC(N)=O)cc1)c1ccc(O)cc1O 37074953 NSAXMLFAAQCTDK-JTQLQIEISA-N 286.331 2.299 10 10 CECE CN1CCCc2cc([C@H]3[C@H](N)CCCN3C)ccc21 70296870 WSANKZVGRNAWTG-ZBFHGGJFSA-N 259.397 2.163 10 10 CECE CC1CC(=O)N(c2ccc(N)c(Cl)c2)C(=O)C1 211458223 MNNMUGBGRSNPBT-UHFFFAOYSA-N 252.701 2.212 10 10 CECE COc1ccc(CN(C)C[C@@H]2CCCC[C@@H]2O)c(O)c1 181094458 FLBCFZGCRYPUIU-WFASDCNBSA-N 279.380 2.384 10 10 CECE CC(C)(C)OC(=O)N[C@H]1CCN[C@@H]1c1ccccc1O 218759766 OLZRYZXHKASYNQ-WCQYABFASA-N 278.352 2.320 10 10 CECE Cc1cc(Br)cc(CNC(C)(C)CO)c1O 134416902 NNCKBCIUINUQCR-UHFFFAOYSA-N 288.185 2.324 10 10 CECE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H](CO)N=[N+]=[N-] 1951688626 OVPNWNQIRIKYOI-SSDOTTSWSA-N 268.277 2.100 10 10 CECE CCN1CCN([C@H](C)c2ccc(F)cc2O)CC1 131703649 DYDFQXCLJKEZGQ-LLVKDONJSA-N 252.333 2.230 10 10 CECE CC(C)N(CCCC(=O)O)Cc1ccc(O)cc1O 86748578 NXUCRWPLFZGGPQ-UHFFFAOYSA-N 267.325 2.173 10 10 CECE Oc1ccc([C@@H]2C(c3ccccc3)=NN=CN2O)c(O)c1 196587516 BKKFCGSIPRDZPK-OAHLLOKOSA-N 283.287 2.276 10 10 CECE CCSC[C@H](C)NC(=O)CCOc1ccc(N)cc1 135342417 ZREYNINRCBJZNC-NSHDSACASA-N 282.409 2.296 10 10 CECE Oc1cccc(Cl)c1CN1CCC[C@@H]2CNC[C@@H]21 221351677 LLYUGHXDLAZRSC-MFKMUULPSA-N 266.772 2.229 10 10 CECE COCCN(CC(C)C)[C@H](C)C(=O)Nc1ccc(N)cc1 42367168 CIQWKYJUBMPRKC-CYBMUJFWSA-N 293.411 2.200 10 10 CECE CCO[C@]1(CN2CCC[C@@H](CN=[N+]=[N-])C2)CCOC1 2271589892 IRABJYYLAZKSSO-STQMWFEESA-N 268.361 2.204 10 10 CECE COC[C@H]1CCN(c2ccc([C@@H](C)N)cc2F)C1 81067847 CXGHFCGIPXNXTF-MNOVXSKESA-N 252.333 2.318 10 10 CECE O=S(=O)(Cc1ccccc1)Nc1ccc(O)c(F)c1 85200996 TWGNLNLHSKHEPM-UHFFFAOYSA-N 281.308 2.473 10 10 CECE C[C@H]1CN(C)CCN1c1ccc(/C=C/C(=O)O)cc1F 235662738 AQGPHWRDNPMORO-MALLOTDXSA-N 278.327 2.064 10 10 CECE CC[C@H](O)[C@H](N)c1c(Br)ccc(C)c1O 95805031 XRNZBHMYLBGQEX-WPRPVWTQSA-N 274.158 2.234 10 10 CECE Nc1cc(-c2c(O)c(O)cc(F)c2Br)on1 258516192 KWDHXJDICPBONS-UHFFFAOYSA-N 289.060 2.237 10 10 CECE N[C@H](CO)c1c(O)c(Br)cc2c1CCCC2 258500885 JMMOUAMMVQNHBM-SNVBAGLBSA-N 286.169 2.026 10 10 CECE COc1ccc(CN[C@@H]2CCN(C)CC2(C)C)c(O)c1 2162867784 KLBADOKNLYJANC-OAHLLOKOSA-N 278.396 2.221 10 10 CECE CCN1CCc2cc([C@H](N)Cc3ccnn3C)ccc21 2163062913 NSJACJCZBRRTTG-OAHLLOKOSA-N 270.380 2.045 10 10 CECE CCCO[C@H]1C=CCN(C(=O)Nc2ccc(N)cc2)C1 2165068457 JQNIJSGXXJETCR-AWEZNQCLSA-N 275.352 2.468 10 10 CECE CN1CCSC[C@H]1[C@@H](N)c1ccc(N2CCCC2)cc1 2163095398 SBPFVVNRRCQOQU-HOTGVXAUSA-N 291.464 2.334 10 10 CECE COc1ccc([C@@H](C)NCCc2ncccn2)c(O)c1 2163217686 UUPKJAHBAAJWCU-LLVKDONJSA-N 273.336 2.084 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H](O)[C@@H]1CCSC1 2163231552 WYKHDHHNNVVITO-BMFZPTHFSA-N 292.448 2.401 10 10 CECE CCN1CCc2cc([C@H](O)[C@]34CNC[C@@]3(C)C4)ccc21 2165486530 BDGLJTXNVBEDCJ-BBWFWOEESA-N 272.392 2.102 10 10 CECE COc1ccc(O)c(CN2C[C@@H](C(=O)O)CC2(C)C)c1 2162143708 XHVQDYVEGSFWOM-NSHDSACASA-N 279.336 2.086 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@H](C4)[C@H]3C2=O)c(Cl)c1 2166914797 DGPFSPDOLSBSED-PTYMLPSESA-N 290.750 2.458 10 10 CECE O=C(O)/C=C\c1cccc2c(O)c(CC(=O)O)sc12 725386672 VEYLANNILZPCNS-PLNGDYQASA-N 278.285 2.332 10 10 CECE Nc1ccc2c(c1)CN(Cc1ccccc1O)CCO2 903947052 LOBXJPDRFBBLAC-UHFFFAOYSA-N 270.332 2.369 10 10 CECE CN(C)Cc1cc([C@]2(C(=O)O)CC2(C)C)ccc1O 1952359359 WGGGFBYTISRVMD-HNNXBMFYSA-N 263.337 2.206 10 10 CECE O=C(NCC[C@@H]1CC1(F)F)NCc1ccccc1O 856853145 NMOCAXRJKAVXLG-SNVBAGLBSA-N 270.279 2.237 10 10 CECE CC(C)(C)OC(=O)[C@H]1C[C@@]1(N)c1cc(F)ccc1O 1952769263 WVELPCFPLFYSMZ-QMTHXVAHSA-N 267.300 2.047 10 10 CECE CCC(C)(C)N[C@H](C)C(=O)NCc1c(O)cccc1F 928708331 JXBFFTFQPYQWSN-SNVBAGLBSA-N 282.359 2.314 10 10 CECE C[C@H](N[C@H](CO)C1CCC1)c1cc(F)cc(F)c1O 850487978 KLBXBWVDYLJFSW-ISVAXAHUSA-N 271.307 2.482 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CC34CC4)C2)cc1 855225099 NVLRJMLEEYRBCS-DOMZBBRYSA-N 286.375 2.190 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@H](CO)C2)cc1O 167818177 SCBFRTJOJLEQQI-OLZOCXBDSA-N 278.396 2.271 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1CCCC[C@H]1O 51991989 MKZZKCWSHOHZHN-WCQYABFASA-N 255.745 2.439 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CN(c3ccc(N)cc3)C[C@@H]21 1956147296 GFGLSLBRMLOXBB-BTTYYORXSA-N 289.379 2.228 10 10 CECE COc1cc(C)nc(/C=C2\SC(=S)N(C)C2=O)c1 776727555 ZRVUSZJEQOARTB-POHAHGRESA-N 280.374 2.230 10 10 CECE C[C@@H]1CN(C(=O)c2cc(O)cs2)[C@H](C)[C@@H](C)O1 783935101 WZJCXFDPXINMHQ-IWSPIJDZSA-N 255.339 2.092 10 10 CECE Cc1ccc(O)c([C@@H]2NCCc3cc(O)c(O)cc32)c1 83621031 RBDLTALDZKGHAU-MRXNPFEDSA-N 271.316 2.347 10 10 CECE Cc1ccc(O)c2c1[C@H](c1cccc(O)c1O)NCC2 83625510 HZHNRZHMJNFMTA-HNNXBMFYSA-N 271.316 2.347 10 10 CECE COc1ccc(N(C)[C@@H]2CCCNC2)c(OC)c1C 84639237 GBNLBUOKCHYPIY-GFCCVEGCSA-N 264.369 2.200 10 10 CECE O=C(NCc1cccc(Cl)c1O)[C@@H]1C[C@H]2CC[C@@H]1O2 890761124 LIKKBSLHGKDZMK-FOGDFJRCSA-N 281.739 2.229 10 10 CECE CC[C@H]1CN(CC(C)=O)c2cc3c(cc2N1)OCO3 76928964 MHOKLMDYRVXTSA-JTQLQIEISA-N 262.309 2.015 10 10 CECE CCC1(CC)CN(CCO)c2cc3c(cc2N1)OCCO3 76930931 IZDZZOLVFMSMHY-UHFFFAOYSA-N 292.379 2.241 10 10 CECE C[C@]1(COC(=O)COc2ccc(N)cc2)CC1(F)F 701777185 XBXPJLJWGLVFQV-GFCCVEGCSA-N 271.263 2.236 10 10 CECE CNCc1ccc(N2C[C@@H]3CN(C)C[C@]3(C)C2)c(Cl)c1 702418914 KSIHCIWTTKEKQE-XJKSGUPXSA-N 293.842 2.447 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@H](C(=O)O)C2CCC2)c1 399102725 FZBKRTKQTNYDOX-OTYXRUKQSA-N 279.336 2.305 10 10 CECE CCOC(=O)[C@](C)(NCCCN=[N+]=[N-])[C@@H]1CCCCO1 705998598 VWCRZOAJTXOOIZ-WCQYABFASA-N 284.360 2.167 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)NCCCCN=[N+]=[N-] 706393905 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10 10 CECE CC[C@@H](C)[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(N)=O 2296243474 MKJQENZZOOSNRN-JMSVASOKSA-N 277.412 2.303 10 10 CECE CCNCc1cc(OC)ccc1N1C[C@H]2COC[C@H]1C2 2286937445 HEHDGBDUQAIDRJ-GXTWGEPZSA-N 276.380 2.030 10 10 CECE Cc1nnccc1CN1CCc2cc(N(C)C)ccc21 2290083782 RYJNGEZXRKWBPU-UHFFFAOYSA-N 268.364 2.414 10 10 CECE C[C@H](N[C@@H]1CC(=O)N2CCCC[C@H]12)c1ccccc1O 367203194 CHZYEBDIWKFSHM-IACUBPJLSA-N 274.364 2.196 10 10 CECE COc1cc(OC)cc(N(C)C(=O)/C=C/c2cnccn2)c1 492005700 MHUVJXUNQMOOJD-SNAWJCMRSA-N 299.330 2.170 10 10 CECE Cc1cc(NS(=O)(=O)CC(C)C)cc(C)c1O 2302226333 GQJNMZXTCDMYAS-UHFFFAOYSA-N 257.355 2.407 10 10 CECE CN(C)CCCN1C(=O)C(=Cc2ccc[nH]2)SC1=S 2323767582 SQSTUPJNDUGQPL-UHFFFAOYSA-N 295.433 2.168 10 10 CECE C[C@@H](N[C@@H]1[C@@H]2CCCO[C@@H]21)c1ccc(F)cc1O 2309851436 DWTDINSABAVUJT-VAYSNVFOSA-N 251.301 2.359 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C[C@@H]2OC[C@@H]3CCC[C@@H]32)C1 2312298981 PMXKXPNWXNRHEY-VOAKCMCISA-N 250.346 2.434 10 10 CECE CCN(CCN=[N+]=[N-])Cc1csc(NC(C)=O)n1 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265.328 2.436 10 10 CECE CC(C)(CCF)CNC(=O)COc1ccc(N)cc1 1875687541 PIFRQMJEEAYOFM-UHFFFAOYSA-N 268.332 2.150 10 10 CECE COc1cncnc1N(C)[C@H](C)c1ccccc1O 1877529316 PRDVZNXCXBZUJU-SNVBAGLBSA-N 259.309 2.388 10 10 CECE COc1ccnc(N(C)[C@H](C)c2ccccc2O)n1 1877538945 QKOKCVRLXDMVTI-SNVBAGLBSA-N 259.309 2.388 10 10 CECE C[C@H](NC(=O)C[C@@H](N)C1CCC1)c1ccccc1O 1877588013 HREIKWXYOFRCJP-GXFFZTMASA-N 262.353 2.087 10 10 CECE COc1cccc(CN2C[C@H](N)CCC2(C)C)c1O 1879073806 VRSDYVIRBAMVLZ-GFCCVEGCSA-N 264.369 2.103 10 10 CECE C[C@H](O)c1cc(F)c(N2CCC[C@@H](CO)C2)c(F)c1 1880448333 GHSYCQBERUGJHG-VHSXEESVSA-N 271.307 2.227 10 10 CECE CC[C@@]1(O)CCN(c2c(F)cc([C@H](C)O)cc2F)C1 1880487027 QFGRIDBZZVEFNH-LKFCYVNXSA-N 271.307 2.369 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@H]3CO[C@@H](C3)C2)c(F)c1 1880960415 KCVBVGJYZCRVKZ-YWVKMMECSA-N 268.307 2.210 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCOCC23CC3)c(F)c1 1880928581 RNLQIFVKWLBWBS-SECBINFHSA-N 268.307 2.354 10 10 CECE C[C@H](NCCc1ccc(O)c(O)c1)C1(Cl)CC1 1943642835 JCXKJJPJDVIUHL-VIFPVBQESA-N 255.745 2.390 10 10 CECE C[C@H]1CCc2cc(N3CCCS(=O)(=O)CC3)ccc2N1 235708522 NKAXFROUEMYSDR-LBPRGKRZSA-N 294.420 2.058 10 10 CECE CCOC(=O)CNCc1ccc(N(CC)CC)cc1 37563684 UPRWSEUSIBDCMS-UHFFFAOYSA-N 264.369 2.186 10 10 CECE Cc1ccc(CN[C@@H]2CC[C@@H]3CN(C)C[C@@H]32)c(O)c1 1184387763 NJUWYPQQXMOLLU-QLFBSQMISA-N 260.381 2.130 10 10 CECE CCc1cccc(CN[C@@H]2COC[C@H]2C2CC2)c1O 898376517 MGZSTGIOYMADCE-LSDHHAIUSA-N 261.365 2.469 10 10 CECE C[C@H](CCC(=O)NCCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1885558089 YXWGACSNUFVPNB-SNVBAGLBSA-N 299.375 2.496 10 10 CECE CC1(C)CC(S(=O)(=O)Nc2ccc(O)cc2)C1 1948251497 UHMMFWBLOMGRRF-UHFFFAOYSA-N 255.339 2.323 10 10 CECE CC(C)(C)S(=O)(=O)N1CCC[C@H](N=[N+]=[N-])CC1 1949750017 XCPIILSPNVMOFV-VIFPVBQESA-N 260.363 2.280 10 10 CECE COc1ccc(O)c(CN2C[C@@H](C)CC[C@H]2C(=O)O)c1 1964725923 IHYLRDKSFAHKQU-GWCFXTLKSA-N 279.336 2.086 10 10 CECE Cc1cc(C(=O)[C@H](O)c2ccc3c(c2)CCN3C)co1 2147117670 HFZHBQWCVHWFEM-OAHLLOKOSA-N 271.316 2.497 10 10 CECE C[C@@H](N)c1ccc(N2CCN3CCC[C@H]3C2)c(F)c1 250891155 DHDVXDDQDSYQOZ-YPMHNXCESA-N 263.360 2.130 10 10 CECE CC[C@@H](CCCO)NCc1cc(F)cc(F)c1O 1967699351 MDBWGXZXAVQSKA-NSHDSACASA-N 259.296 2.311 10 10 CECE CO[C@H](CN(C)c1ccc(N)cc1)[C@@H]1CCCOC1 1967628848 ODBXWKKEOGBKOS-IUODEOHRSA-N 264.369 2.147 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1CCC(F)(F)CO1 1967824418 HXBOBZPQUHLXDU-LLVKDONJSA-N 275.270 2.435 10 10 CECE Cc1cccc(CNC2(CO)CC3(CCC3)C2)c1O 1967903402 YUGIIRPEHAMWAP-UHFFFAOYSA-N 261.365 2.485 10 10 CECE Nc1ccc(OCc2cn(C[C@H]3C=CCC3)nn2)cc1 1968179853 JQOFJVZSTWPMHP-LBPRGKRZSA-N 270.336 2.406 10 10 CECE CC1(C)C[C@H](CCNC(=O)c2cccc(O)c2O)CO1 1973963191 OXOHXXKPVPLGSB-JTQLQIEISA-N 279.336 2.033 10 10 CECE Oc1c(F)cccc1CNCCOCCC1CC1 1974166305 SYOYDNROYCQIBK-UHFFFAOYSA-N 253.317 2.438 10 10 CECE CSC[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)C1 1974442519 AOBQZBPDDYCHGY-AULYBMBSSA-N 264.394 2.069 10 10 CECE CCN[C@@H](c1ccccc1O)[C@H](O)c1ccc(C)cn1 2148145875 AJXAYPVVBWMNBD-JKSUJKDBSA-N 272.348 2.480 10 10 CECE CO[C@H]1C[C@@H]1CNCc1cccc(Br)c1O 1987751859 YVLNXCWLJUUJDF-KOLCDFICSA-N 286.169 2.279 10 10 CECE CCCN(CC(=O)N[C@H](C)CC)Cc1ccc(N)cc1 35364796 IINCCNDPRFCPRC-CYBMUJFWSA-N 277.412 2.396 10 10 CECE CCN(C(=O)c1ccn(-c2ccc(N)cc2)n1)C(C)C 35427891 SYNYRBVYYQQORP-UHFFFAOYSA-N 272.352 2.325 10 10 CECE Nc1ccc(OCCCN2CCCC[C@@H]2CCO)cc1 36671425 OBDSXRUBDOFWIM-OAHLLOKOSA-N 278.396 2.275 10 10 CECE N[C@@H](c1cnn(-c2ccccc2)n1)c1ccccc1O 2146234989 OIGKLTWMPOFTFT-OAHLLOKOSA-N 266.304 2.021 10 10 CECE NN[C@@H](c1ccccc1O)[C@@H]1CSc2ccccc2O1 2146235041 ORKGCWINFQBUPM-ZFWWWQNUSA-N 288.372 2.450 10 10 CECE NN[C@@H](c1ccccc1O)[C@H]1Cc2ccccc2CO1 2146239083 BVFTUYZSMUHQIM-CVEARBPZSA-N 270.332 2.038 10 10 CECE Cc1cc(OCCOC(C)C)ccc1N1CCNCC1 161693843 GBBVYFINSYLABA-UHFFFAOYSA-N 278.396 2.208 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2Cc1ncccn1 162223074 XVUZPVGOYZTRQQ-LBPRGKRZSA-N 268.364 2.449 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@@H]2[C@@H](CO)[C@@H]2C1 2146874233 FLQISTWNLNJYDF-ZSHCYNCHSA-N 274.408 2.168 10 10 CECE Nc1ccc(O)c(CNC(=O)C2C[C@H]3CC[C@H](C2)C3)c1 2150497178 AZQBBIAAJMFGJW-QWRGUYRKSA-N 274.364 2.417 10 10 CECE Cc1cc(C(=O)NCC2(CN=[N+]=[N-])CC2)sn1 2006018484 LPIBEYBIGHQBDC-UHFFFAOYSA-N 251.315 2.272 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C2CCSCC2)CC1 2006021281 RXWPCEZAIZCJDS-UHFFFAOYSA-N 254.359 2.336 10 10 CECE COc1ccc([C@@H](C)N[C@H](C(=O)O)C(C)C)c(O)c1 43430298 UIHLQUDZVOKYDA-RNCFNFMXSA-N 267.325 2.161 10 10 CECE COCC1(OC)CCN(c2ccc(CO)cc2C)CC1 2151846824 RRMHIFKEKPFNLK-UHFFFAOYSA-N 279.380 2.119 10 10 CECE COc1ccc(N2CCN(CCN=[N+]=[N-])CC2)cc1 48804642 QGKQFWHDDWPEEV-UHFFFAOYSA-N 261.329 2.128 10 10 CECE Oc1cc(Cl)ccc1CNCC[C@H]1C[C@@H](O)C1 2017008030 FXUYVBCSSUIOJF-WVSHTKLVSA-N 255.745 2.296 10 10 CECE c1cc2c(cc1N1CCN3CCCC[C@@H]3C1)COCC2 2152794676 DVQUIOHQNFJEPB-QGZVFWFLSA-N 272.392 2.434 10 10 CECE CCNCc1ccc(OC)c(CN2CCCCC2=O)c1 50125556 ZLSSKYHWUUAREV-UHFFFAOYSA-N 276.380 2.317 10 10 CECE C[C@H]1[C@@H](NCc2ccc(N3CCOCC3)cc2)C1(F)F 2153774843 YLKXPUPKTAUCHA-SMDDNHRTSA-N 282.334 2.266 10 10 CECE CC1(C)[C@@H](NC(=O)CCOc2ccc(N)cc2)C1(F)F 2153781328 XUKNNUJKGWUHIJ-GFCCVEGCSA-N 284.306 2.198 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1CCCC[C@H]1O 293540805 FYTYPPPUHIMHKU-GXFFZTMASA-N 253.317 2.172 10 10 CECE CC[C@@]1(C)CC[C@H](CNCc2ccc(O)c(O)c2O)O1 2153959999 FMYCQGAGSPHOSQ-ABAIWWIYSA-N 281.352 2.241 10 10 CECE OCc1cc(F)c(N2[C@H]3CCC[C@H](O)[C@H]2CC3)c(F)c1 2154092382 JAOMBGBPGQJBSJ-GDLCADMTSA-N 283.318 2.339 10 10 CECE CCC[C@H]1CCN1c1ccc(CO)cc1[N+](=O)[O-] 2028286052 ALQRAMNBBGARIJ-NSHDSACASA-N 250.298 2.466 10 10 CECE NCc1ccc(N2CC[C@H]3COCC[C@H]32)cc1Cl 2028371355 ZLEHDAWYAFMGGE-SMDDNHRTSA-N 266.772 2.414 10 10 CECE Cc1cc(CN)ccc1N1CCC(C2(C)OCCO2)CC1 2029102914 WCPXTTUVVIIYEW-UHFFFAOYSA-N 290.407 2.433 10 10 CECE CC[C@H](O)c1ccc(N2C[C@@H](F)[C@H](OC)C2)cc1 2029815921 ZAEMYKXHLJPQRK-HZSPNIEDSA-N 253.317 2.303 10 10 CECE O=C(O)[C@@H]1CCC[C@H](NCc2ccc(O)c(O)c2)CC1 2154451145 PGQUMPKIHKUCRZ-NEPJUHHUSA-N 279.336 2.221 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCC[C@@H]2CNC[C@H]21 299920566 OHHJRUIGGHBVAK-JTNHKYCSSA-N 264.344 2.276 10 10 CECE Cc1cnn(CCN[C@H](C)c2cc(F)ccc2O)c1 185843895 BRFVSEQHOAUOBD-LLVKDONJSA-N 263.316 2.387 10 10 CECE C[C@H]1CCOC[C@H]1OC(=O)Nc1ccc(N)cc1 2035075254 CQQRIPDTHJLUCP-JOYOIKCWSA-N 250.298 2.242 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2nccn2C)cc1 62253020 AUNYLKBJHJSUAC-GFCCVEGCSA-N 258.369 2.337 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)C3)c([N+](=O)[O-])c1 2154914057 SWGWMCFYQDNFQE-URLYPYJESA-N 278.308 2.096 10 10 CECE COCC1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CCC1 2039721331 CYQXXMOILSMVLQ-JTQLQIEISA-N 252.318 2.104 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CC[C@H](C)C1 2040174514 BJBQEVODZZWFNM-HBNTYKKESA-N 254.334 2.254 10 10 CECE COc1cc(Cl)cc(CN(C)[C@H](C)CCN)c1O 2040925416 QUHJNGTYHQRQET-SECBINFHSA-N 272.776 2.223 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])C12CCC(CC1)C2 2041250848 LVXZNVYPYJKNFV-SQLBVSGCSA-N 252.318 2.008 10 10 CECE CO[C@@H]1CN(c2ccc([C@@H](C)N)cc2Cl)[C@@H]2COC[C@@H]12 2158352943 JPLKOUGCQJPBFI-NZQZLILVSA-N 296.798 2.210 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CC[C@H](C)OC1 401502694 IJEBEVKOQJRHOC-QWRGUYRKSA-N 278.352 2.425 10 10 CECE C[C@@H]1C[C@@H](O)CN(c2ccc(CN)c(C(F)(F)F)c2)C1 401717026 WZKAMUKWGLVTKO-BXKDBHETSA-N 288.313 2.371 10 10 CECE CN[C@H](C)c1ccc(N(CCCO)C2CC2)c(F)c1 404228314 SDIODKKRWLESSE-LLVKDONJSA-N 266.360 2.457 10 10 CECE Cc1cc(CNC(=O)CCc2ccc(N)cc2)sn1 404327959 BDTASIBCQOWABL-UHFFFAOYSA-N 275.377 2.283 10 10 CECE C[C@H](NCCn1cc(Cl)cn1)c1cc(O)ccc1O 311545004 UUHLJXOVXSOBAH-VIFPVBQESA-N 281.743 2.299 10 10 CECE C[C@@H]1CN(C)CC[C@H]1N[C@H]1CCc2cccc(O)c21 311904489 QGLUQTJQCSWIQD-BNOWGMLFSA-N 260.381 2.309 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)c(Cl)c1 312249621 JWFGIOHSGSVKGF-YYFFNPIBSA-N 292.810 2.265 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H](O)COC)cc1Cl 78906248 SBZLVBZSEZQOQO-PWSUYJOCSA-N 286.803 2.064 10 10 CECE Oc1ccc(CN[C@@H]2COc3ccccc3C2)cc1O 328118422 KNRDBXHCUKISDX-ZDUSSCGKSA-N 271.316 2.191 10 10 CECE Cn1cc2c(n1)C[C@@H](NCc1c(O)cccc1Cl)CC2 2159960549 KTWRFVJMWCSFNK-NSHDSACASA-N 291.782 2.426 10 10 CECE CC[C@H]1[C@H](C(=O)O)CCN1Cc1c(O)cccc1OC 2160710973 BHCRYYPKDJERJY-PWSUYJOCSA-N 279.336 2.086 10 10 CECE Cc1ccc(N[C@@H](C(N)=O)c2c(O)cccc2F)cc1 2160770739 QTMFTHLJHSXLCZ-CQSZACIVSA-N 274.295 2.478 10 10 CECE CCOc1ccccc1[C@@H](NCCN=[N+]=[N-])C(=O)OC 90257025 RTBHYCHQNCVIKY-GFCCVEGCSA-N 278.312 2.199 10 10 CECE Cc1ncc(CN(C)CCCc2ccc(N)cc2)n1C 701625965 CYVNJCYUXDBGCR-UHFFFAOYSA-N 272.396 2.375 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@]23COC[C@@H]2C3)c(F)c1 701814223 NYWWRSLNLFYDPQ-GMXABZIVSA-N 265.328 2.352 10 10 CECE Cc1c(N[C@H](C)c2ccc(F)cc2O)nnn1C 701836960 GESBRSUJDJYPEV-SSDOTTSWSA-N 250.277 2.141 10 10 CECE Oc1c(Br)cccc1CNCc1ncccn1 702323105 GRSKTNAPLSCYNH-UHFFFAOYSA-N 294.152 2.235 10 10 CECE C[C@@H]1OCC[C@]1(C)NCc1ccc(F)c(F)c1O 703273068 GHXAAFVKEAINES-SDBXPKJASA-N 257.280 2.328 10 10 CECE CCN1CC[C@H](N(C)Cc2ccc(F)c(F)c2O)C1 703515651 CUNYWXRCKPFZGR-NSHDSACASA-N 270.323 2.196 10 10 CECE C[C@](Cc1ccsc1)(NCCCN=[N+]=[N-])C(=O)O 689918410 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2.351 10 10 CECE CN(C)CCC1CN(c2ccc3c(c2)CCC[C@@H]3O)C1 2184691257 MCYVDUCONPXTTB-KRWDZBQOSA-N 274.408 2.444 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@H]4COC[C@H]4C3)ccc21 2184728094 ZXHPQXMSVHMLKD-VBQJREDUSA-N 272.392 2.366 10 10 CECE OC[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)CC[C@@H]2O 2184735921 MOKKKKAHXNGFRD-SYEQVDHESA-N 273.376 2.406 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@@H](F)[C@H](CO)C3)ccc21 2184720813 FASYQXWQMDBEHU-APHBMKBZSA-N 278.371 2.050 10 10 CECE CN(Cc1c(O)cccc1F)C[C@@H]1OCC[C@@H]1F 2058676177 LUEXNZNSOCDDNP-AAEUAGOBSA-N 257.280 2.090 10 10 CECE CC[C@@H]1[C@H]2CNC[C@H]2CN1c1ccc(OC)cc1F 2106335135 DVEYCYQGMQGHKW-VHRBIJSZSA-N 264.344 2.269 10 10 CECE COc1cc2c(cc1OC)N([C@@H](C)[C@@H](C)C(=O)O)CC2 2195425324 DXXYJBIFOAOELC-ZJUUUORDSA-N 279.336 2.176 10 10 CECE CC[C@H](NCCC(F)(F)CO)c1ccccc1O 2064900116 MZZYSAFKHKVEGF-NSHDSACASA-N 259.296 2.451 10 10 CECE OCc1ccc(N2CC[C@@H]3CCO[C@@H]3C2)cc1Cl 2065060302 KZDYDLQGLAXBDB-QMTHXVAHSA-N 267.756 2.448 10 10 CECE 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CSc1ncc(CN[C@@H]2CCN[C@H]2C2CC2)s1 2248700180 KHSXBHANBLKYRK-MNOVXSKESA-N 269.439 2.095 10 10 CECE CCO[C@@]1(CSc2ncc(C(=O)O)s2)CCOC1 2259047731 YRFMPGJMKYCIDP-NSHDSACASA-N 289.378 2.129 10 10 CECE CS[C@H]1C[C@H](COC(=O)Cc2ccc(N)cc2)C1 2259380279 XXHXYDYRVFESDY-AULYBMBSSA-N 265.378 2.496 10 10 CECE CC[C@H]1[C@H](O)CCN1c1ccc([C@@H](C)O)cc1F 2260374917 YHNVLKDUXMXMJJ-LJWDBELGSA-N 253.317 2.229 10 10 CECE COc1cc(OC)c(N2CCN[C@@H]3CC[C@@H]32)cc1Cl 2270409885 KOENHIOVVUTIKZ-MNOVXSKESA-N 282.771 2.298 10 10 CECE O[C@@]1(c2ccc(N3CCCC3)cc2)C[C@H]2CO[C@H]1C2 2270746039 IZBLUXFWWZINSH-VBNZEHGJSA-N 259.349 2.283 10 10 CECE Oc1ccc(F)cc1CN[C@H]1CCCN(C2CC2)C1 2273137782 VQESGJSSZSHFQK-ZDUSSCGKSA-N 264.344 2.248 10 10 CECE COC1(C(=O)N(C)Cc2ccccc2O)CC(C)C1 2266324093 RPJHGCUCRWKGSJ-UHFFFAOYSA-N 263.337 2.166 10 10 CECE COc1ccc(N2C[C@@H](O)C(C)(C)C2)c2c1CCC2 2269179672 XSFBKXKLJJPQRW-OAHLLOKOSA-N 261.365 2.391 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](S(C)(=O)=O)CC[C@@H]2C)cc1 2279402712 SLSWMMLLYMQILO-HUBLWGQQSA-N 297.420 2.142 10 10 CECE CN1CCc2cc([C@H](N)c3nccn3C(F)F)ccc21 2280081298 BHZFGYZENFVGSG-LBPRGKRZSA-N 278.306 2.319 10 10 CECE Cc1cc(N2CCCNC(=O)C2(C)C)ccc1[C@@H](C)N 2285123985 KNLUSYQOCLBAAO-GFCCVEGCSA-N 275.396 2.120 10 10 CECE Cc1cc(N(C)CCCC(=O)N(C)C)ccc1[C@@H](C)O 2285152739 COICKSIQRKYEPS-CYBMUJFWSA-N 278.396 2.353 10 10 CECE Cc1cc(N(C)C2CCS(=O)(=O)CC2)ccc1[C@@H](C)O 2285166223 JWIMQNNUWVAKJD-GFCCVEGCSA-N 297.420 2.062 10 10 CECE Cc1cc(N2C[C@@H](C)NC(=O)C2(C)C)ccc1[C@@H](C)N 2285145699 HHEHDDZWIZNJHE-VXGBXAGGSA-N 275.396 2.118 10 10 CECE CC[C@@H](N)Cc1cc(OC)ccc1N(C)CC1COC1 2285344597 NTNLKUGVPGHHDJ-CQSZACIVSA-N 278.396 2.058 10 10 CECE CC[C@H]1C[C@H]1CNCc1ccc(N2CCNCC2)cc1 2286065427 JDMALXDLVWWGLY-HOTGVXAUSA-N 273.424 2.232 10 10 CECE CP(C)(=O)[C@H]1CN(c2ccc3c(c2)CC[C@@H]3O)CCO1 2289318100 AEPMVCOIUHINDM-GJZGRUSLSA-N 295.319 2.452 10 10 CECE CNCc1ccc(N(C)Cc2ccnnc2C)c(F)c1 2290044606 XWGBNAFATXSBEQ-UHFFFAOYSA-N 274.343 2.280 10 10 CECE Oc1ccc(F)cc1CNC[C@@H]1C[C@H]2CC[C@@H]1O2 2296972656 YLASCQKGWRTQMC-SUHUHFCYSA-N 251.301 2.188 10 10 CECE CC1(C)[C@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]21 379505058 HRFOICCXANUYQD-UWVGGRQHSA-N 260.337 2.132 10 10 CECE CC1(C)CCc2cc(N3C[C@H](F)[C@H](O)C3)ccc2O1 1144605951 LYPWEIDSVPQNGN-QWHCGFSZSA-N 265.328 2.309 10 10 CECE O=C(/C=C/c1cnccn1)N1CCSc2ccncc21 492123528 AEHDBARWZYLYSD-OWOJBTEDSA-N 284.344 2.024 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)c(Cl)c1 2311863004 SBPUGAMHCYWUQR-CBRVECNMSA-N 267.756 2.210 10 10 CECE CN(c1ccc(OC(F)F)cc1)[C@@H]1CNC[C@@H]1F 2320538451 AMSUWEAGURZJNK-WDEREUQCSA-N 260.259 2.034 10 10 CECE O=C(O)[C@]1(Sc2nccs2)CCCCC12CNC2 2327016289 WZNPBAUZYNHLEW-GFCCVEGCSA-N 284.406 2.222 10 10 CECE N[C@@]1(c2ccc(N3CCCC3)cc2)C[C@@H]2OCC[C@@H]21 2329486666 IHFWZTKXDBBXLT-HRCADAONSA-N 258.365 2.250 10 10 CECE CNCc1ccc(N(C)C[C@H]2C[C@@H]3CC[C@H]2O3)cc1 2329967258 GXHCJMZZGIZLNL-VNQPRFMTSA-N 260.381 2.410 10 10 CECE Oc1c(CN[C@@H]2CC[C@H]3C[C@@H]2CO3)ccc(F)c1F 2334110739 JAGWNDPLELNJDT-JFGNBEQYSA-N 269.291 2.328 10 10 CECE NCc1ccc(N2CC[C@@]3(CCO3)C2)cc1C1CC1 2339165668 KWBLTXWARHNJMW-MRXNPFEDSA-N 258.365 2.392 10 10 CECE CC(C)[C@H](O)C(C)(C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2340238977 TZWGGLVYNNMVSX-QWRGUYRKSA-N 268.361 2.331 10 10 CECE CNC[C@@H]1CN(c2ccc(OC)cc2C)CC12CC2 2340376718 CSBMLEKNVATSEI-CYBMUJFWSA-N 260.381 2.439 10 10 CECE Cc1c([C@@H](C)N)ccc(N(C)[C@@H](C)CC(N)=O)c1C 2340859714 NKTCZJDMFHGWBL-JOYOIKCWSA-N 263.385 2.023 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC([C@@H](F)CO)C2)c1C 2341060077 RCDITALBINEFLY-FZMZJTMJSA-N 266.360 2.090 10 10 CECE Oc1cc2c(cc1O)CN(c1ccc(Cl)nn1)CC2 2341195196 AOASOBQDJCAERO-UHFFFAOYSA-N 277.711 2.104 10 10 CECE OCc1ccc(NCc2ccc(O)cc2O)cc1F 2341921734 CEANGQXASSBAAU-UHFFFAOYSA-N 263.268 2.341 10 10 CECE COc1cnc(Cn2ccc3cc(N)ccc32)nc1 2352249823 YUMHIUAWKYCCON-UHFFFAOYSA-N 254.293 2.070 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2CC1=CCCOC1 2353395298 XQPJAIVRURJMNC-GFCCVEGCSA-N 258.365 2.416 10 10 CECE COc1cccc(CN[C@@H]2C[C@@H]3CC[C@@]2(CO)C3)c1O 2354525886 YAXQDJHADHEFNB-PEYYIBSZSA-N 277.364 2.042 10 10 CECE c1cc(N2CCCC2)ccc1CNC[C@H]1[C@@H]2CCO[C@@H]21 2355557311 NUXXEJFBXUJYAJ-ULQDDVLXSA-N 272.392 2.411 10 10 CECE CNCc1ccc(OC)c(CN(C)C[C@H]2CCCCO2)c1 50125142 XKYGWDGXCDREOA-MRXNPFEDSA-N 292.423 2.416 10 10 CECE Cc1cc(N)ccc1N1C(=O)c2ccccc2C1=O 22223347 LHSIWXDRCPYCHY-UHFFFAOYSA-N 252.273 2.378 10 10 CECE CC[C@H](C)NC(=O)CCNCc1ccc2c(c1)CCN2C 50286734 UHHNHOLJMBMOSS-ZDUSSCGKSA-N 289.423 2.073 10 10 CECE Cn1cc([C@H]2CCN(Cc3ccccc3O)C2)cn1 179577569 NCGFSIGKJWUEPE-LBPRGKRZSA-N 257.337 2.115 10 10 CECE CCNC1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 37240377 SCQUJHRXWWAMFP-UHFFFAOYSA-N 294.395 2.291 10 10 CECE C[C@@H](CO)N(C)c1ccc([C@@H](C)N)cc1Br 124292336 RUELJYMUHAJVRE-DTWKUNHWSA-N 287.201 2.286 10 10 CECE COc1ccc(OCC(=O)N(C)c2ccc(N)cc2)cc1 37274586 BHWKSQBSSKBQFQ-UHFFFAOYSA-N 286.331 2.319 10 10 CECE C[C@@H](NC[C@@H]1CCCOC1)c1ccc(O)cc1O 38044103 RZSCIBSXHDNFSM-MNOVXSKESA-N 251.326 2.175 10 10 CECE CCn1cc(C[C@H](N)c2ccc(N(C)C)cc2)cn1 137543353 XJDGZJULMOEQMS-HNNXBMFYSA-N 258.369 2.212 10 10 CECE O=C(CC1(C(=O)O)CCCCC1)NCc1ccccc1O 228402190 CTJXAEFERKVRAF-UHFFFAOYSA-N 291.347 2.434 10 10 CECE CC(C)C[S@](=O)CCCOc1ccc(N)cc1 40969880 OCEDJFSWXXLHFD-KRWDZBQOSA-N 255.383 2.442 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cc(F)ccc1C 234550364 BADSKHAEHOKAKP-NSHDSACASA-N 266.276 2.248 10 10 CECE CC(C)C[C@H]1CCC[C@](NCCN=[N+]=[N-])(C(N)=O)C1 230781192 ICFBBQGBSCEAON-DGCLKSJQSA-N 267.377 2.347 10 10 CECE CC[C@H]1CCCC[C@@]1(NCCCN=[N+]=[N-])C(N)=O 90260504 YPWORQCZLZJHHN-JQWIXIFHSA-N 253.350 2.101 10 10 CECE Cc1cc(O)c([C@H](C)N)cc1I 238421474 NIIRCRHDRNAMHI-LURJTMIESA-N 277.105 2.325 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@](C)(O)C2)cc1Br 235513422 GVTNLHPRRONCHI-TVQRCGJNSA-N 299.212 2.430 10 10 CECE CC(=O)N(C(=O)NCc1ncccc1C)c1ccc(N)cc1 244200459 VOIZKAUFNUETFZ-UHFFFAOYSA-N 298.346 2.235 10 10 CECE CC1CCC(CO)(NCc2ccc(O)cc2O)CC1 53113395 IPWWSTFTLASUHE-UHFFFAOYSA-N 265.353 2.129 10 10 CECE CN(C[C@H]1CCCCO1)C(=O)/C=C/c1ccc(O)c(O)c1 272347786 ANRLYIRJNABGBL-STMXVASLSA-N 291.347 2.139 10 10 CECE CO[C@H](C)[C@H](N)C[C@@H](O)c1ccc(N2CCCC2)cc1 2165784923 MRHKUFAMJHMOGJ-DAXOMENPSA-N 278.396 2.073 10 10 CECE CO[C@@H]1CN(c2ccc(CN)cc2F)CC[C@H]1C 299986718 NJIQNDCWKAFBQI-QMTHXVAHSA-N 252.333 2.146 10 10 CECE CN1CCc2cc([C@@]3(O)CCC[C@H](N(C)C)C3)ccc21 2163065504 AVOQTZJRJVFMCW-DOTOQJQBSA-N 274.408 2.371 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)c1ccccn1 2163143677 IXOYCHLEULRVAB-HZPDHXFCSA-N 271.364 2.142 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2ccn(C)n2)c(F)c1 723523258 HDWPSDYGVPAFRL-NSHDSACASA-N 276.359 2.476 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CCc2ccc(F)cc21 2163707901 WILPKQOGZTVIIL-HZPDHXFCSA-N 273.307 2.365 10 10 CECE Nc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)c(Cl)c1 2166998286 ZEYYQPYAUDTPFP-XXHBBNRNSA-N 288.734 2.234 10 10 CECE CC(=O)c1cc(Cl)cc(CN[C@@H](C)[C@H](C)CO)c1O 295872224 ZDNAENNHSVTVJT-BDAKNGLRSA-N 285.771 2.355 10 10 CECE CNCc1cnc(SCC(C)(C)C(=O)OC)s1 1949569499 FFZHXIFUXDMYRH-UHFFFAOYSA-N 274.411 2.154 10 10 CECE CC[C@H]1COC[C@@H]1N(C)c1ccc(CNC)cc1F 711202344 MDQRDBWARJPYHM-WFASDCNBSA-N 266.360 2.406 10 10 CECE COCC[C@@H](C)N(CCCN)c1ccc(OC)cc1 129698095 LRLSERSPYIAEFN-CYBMUJFWSA-N 266.385 2.275 10 10 CECE C[C@@H](OC[C@@H](O)COc1ccc(N)cc1)C1CCC1 719738922 FNHRDNAEJNANMR-BXUZGUMPSA-N 265.353 2.214 10 10 CECE Cc1cc(Cl)cc(CNCCCc2cnn(C)n2)c1O 816638395 KOFLDQIXNBKGIC-UHFFFAOYSA-N 294.786 2.205 10 10 CECE C[C@H]1C[C@H](C(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 724419737 IXFLMYKWTIETSJ-DABQJJPHSA-N 276.380 2.131 10 10 CECE Cc1cc(O)nc(Cn2ccc3cc(N)ccc32)n1 700483682 ZFBWPJJCCKCEFL-UHFFFAOYSA-N 254.293 2.076 10 10 CECE C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1F 827979291 NYGZMVGFYJLUEL-IONNQARKSA-N 271.263 2.057 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](C(F)(F)CO)C2)cc1 1892714895 KAGWNMQOMWHGTG-JQWIXIFHSA-N 271.307 2.194 10 10 CECE Cc1cc(O)c(CN[C@H]2CC(=O)N(C3CC3)C2)c(Cl)c1 840901627 GWYZATYCCNBQNQ-JTQLQIEISA-N 294.782 2.207 10 10 CECE O[C@H]1CCCCN[C@H]1c1ccc(N2CCCC2)cc1 1952043944 GKXUDJHNFSFEIQ-HOTGVXAUSA-N 260.381 2.462 10 10 CECE CC[C@H](NCC[C@@]1(O)CCOC1)c1ccc(F)cc1O 846195133 XHGMDCQYGBYLKS-DZGCQCFKSA-N 283.343 2.114 10 10 CECE CC(C)(C)OC(=O)N1C[C@H](N)C[C@H]1c1ccc(O)c(O)c1 1952452413 KWXIDQGDEPCVRU-MNOVXSKESA-N 294.351 2.107 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@H]2CCN2C)cc1 922576573 UBOWRQVXKQFVPQ-DWTRPJMMSA-N 259.397 2.060 10 10 CECE CCNCc1ccc(N(C)[C@@H]2CCOC[C@@H]2F)cc1 2130196062 KVSGNLDJTCOWSX-LSDHHAIUSA-N 266.360 2.359 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CCN(CCCN=[N+]=[N-])C1 1953752727 XGUBNUBYKJZXGG-SNVBAGLBSA-N 269.349 2.286 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H]3COC[C@H]32)c(F)c1 1899114479 ZTIZIKVJTUUXJB-MWODSPESSA-N 268.307 2.210 10 10 CECE Cc1nccc(-c2noc(Cc3ccc(N)cc3)n2)n1 132236780 PSWXARPVEKDBDX-UHFFFAOYSA-N 267.292 2.008 10 10 CECE C[C@@H](NC(=O)N[C@@H]1CO[C@H](C2CC2)C1)c1ccccc1O 868814596 FDIBXCXNNNTBSP-GMXABZIVSA-N 290.363 2.320 10 10 CECE Cc1ccc(C(=O)NC2C[C@@H]3[C@@H](C2)C3(F)F)c(O)c1O 1118780619 DIELZBMWQUSXOI-NXEZZACHSA-N 283.274 2.180 10 10 CECE C[C@H]1CN(CCF)c2cc3c(cc2N1)OCCO3 76928717 IHXRREBSAYFXOZ-VIFPVBQESA-N 252.289 2.048 10 10 CECE Oc1ccc2c(c1O)CCN[C@H]2c1cccnc1Cl 83656211 FKCKKPFVCLMBOU-GFCCVEGCSA-N 276.723 2.381 10 10 CECE Oc1ccc([C@@H]2NCCc3c(O)ccc(F)c32)c(O)c1 83626007 URRYUCWZTCYXSH-HNNXBMFYSA-N 275.279 2.178 10 10 CECE CCOC[C@H]1CN(c2ccc([C@@H](C)N)cc2F)CCO1 705803329 KBJUATLYKSARJO-DGCLKSJQSA-N 282.359 2.087 10 10 CECE N[C@H]1CCCN(Cc2c(O)cccc2Br)C1 706846647 OPYWLZDNWJSCRD-VIFPVBQESA-N 285.185 2.078 10 10 CECE C[C@H](N)c1ccc(N2C[C@]3(C)CN(C)C[C@@]3(C)C2)cc1 707016797 IEKBSFVUKZVWQY-JQFCIGGWSA-N 273.424 2.484 10 10 CECE C[C@@H](CN[C@H](C)c1ccc(O)cc1O)CN1CCCC1 62077418 YAVKUJIACHGVCW-QWHCGFSZSA-N 278.396 2.480 10 10 CECE CCN(c1ccc(N)cc1)[C@@H](C)C(=O)N1CCCCC1 63114834 VBPODTFDCKZZSV-ZDUSSCGKSA-N 275.396 2.496 10 10 CECE CNCc1ccc(OC)c(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1 715387354 KUKNQXNTRGPVGE-CHWSQXEVSA-N 282.334 2.112 10 10 CECE C[C@H](NC[C@H]1CCN1C1CC1)c1ccc(F)cc1O 691833551 AAWMCXLHRORCAQ-GXFFZTMASA-N 264.344 2.419 10 10 CECE CO[C@H](C(=O)N(Cc1ccc(N)cc1)C1CC1)C1CC1 692756034 SRSMQVYUURQSAA-HNNXBMFYSA-N 274.364 2.185 10 10 CECE CC[C@@H](NCC[C@H](COC)OC)c1ccccc1O 694313415 UYEHGLVEJVXINH-TZMCWYRMSA-N 267.369 2.484 10 10 CECE CC[C@H](NC[C@@H]1CN(C)C[C@H](C)O1)c1ccccc1O 697320992 KSOJBKWHOFTYFI-GUTXKFCHSA-N 278.396 2.152 10 10 CECE CCOC(=O)[C@@](C)(CC(C)(C)OC)NCCCN=[N+]=[N-] 90259911 CZGGVMMUTJQBTC-CYBMUJFWSA-N 286.376 2.413 10 10 CECE CCN1CCC[C@@H]1CN(C)c1ccc(CN)cc1F 92620671 HFPMESFGAVXODU-CYBMUJFWSA-N 265.376 2.205 10 10 CECE N[C@@H](c1ccccc1O)c1ccnn1[C@@H]1CC1(F)F 2121750466 ZHVYRVOEJGEXFV-NEPJUHHUSA-N 265.263 2.217 10 10 CECE CNCc1ccc(N2CCC=C[C@@H]2COC)c(C)c1 2125985751 PURKUKCDMAAGPU-OAHLLOKOSA-N 260.381 2.496 10 10 CECE CN[C@H](c1ccccc1O)C1C[C@@H](OC)[C@H](OC)C1 2118297695 OYLHQAREKLYGKI-KFWWJZLASA-N 265.353 2.093 10 10 CECE C[C@@H]1C[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)CCO1 2126506584 FCHFZUCAIDVMBW-WOPDTQHZSA-N 266.345 2.493 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](CO)[C@@H](F)C2)cc1 2120619238 CEFHFGIMNFHHFR-ZLDLUXBVSA-N 266.360 2.124 10 10 CECE O[C@@]1(c2ccc(N3CCCC3)cc2)CCOC[C@@H]1F 2130263006 FOZSVAMTRCDQNX-LSDHHAIUSA-N 265.328 2.233 10 10 CECE CO[C@@H]1CC[C@H]1C[C@@H](NN)c1ccc(N(C)C)cc1 2130377681 CIVQEVJWRDXJOO-NWANDNLSSA-N 263.385 2.072 10 10 CECE CN(C)CCCN(C)c1ccc2c(c1)CCC[C@H]2N 2128276388 AKSSDGIKWBDFLK-MRXNPFEDSA-N 261.413 2.411 10 10 CECE C[C@H](C[S@](C)=O)N(C)c1ccc2c(c1)CCC[C@H]2N 2128273001 IYPLNGGNIFMJPX-VWCVUJCZSA-N 280.437 2.226 10 10 CECE CCN1CCN(c2ccc3c(c2)CCC[C@H]3N)CC1 2128268671 JWKWJRYMGKTYJH-MRXNPFEDSA-N 259.397 2.165 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](C3(O)CC3)C2)cc1 2130509929 FKFPQBNMZNPEEW-TZMCWYRMSA-N 260.381 2.318 10 10 CECE CCCN1C[C@H]2C[C@H]1CN2c1ccc(CNC)cc1 2131056423 PQXGPUCMHQYLMR-JKSUJKDBSA-N 259.397 2.079 10 10 CECE CC[C@H]1NCC[C@]1(O)c1ccc(N(CC)CC)cc1 2131689614 RFEXXLBOMLUZFJ-CVEARBPZSA-N 262.397 2.492 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)O3)cc1Br 1910355396 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2269161607 HKLWKNIBQOJWBO-OCCSQVGLSA-N 265.328 2.093 10 10 CECE Cc1cc(N2[C@H]3CC[C@H]2CN(C)C3)ccc1[C@@H](C)O 2269673528 SZPYSIWMSQHYLS-SNPRPXQTSA-N 260.381 2.331 10 10 CECE C[C@@H](COC(F)F)OCCC(=O)Nc1ccc(N)cc1 2279811566 JJCATBHCRDYCHD-VIFPVBQESA-N 288.294 2.242 10 10 CECE CC(=O)NC1=NC(=O)C(=Cc2ccc(Cl)cc2)S1 2294009871 TVGRVJFOSPCXHC-UHFFFAOYSA-N 280.736 2.446 10 10 CECE C[C@@H]1C[C@@H]2CCC[C@@H]2N1C(=O)c1cc(O)c(O)c(O)c1 2280165220 AQDHZODPIFYCQL-YWVKMMECSA-N 277.320 2.207 10 10 CECE C[C@H](N)c1ccc(N2CCc3cccnc3C2)cc1O 2290229118 IIUZOJRNARLLDO-NSHDSACASA-N 269.348 2.370 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)[C@@]12CC[C@@](CF)(C1)OC2 2290500034 SYYWMLXUZRPFGM-UKJIMTQDSA-N 282.319 2.243 10 10 CECE CCCN[C@H](c1cnc(OC)nc1)c1ccccc1O 2281551252 GYKFTXQZRRSDFW-CQSZACIVSA-N 273.336 2.280 10 10 CECE CN(C)c1ccc([C@@H](OCCN)C2=CCCCO2)cc1 2293222930 RSHROLIVPJRYTB-MRXNPFEDSA-N 276.380 2.463 10 10 CECE COc1ccc(N2C[C@@H](N)CC(F)(F)C2)c2c1CCC2 2284598416 NDMJRYCPZZREQS-JTQLQIEISA-N 282.334 2.357 10 10 CECE CCN(c1ccc([C@H](C)N)c(C)c1)[C@@H](C)CS(C)(=O)=O 2285126918 ICXRHEVEFNSAMY-STQMWFEESA-N 298.452 2.274 10 10 CECE COC[C@H]1C[C@H](CN)N(c2ccc(OC(F)F)cc2)C1 2295933416 SAEGXPFKOCWHAH-CMPLNLGQSA-N 286.322 2.088 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)c2cc(F)c(F)cc2N)C1 2286928810 QCGSWESEUKPWLD-SSDOTTSWSA-N 281.266 2.319 10 10 CECE CN(C[C@@H](O)COc1ccc(N)cc1)[C@@]1(C)CC1(C)C 2288809402 FXPQMHCVAQSVLN-CJNGLKHVSA-N 278.396 2.129 10 10 CECE COc1ccc([C@@H](C)NC[C@@H]2C[C@H]2OC)c(O)c1 2310634138 NVFLROMCRPRCMR-ISTVAULSSA-N 251.326 2.086 10 10 CECE CO[C@@H](C)CC[S@@](=O)CCCc1ccc(N)cc1 2315284531 BSLFMYXJKHMBLC-SGTLLEGYSA-N 269.410 2.375 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)[C@H]1[C@@H]2CCC(F)(F)[C@@H]21 2330661098 IQPJXCFQGWKRNG-XSPKLOCKSA-N 274.271 2.021 10 10 CECE Cc1ccc(CN[C@H]2CC[C@H]3CN(C)C[C@@H]23)c(O)c1 2333190963 NJUWYPQQXMOLLU-ZNMIVQPWSA-N 260.381 2.130 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@@H]4CO[C@H]3C4)ccc21 2334538270 UMROGYUOXIQANN-XFBWCDHKSA-N 258.365 2.032 10 10 CECE CN1CCc2cc([C@@H](CN)N(C)Cc3ccco3)ccc21 50287128 DRZAGCSQLNUGID-QGZVFWFLSA-N 285.391 2.404 10 10 CECE COc1ccc(C(=O)C(C)=O)cc1Br 57544752 NCFKOADYPYKYRA-UHFFFAOYSA-N 257.083 2.229 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2CC(O)C3)cc1Cl 111382774 WWYUYEKAMBOVFE-QWRGUYRKSA-N 266.772 2.291 10 10 CECE CCc1cc(N2CCC[C@H](N)C2)ccc1OCOC 1890651435 PTLFQVKJFXPBGR-ZDUSSCGKSA-N 264.369 2.159 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(CC)CCOCC)ccc21 111119846 WZIMFNRXJZLPLO-HNNXBMFYSA-N 291.395 2.152 10 10 CECE c1cc2c(cc1CN[C@@H]1C[C@@H]3[C@H]4CC[C@H](O4)[C@H]31)CCO2 2356909933 MYSGMSCBRZZHKN-LYHPXFHOSA-N 271.360 2.277 10 10 CECE C[C@@H](O)c1cc(F)c(N2[C@H]3CC[C@@H]2C[C@H]3CO)c(F)c1 2357380629 GCJORGDDHPHGRZ-KMUQISDUSA-N 283.318 2.368 10 10 CECE C[C@@H](N)c1ccc(N(C)C2CCOCC2)c(F)c1 36321429 KUPFXPFQQHSJHI-SNVBAGLBSA-N 252.333 2.461 10 10 CECE CC(C)NCc1ccc(N(C)C(C)(C)CO)cc1 126800213 XPBPGULAZOHDNK-UHFFFAOYSA-N 250.386 2.392 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC[C@@H]1C(=O)O 86726957 WYSZEQILZCMQMK-GZMMTYOYSA-N 253.273 2.141 10 10 CECE CC(C)N[C@](C)(CCSc1nccs1)C(=O)O 45596206 PPBBZEDMLZUVCC-LLVKDONJSA-N 274.411 2.467 10 10 CECE CCn1ncc(CN[C@H](C)c2ccc(C)cc2O)n1 527924462 PPCXNRGNKAMEFX-LLVKDONJSA-N 260.341 2.163 10 10 CECE Nc1cc2c(cc1N1CC[C@H]3CCCC[C@H]31)NC(=O)CO2 227947906 WCQHGWVHJDOPRY-ZWNOBZJWSA-N 287.363 2.369 10 10 CECE N#Cc1cc(F)c(/C=C2\SC(=S)NC2=O)c(F)c1 195221339 OADNKUJNUWFYEW-OQFOIZHKSA-N 282.296 2.325 10 10 CECE Nc1ccc(CCNC(=O)Cc2ccc(F)c(F)c2)cc1 95045741 HCWQAJNALXZMTL-UHFFFAOYSA-N 290.313 2.448 10 10 CECE CNCc1ccc(N(CCO)CC(F)F)c(Cl)c1 231329253 VXWLVMUOMXKAJL-UHFFFAOYSA-N 278.730 2.123 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@@H]1CCCO1 235156692 WGASYCITHCCUJZ-MNOVXSKESA-N 251.326 2.270 10 10 CECE COc1cc(O)c(CN2CC[C@H](C)[C@H](OC)C2)cc1OC 249844015 OBMZPCQGGXQJRW-MEDUHNTESA-N 295.379 2.266 10 10 CECE COc1ccc(N(C)[C@]2(CN)CCN3CCC[C@H]3C2)cc1 250257526 ZFVVGTMRYLDTIX-DOTOQJQBSA-N 289.423 2.087 10 10 CECE CCC[C@@H](N)[C@H]1c2c(oc3c2ccn3C)CCN1C 606597481 FOLYTDGSAJCVLB-RISCZKNCSA-N 261.369 2.428 10 10 CECE C[C@H](NCCF)c1ccc(N2CCOCC2)cc1 271767149 FCWCTVFDAKLVGX-LBPRGKRZSA-N 252.333 2.143 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC(N(C)C)C2)cc1O 382308409 RKZOQLGWRZYHBJ-LBPRGKRZSA-N 277.412 2.203 10 10 CECE Cc1cc(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])sn1 2213592633 MWTUVFSUVUFPOV-JGVFFNPUSA-N 251.315 2.413 10 10 CECE CCC[C@@H]1CCOCCN1C(=O)c1cccc(O)c1O 2167511714 XHTNSEOMXDRHKO-LLVKDONJSA-N 279.336 2.129 10 10 CECE CC(C)(CCO)NCc1cc(Cl)c(F)cc1O 293641960 NYXFWIVJLLJPMS-UHFFFAOYSA-N 261.724 2.435 10 10 CECE C[C@@H](O)c1ccc(N(C)C2(CO)CC(C)(C)C2)cc1O 2164565060 WAXIREMEKZNCNU-LLVKDONJSA-N 279.380 2.433 10 10 CECE NC[C@@]12CCC[C@H]1CN(c1ccc3c(c1)OCCO3)C2 2162635751 IEGLSMZNZYDJSZ-BLLLJJGKSA-N 274.364 2.023 10 10 CECE N[C@H](c1ccccc1O)[C@@H](O)c1ncoc1C(F)(F)F 2167837117 KHZJKOVFXHGKEC-PSASIEDQSA-N 288.225 2.132 10 10 CECE CCN[C@@H](CC)c1ccc(N2CC(NC(C)=O)C2)cc1 723180851 DKIZSVCNMXYLNL-INIZCTEOSA-N 275.396 2.072 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)[C@H]1CCN(C)C1 2163104826 GNJZQOUZPZIGFO-DOTOQJQBSA-N 273.424 2.499 10 10 CECE Nc1ccc(OC[C@@H](O)C[S@@](=O)C2CCCCC2)cc1 722446682 YUTJNSXHXCKSMD-ZUOKHONESA-N 297.420 2.090 10 10 CECE CCNC(=O)CN(CC)c1ccc([C@H](N)CC)cc1 723180838 BRNZMJUYRKAHAB-CQSZACIVSA-N 263.385 2.059 10 10 CECE Cc1cc(N(C)C[C@@H]2CCN2C)ccc1C[C@H](C)N 2129906743 XCVTWUHVJVPVKK-BBRMVZONSA-N 261.413 2.025 10 10 CECE Oc1cc(Br)ccc1CN1CCO[C@H]2C[C@H]21 825965274 WYPYLHLDGIUBTA-PWSUYJOCSA-N 284.153 2.128 10 10 CECE COc1cc(N(C)C[C@@H]2CNC[C@H]2C)cc(OC)c1OC 903439959 ROQWUKFUZUJXAE-NEPJUHHUSA-N 294.395 2.004 10 10 CECE CCC(C)(C)C(=O)C(=O)NCc1cccc(OC)c1O 901128249 UOEGTTMSHOPZOK-UHFFFAOYSA-N 279.336 2.022 10 10 CECE Cc1cc(C)c(O)c(CN(C[C@@H]2CCC(=O)N2)C(C)C)c1 840187912 JAZNZLWROKQXNR-HNNXBMFYSA-N 290.407 2.498 10 10 CECE COC[C@@](C)(CN1CCCC[C@@H](CN=[N+]=[N-])C1)OC 1895831583 YGPZCEDVSHOIHJ-QWHCGFSZSA-N 270.377 2.450 10 10 CECE Cc1cc(O)c(CNCCn2ccnc2)c(Cl)c1 840877631 ZVYLPLDQWQKXFS-UHFFFAOYSA-N 265.744 2.340 10 10 CECE COC1(C(=O)NCc2ccc(N3CCCCC3)cc2)CC1 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COc1ccnc(N(Cc2ccc(N)cc2)C(C)C)n1 37671724 MOKSZZAHZOKVRY-UHFFFAOYSA-N 272.352 2.482 10 10 CECE CCN[C@H](CC)c1ccc(N2C[C@H]3C(CO)[C@@H]3C2)cc1 2146877089 NOOIQWSOBAOVAS-BFYDXBDKSA-N 274.408 2.422 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCOCC2(C)C)cc1 2149218454 BAFTZLYOYPBHBJ-MRXNPFEDSA-N 278.396 2.275 10 10 CECE Cc1cc(N2CCNCC2)ccc1OCCOC(F)F 2150249472 PKUBAKNNAQHWPJ-UHFFFAOYSA-N 286.322 2.023 10 10 CECE O[C@H](CC1OCCO1)c1ccc(N2CCCCC2)cc1 1999521585 OLFLGMRNUGIBNF-OAHLLOKOSA-N 277.364 2.473 10 10 CECE CCN[C@H]([C@H](O)c1ccc2c(c1)CCN2C)[C@@H]1C[C@H]1C 2151028703 JXDZKRLXPQZLOB-QQDQCYIDSA-N 274.408 2.346 10 10 CECE NC1[C@H]2CN(Cc3cc(Cl)cc(Cl)c3O)C[C@H]12 2000285629 VERNCRCMYIAPCN-IUCAKERBSA-N 273.163 2.088 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)[C@H](C)C(F)(F)F 2151708825 HOTKLZOHWJPLSB-RKDXNWHRSA-N 289.301 2.478 10 10 CECE CN(c1cc(Cl)c(CN)cc1F)[C@H]1CCOC1 2008204611 FCRNFQNSCIYKGJ-VIFPVBQESA-N 258.724 2.163 10 10 CECE C[C@H]1CCN(c2cc3c(cc2N)NC(=O)CC3)C[C@@H]1F 2152278156 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10 CECE Cc1ccc(O)c(CN2CCC3(CC2)C[C@H]3C(=O)O)c1 405280343 BFVPWXRMZJEDJP-ZDUSSCGKSA-N 275.348 2.387 10 10 CECE OC[C@@H]1CCC[C@@H](NCc2cc(F)ccc2O)C1 310711649 CTSJFYXOSZBHFK-ZWNOBZJWSA-N 253.317 2.172 10 10 CECE Oc1c(F)cccc1CN1CCC[C@]12CCOC2 310986362 RWDFCVYIGXGSML-CQSZACIVSA-N 251.301 2.286 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H](C)C[C@H]2C(=O)O)c1 2159259817 ONHLGKOTIYVRGT-KWBADKCTSA-N 279.336 2.257 10 10 CECE Oc1cccc(CNC[C@H]2CC23CCC(O)CC3)c1O 2157511947 MILYRFXHQMCJLI-VEAWUBTESA-N 277.364 2.129 10 10 CECE CC1(C)CCN(CCCc2ccc(N)cc2)CC[S@@]1=O 321841362 HTZDFQWXGDRFRI-FQEVSTJZSA-N 294.464 2.434 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3CCC[C@]3(CO)C2)cc1O 2159405612 QHSLRCYVGDFJRS-HWWQOWPSSA-N 277.364 2.044 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cn3ccccc3n2)C1 701323164 NSPXDOGHADFFRN-SNVBAGLBSA-N 270.296 2.249 10 10 CECE C[C@@H](N)c1ccc(N2CCN3C(=O)OC[C@@H]3C2)c(Cl)c1 2170703124 FFHLPSVCAUTUCH-KOLCDFICSA-N 295.770 2.001 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@H]2COC(C)(C)CO2)cc1 2176652369 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270.332 2.051 10 10 CECE COc1ccc(O)c(CNCc2cnn(C(F)F)c2)c1 2177342405 ODCXUAUSQDZNNW-UHFFFAOYSA-N 283.278 2.282 10 10 CECE CNCc1cc(F)c(N2CC[C@@](C)(OC)C2)c(F)c1 382399251 WYLAARUYIQFKFD-CQSZACIVSA-N 270.323 2.299 10 10 CECE CCOc1nc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)co1 2172857253 WPMNTQJWVAMKCE-SECBINFHSA-N 279.300 2.378 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](O)[C@H]2C)c(F)c1 384807362 ZXBZVHIDJVYLCN-GPCCPHFNSA-N 252.333 2.195 10 10 CECE O=C(NCC[C@@H]1CC[C@@H]2C[C@H]12)c1cccc(O)c1O 717157607 SFRZXCZBCZSBGF-HOSYDEDBSA-N 261.321 2.264 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](CO)[C@H]2C)cc1 385856165 YONLQQBOCCNHJY-UKRRQHHQSA-N 262.397 2.392 10 10 CECE OCc1cc(F)c(N2[C@H]3CC[C@H]2CC(CO)C3)c(F)c1 719237843 FZSJRKRAKMNJDT-RYUDHWBXSA-N 283.318 2.197 10 10 CECE CCC(F)(F)CNC(=O)[C@@H]1CNc2ccccc2N1 697650959 UCERFWOSQWRAFE-NSHDSACASA-N 269.295 2.054 10 10 CECE CO[C@@H]1CC[C@H]1N(C)c1ccc(CN)c(Cl)c1 724134618 HIVUGJLNXMARKV-CHWSQXEVSA-N 254.761 2.412 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)c1ccc(CN)c(Cl)c1 724134620 HIVUGJLNXMARKV-QWHCGFSZSA-N 254.761 2.412 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CCN(C)C[C@@H]3C2)cc1 394349354 YNMKHXMLDRISGS-VNQPRFMTSA-N 273.424 2.355 10 10 CECE CC[C@]1(C)C[C@@H]1NC(=O)CCOc1ccc(N)cc1 397393185 ONAFXTCSVUUVPC-DZGCQCFKSA-N 262.353 2.343 10 10 CECE C[C@H](C[S@](C)=O)N(C)c1ccc(CNC2CC2)cc1 399076424 JNDLUEMWDNERMV-BLVKFPJESA-N 280.437 2.142 10 10 CECE CC[C@H]1C[C@H](C)CN1CC(=O)Nc1ccc(N)cc1 399690368 URRXZLMPTOLJHP-FZMZJTMJSA-N 261.369 2.328 10 10 CECE CC(C)c1nc(N)cc(N(C)Cc2ccc(N)cc2)n1 2173803793 GYFVHLIYUIXAIN-UHFFFAOYSA-N 271.368 2.401 10 10 CECE CC[C@@H](NC(=O)CCOc1ccc(N)cc1)C(F)(F)F 2174092409 RWIWKEYYPOEHMX-LLVKDONJSA-N 290.285 2.495 10 10 CECE CC1(C)[C@H](O)C[C@@H]1CC(=O)N1Cc2cccc(O)c2C1 2064106945 GHXFZDJWIMHIDJ-BXUZGUMPSA-N 275.348 2.032 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)C[C@]1(C)COCCO1 2174264242 OQIYLVUURVTLFT-IAQYHMDHSA-N 283.343 2.330 10 10 CECE CCNCc1ccc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)c(C)c1 2174637712 AIHVTJNAXSMYBI-PHZGNYQRSA-N 274.408 2.433 10 10 CECE C[C@@H](c1c(O)cccc1F)n1cc(C(=O)NC2CC2)cn1 2069957657 QOSHKOBJCDAKDG-VIFPVBQESA-N 289.310 2.229 10 10 CECE CO[C@H](C)CCN(C)c1cc2c(cc1Cl)[C@H](O)C(=O)N2 2179917705 SVTUGZCIAIYFIY-OQPBUACISA-N 298.770 2.187 10 10 CECE NCc1ccc(N2CC[C@@H](O)CC23CCC3)c(F)c1F 2169892590 IEBYENZFHDNCDQ-LLVKDONJSA-N 282.334 2.307 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1O 2170378249 GVALCOOTOHULAA-SGMGOOAPSA-N 277.412 2.331 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H]3[C@@H]4CCCO[C@@H]43)ccc21 2176434952 WVEXURWNEJKDQO-HJWJTTGWSA-N 272.392 2.494 10 10 CECE C[C@@H](NC(=O)C[C@H]1CNC(C)(C)C1)c1ccccc1O 2192623312 FIRKZIIARCSQDU-VXGBXAGGSA-N 276.380 2.348 10 10 CECE CCN[C@H](CC)c1ccc(N2CC(=O)NC[C@H]2C)cc1 2181163047 QMFPVVSPHOMCAK-IUODEOHRSA-N 275.396 2.072 10 10 CECE Cc1cc(N2CCN(C)C3(CC3)C2)ccc1C[C@@H](C)N 2188423848 BCXKUNHJKLGGTK-CQSZACIVSA-N 273.424 2.169 10 10 CECE COc1cccc(CNC[C@@H]2C[C@@H]3CC[C@H](C2)O3)c1O 2181490941 JANGZVJJCSLEHJ-UBSAEIQESA-N 277.364 2.448 10 10 CECE C[C@@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)[C@H](C)CCO1 2188576291 MRQXCBWCWBDPMF-GHMZBOCLSA-N 280.324 2.091 10 10 CECE COC[C@H]1CCCCN1c1ccc(CO)c([N+](=O)[O-])c1 2188577410 SPIFUDVGIAMZPH-CYBMUJFWSA-N 280.324 2.092 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2[C@H]3CC[C@@H](O3)[C@H]21)c1cc(O)ccc1O 2188732067 RYULLPXOIYVWNK-SBHGQNAGSA-N 275.348 2.314 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@]3(C2)C[C@@H](O)C3)c(F)c1 2182396836 USAHHBGWTLBFFX-DETPVDSQSA-N 278.371 2.457 10 10 CECE CO[C@H]1CCN(CCOc2ccc(N)cc2)[C@@H]1C(C)C 2182491406 OUVOJEIGDRVGOE-JKSUJKDBSA-N 278.396 2.393 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@@H]2C(C)C)cc1O 2182498382 VDYYKIRFBAGUEP-XFJVYGCCSA-N 278.396 2.268 10 10 CECE Oc1ccc(CNC[C@H]2CCOCC23CCC3)c(O)c1 2189744444 CTKYQAXVDWRMCJ-CYBMUJFWSA-N 277.364 2.394 10 10 CECE O[C@H]1CCCc2cc(N3C[C@@H](O)[C@H](C4CC4)C3)ccc21 2184691499 OXXZCVMSFOJNCL-YESZJQIVSA-N 273.376 2.263 10 10 CECE Cc1noc(CN(C)c2ccc3c(c2)CCC[C@@H]3N)n1 2184684088 IGSVFBAWDRKYEX-AWEZNQCLSA-N 272.352 2.351 10 10 CECE CN(Cc1ncccn1)c1ccc2c(c1)CCC[C@H]2O 2184690911 ILFWAKYQTRMXRH-OAHLLOKOSA-N 269.348 2.483 10 10 CECE CN(C[C@@H]1[C@H]2CCCO[C@@H]12)c1ccc2c(c1)CC[C@H]2N 2184723154 JHJHHSIDDSOAHQ-QBPKDAKJSA-N 272.392 2.494 10 10 CECE O[C@H]1CCc2cc(N3CCCN4CCC[C@H]4C3)ccc21 2184735535 HVUIBYCIUCAJQY-RDJZCZTQSA-N 272.392 2.341 10 10 CECE CC[C@@H](CNCc1c(O)cccc1OC)COC 2042580763 HFIJVUFQRRQSJC-NSHDSACASA-N 253.342 2.163 10 10 CECE Cc1cccc(O)c1CN(C)C(C)(C)CC(=O)O 2042626112 FBSGVOPOCJYPRR-UHFFFAOYSA-N 251.326 2.386 10 10 CECE C[C@@H]1NC[C@@H](C)N(Cc2c(O)cccc2F)[C@H]1C 2042636836 BUSQKMMETHALFS-VWYCJHECSA-N 252.333 2.102 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3CCO[C@H]3C2)cc1O 2184832981 MIIVOJWTZKTRJI-HSMVNMDESA-N 276.380 2.288 10 10 CECE Nc1ccc(CCC(=O)OC[C@@]23CCOC[C@H]2C3)cc1 2194454135 MEFYWNJUSUFFGM-CJNGLKHVSA-N 275.348 2.171 10 10 CECE CC1(C)CC(CO)(NCc2c(O)cccc2F)C1 2045117060 UUYFRJKNVOKGOM-UHFFFAOYSA-N 253.317 2.172 10 10 CECE Cc1cc([C@@H](NCCN=[N+]=[N-])C(N)=O)ccc1Cl 2045547673 LJWIYSXZYJUHQF-SNVBAGLBSA-N 267.720 2.075 10 10 CECE Cc1oc(C(=O)O)cc1COc1cnc(Cl)nc1 2046987765 NPHYHIAMFNBVFF-UHFFFAOYSA-N 268.656 2.309 10 10 CECE O=C(O)CC[C@H]1CCN1Cc1ccc(Cl)cc1O 2047050774 YORUFRYMFBFFLF-NSHDSACASA-N 269.728 2.485 10 10 CECE Oc1cccc(CNCCOCCC2CC2)c1O 2047218206 SSPQVNBRKYHXCU-UHFFFAOYSA-N 251.326 2.004 10 10 CECE CCN[C@@H](C)c1cc(F)c(N2CC(C)(CO)C2)c(F)c1 2194698606 YPDMWFWOGCWZAX-JTQLQIEISA-N 284.350 2.454 10 10 CECE C[C@H](N[C@H](C)c1ccc(F)cc1O)c1cnn[nH]1 2049945316 MAGKOAOIWYBVHE-SFYZADRCSA-N 250.277 2.061 10 10 CECE Nc1ccc(N2CCO[C@H](c3nccs3)C2)cc1 2051794396 PVFOSLJQELNEKV-LBPRGKRZSA-N 261.350 2.303 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2C[C@H]3O)cc1Cl 2052053593 MCVONOKDHVGBOG-AOGLXQGOSA-N 266.772 2.319 10 10 CECE CC(C)[C@@]1(C)CCN1c1ccc2c(c1)N(C)C(=O)[C@H]2O 2191217846 NUNILGSSKCIZSV-GOEBONIOSA-N 274.364 2.321 10 10 CECE C[C@H]1CCC[C@H]1S(=O)(=O)Nc1ccc(O)cc1F 2055300686 LKKCZCDKOYYKCO-QPUJVOFHSA-N 273.329 2.462 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1C[C@@H]2CC[C@H](C1)N2 2191527556 YWRCZHHZOYJHKM-BTTYYORXSA-N 274.368 2.016 10 10 CECE Nc1ccc(NC(=O)NC[C@H](F)C(F)(F)F)cc1 2059192312 FATOFHFTTFGBMW-QMMMGPOBSA-N 265.210 2.291 10 10 CECE Nc1ccc(CN=c2[nH]c3ncccc3s2)cc1 2067462332 FEOACPNURLAVRI-UHFFFAOYSA-N 256.334 2.308 10 10 CECE COC(OC)[C@H](C)N(C)[C@H](C)c1ccccc1O 2072448529 NHEDRGBZDSFLMI-MNOVXSKESA-N 253.342 2.392 10 10 CECE CCOC(=O)[C@@H](C)CN[C@@H](C)c1ccccc1O 2072481683 JSHZIGVQCQMVLO-QWRGUYRKSA-N 251.326 2.242 10 10 CECE CNCc1ccc(N2C[C@H]3COCC[C@H]32)c(Cl)c1 2073006701 APINLMAWCXYWKZ-WCQYABFASA-N 266.772 2.285 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCC2CC1(C(=O)O)C2 2192518006 SREDUWSMOBDREA-YLTRJXTNSA-N 277.320 2.098 10 10 CECE C[C@H](O)c1cc(F)c(N2CCOC[C@@H]2C)c(F)c1 2074081851 LXVWGMUDSOXPPH-IUCAKERBSA-N 257.280 2.243 10 10 CECE Cc1cccc(O)c1CN[C@H]([C@@H](C)O)C(F)(F)F 2074720363 MVKZSCGMRVZMDM-LDYMZIIASA-N 263.259 2.102 10 10 CECE CNCc1ccc(N2CC[C@H](OC)[C@@H](OC)C2)cc1Cl 2199548232 OWNKYINYHUIZNJ-GJZGRUSLSA-N 298.814 2.300 10 10 CECE C[C@@H]1OC2(C)CC1(C(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C2 2100447721 RRMVJYJHKRPTRK-WPMGSTCASA-N 264.329 2.103 10 10 CECE C[C@@H]1OC2(C)CC1(NC(=O)Nc1ccc(N)cc1)C2 2100450718 XMBYGPMAFYNSHC-SQNUNTJVSA-N 261.325 2.100 10 10 CECE Nc1ccc(CCN[C@H]2COC[C@H]2CC2CC2)cc1 2101847824 PUQCDHYTGUCMLR-ZBFHGGJFSA-N 260.381 2.216 10 10 CECE C[C@@H](CCN)N(C)Cc1ccc2c(c1)CCCN2C 2102578748 XYSFFOQPGKKVRP-ZDUSSCGKSA-N 261.413 2.238 10 10 CECE CC1(C)C[C@@H](CCNCc2ccc(O)cc2O)CO1 2103191381 RJDDPTHFFMJTRK-LLVKDONJSA-N 265.353 2.393 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC=C[C@@H](C(=O)O)C1 2103552176 BMFGTLKKKKZNNP-VHSXEESVSA-N 265.284 2.165 10 10 CECE CCC1(S(=O)(=O)NCc2cccc(C)c2O)CC1 2084059649 WUHCQEDHXZQJHK-UHFFFAOYSA-N 269.366 2.063 10 10 CECE CN(C)CC(C)(C)CNCc1ccc(F)cc1O 2084169568 ANEQOLWNOULVQL-UHFFFAOYSA-N 254.349 2.209 10 10 CECE Oc1cccc(F)c1CN[C@H]1CCN2CCC[C@H]1C2 2104471924 MZLDCYNBXGYRKK-FZMZJTMJSA-N 264.344 2.105 10 10 CECE COc1cccc(O)c1CN1CCO[C@H]2CCC[C@@H]21 2104433817 MIPJKHVYOAHKMG-WFASDCNBSA-N 263.337 2.154 10 10 CECE Nc1ccc(CCCN2CCC23CC(CO)C3)cc1 2104537443 CFQFCRBRHMNBJT-UHFFFAOYSA-N 260.381 2.048 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CC(C)(C)[C@H]2O)c1 2105102094 NINQRFKOTHBEJW-WFBYXXMGSA-N 265.353 2.211 10 10 CECE CC1(C)[C@H](O)CC[C@H]1NCc1cccc(F)c1O 2086016059 NXNPRMXJMWUKHE-VXGBXAGGSA-N 253.317 2.170 10 10 CECE COc1ccc(N2C[C@]3(C)CNC[C@]3(C)C2)c(C)c1 2106384843 ZZNMWVPNKPZIFB-IYBDPMFKSA-N 260.381 2.439 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCCO3)C[C@H]1CCN 2106387971 IHBLELFFRHZNHX-GXTWGEPZSA-N 260.381 2.433 10 10 CECE c1cc2c(cc1N1CC[C@@H](C3CNC3)C1)CCCO2 2106373246 IXBCZCHANIHUDL-CYBMUJFWSA-N 258.365 2.057 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H]3CC[C@H](N)C3)ccc21 2106790939 NLLGGIUYBJZLCK-DIOULYMOSA-N 260.381 2.230 10 10 CECE CCN1CCc2cc([C@@]3(N)CC[C@@H](C)OC3)ccc21 2106790427 IEUVRTAXZCJHKI-MLGOLLRUSA-N 260.381 2.422 10 10 CECE CC[C@@H]1NCC[C@@H]1[C@H](O)c1ccc2c(c1)CCN2C 2106791647 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Oc1ccc([C@H]2NCCc3ccc(O)c(F)c32)cc1O 83623236 XDRCMTCNTVOWJH-OAHLLOKOSA-N 275.279 2.178 10 10 CECE Cc1cc(O)c2c(c1)[C@H](c1cc(O)ccc1O)NCC2 83625981 XEDKVTHMMDQOSV-MRXNPFEDSA-N 271.316 2.347 10 10 CECE COc1cc(OC)c2c(c1)/C(=C/C(=O)O)CCN2C 84145795 PMYMGIARWSMJEG-RMKNXTFCSA-N 263.293 2.012 10 10 CECE CN(C)c1ccc(Cn2ccc3c(N)ncnc32)cc1 84644184 IVARIIWLPQCPCQ-UHFFFAOYSA-N 267.336 2.128 10 10 CECE CC[C@@H]1CN(COC)c2cc(OC)c(OC)cc2N1 76929942 UYVJRXLRZWMOKN-SNVBAGLBSA-N 266.341 2.318 10 10 CECE [N-]=[N+]=NC[C@@H]1CN=C(N)N1c1cccc(Cl)c1 93379187 XGXHKUNVLCNRSR-VIFPVBQESA-N 250.693 2.154 10 10 CECE NCc1ccc(N2CCN3CCC[C@@H]3C2)c(Cl)c1 94456790 ACVPJVYARZLLPI-GFCCVEGCSA-N 265.788 2.083 10 10 CECE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN1CC 1137346957 RLOWTMQPIVSADN-AWEZNQCLSA-N 276.380 2.225 10 10 CECE OC[C@@H]1CCC[C@H](NCc2ccc(F)c(F)c2O)C1 703345777 AMZAGAHRDGDHSD-KOLCDFICSA-N 271.307 2.311 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H]3CNC[C@@]3(C)C2)c1O 703618849 HEBQHKRRXYJGCU-NHYWBVRUSA-N 296.798 2.096 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1cccc(OC2CC2)c1 704385891 YGRVBDOBQFRYFJ-LBPRGKRZSA-N 276.296 2.253 10 10 CECE COc1ccc(N(C)Cc2ccnc(C)n2)c(OC)c1 796448930 KPINGNPVWFQMEP-UHFFFAOYSA-N 273.336 2.439 10 10 CECE C[C@@H]1O[C@H](C)C[C@@H]1CNCc1cccc(O)c1O 686508283 LSWBPUBUMCUWRJ-JFGNBEQYSA-N 251.326 2.001 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])C1(CC)CC1 687562243 LKHWMFCFZIEABU-SNVBAGLBSA-N 254.334 2.398 10 10 CECE OCc1ccc(N2CC(OCC(F)F)C2)c(Cl)c1 687935070 WDAZEIKRLVBQTC-UHFFFAOYSA-N 277.698 2.303 10 10 CECE CS[C@H]1CCC[C@H]1N(C)CC(=O)Nc1ccc(N)cc1 687966244 XXXWKZOGIOOAAK-KGLIPLIRSA-N 293.436 2.423 10 10 CECE CCN(c1ccc(CN)c(F)c1F)C(C)(C)CO 688361725 REXPZQGCQORALD-UHFFFAOYSA-N 258.312 2.021 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CCCSCC2)cc1 692313740 PRPCZYAUOXPQTF-LBPRGKRZSA-N 280.393 2.050 10 10 CECE CNCc1ccc(OCCCCCC(N)=O)c(C)c1 2278356284 BGSXMJDQTFKUEB-UHFFFAOYSA-N 264.369 2.139 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](CN)C1CCC1 698444128 CBOGSMSSHWOUFB-BXUZGUMPSA-N 276.380 2.287 10 10 CECE CCN1CCC[C@H]1CN(C)CCc1ccc(N)cc1 92622777 FAZJMVOTDUGJEQ-INIZCTEOSA-N 261.413 2.227 10 10 CECE CCn1ccnc1C[C@H](N)c1ccc(N(C)C)cc1 97304872 QYAYDFCYOCGZRA-AWEZNQCLSA-N 258.369 2.212 10 10 CECE Cc1nsc(NC(=O)c2ccc(N=NC(N)=O)cc2)n1 1160902511 YBICKZKDHLZPAE-UHFFFAOYSA-N 290.308 2.261 10 10 CECE FC(F)(F)CONCc1ccc(N2CCOCC2)cc1 133815914 OYASRWBHRFYLAR-UHFFFAOYSA-N 290.285 2.107 10 10 CECE C[C@]12CN(c3cc(Cl)c(CN)cc3F)C[C@]1(CO)C2 2120884570 LIPKRJXPXHYCDI-KBPBESRZSA-N 284.762 2.147 10 10 CECE CN(C)c1cc(F)c(CNCC2(CCO)CC2)cc1F 1329156581 PTJBCGDVNHOQAB-UHFFFAOYSA-N 284.350 2.283 10 10 CECE NCc1ccc(N2CCO[C@@H](c3nccs3)C2)cc1 2115203438 CMKBOZNCDOEHAZ-CYBMUJFWSA-N 275.377 2.180 10 10 CECE C[C@H]1CC(F)(F)CN1CC(=O)c1ccc(O)c(O)c1 2115448766 APTFEBAUKBQJSY-QMMMGPOBSA-N 271.263 2.010 10 10 CECE CCOc1cccc(CN[C@]2(C)CCC[C@@H]2O)c1O 2126323261 TYTKBQIZLMEEFM-DZGCQCFKSA-N 265.353 2.184 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]2CC[C@H](C1)O2 2124917045 NMIHIYKYGBEMCU-YFKTTZPYSA-N 264.329 2.245 10 10 CECE CCN(CC)C(=O)CCCN1CCC[C@H]1CN=[N+]=[N-] 2123016321 WQOICFQHMCGFNL-LBPRGKRZSA-N 267.377 2.410 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@H]3N)C[C@@H]1O 2128276882 GVEDSEJXVRJILG-LYRGGWFBSA-N 260.381 2.230 10 10 CECE CN(Cc1nccn1C)c1ccc2c(c1)CC[C@H]2O 2128317041 MCLGNSLWZLNWDU-CQSZACIVSA-N 257.337 2.036 10 10 CECE CN(Cc1nccn1C)c1ccc2c(c1)CC[C@@H]2O 2128322062 MCLGNSLWZLNWDU-AWEZNQCLSA-N 257.337 2.036 10 10 CECE N[C@H]1CCc2cc(N3CC[C@H]4CCO[C@@H]4C3)ccc21 2128420499 KFXUQRYRIZRSIP-KNXALSJPSA-N 258.365 2.248 10 10 CECE Cc1cc(CO)ccc1N1CC[C@@H](O)[C@@H]1C(C)(C)C 2128760710 KFLPGHXKYCSOJH-HUUCEWRRSA-N 263.381 2.473 10 10 CECE CN1C[C@@H](NCc2ccc(Cl)cc2O)CCCC1=O 2131965564 CYBYFQKQFGTFJM-LBPRGKRZSA-N 282.771 2.146 10 10 CECE C[C@@]12CC[C@@H]1CCN2c1ccc(CO)c([N+](=O)[O-])c1 2132057438 DMVHZTMCXPIADM-BXUZGUMPSA-N 262.309 2.466 10 10 CECE Cc1ccc(CNCC[C@@H](C)N)c(O)c1Br 1905140223 XWXRBAYNBIFSKG-SECBINFHSA-N 287.201 2.290 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 1912188361 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IPCDQVSKZKIEMI-UHFFFAOYSA-N 267.332 2.338 10 10 CECE CC1(C)C[C@H]1CNC(=O)CCOc1ccc(N)cc1 232811723 DDAYVBDQKKLBOD-NSHDSACASA-N 262.353 2.200 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2C[C@H]1C[C@H](O)C1 2140469879 VOIYXXAGIWVCLW-HUBLWGQQSA-N 260.381 2.230 10 10 CECE CCN(CC(C)(C)CN)[C@@H](C)c1c(O)cccc1O 233440400 CMWGWMHVBBEGLP-NSHDSACASA-N 266.385 2.466 10 10 CECE C[C@@H](NCCCn1ccnn1)c1ccc(N(C)C)cc1 126413455 XQOILCXFCDUQOO-CYBMUJFWSA-N 273.384 2.085 10 10 CECE N=C(N)[C@@H](CSc1nccs1)C(F)(F)F 236197715 ZLWZFENRFFIEMS-SCSAIBSYSA-N 255.290 2.350 10 10 CECE Cc1ccc(CN2CCN(CC(F)F)CC2)c(O)c1 876643476 YSPJFHXQDGGNAD-UHFFFAOYSA-N 270.323 2.083 10 10 CECE Cc1ccc(CN2CCO[C@@]3(CCCOC3)C2)c(O)c1 877514346 KHIFFRBFVIOOQD-INIZCTEOSA-N 277.364 2.082 10 10 CECE C[C@H](CCN1CCOC1=O)NCc1cccc(Cl)c1O 1876029088 WKJQBCUUMSQQEI-SNVBAGLBSA-N 298.770 2.366 10 10 CECE Cc1nc(O)cc(N(C)[C@H](C)c2ccccc2O)n1 1877528614 HKGWQZMKHTYITC-SECBINFHSA-N 259.309 2.394 10 10 CECE C[C@H](O)c1cc(F)c(N(CCO)CC2CC2)c(F)c1 1880480428 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CN(C)c1ccc(CN[C@H]2C[C@H](CN)C2(C)C)cc1 1968033769 QHTYWPFTJGIJKQ-HIFRSBDPSA-N 261.413 2.216 10 10 CECE CN(CCOC[C@@H]1CCCCO1)Cc1ccccc1O 1968858013 WFJRNVQUYKHQGD-HNNXBMFYSA-N 279.380 2.410 10 10 CECE Oc1c(CNC2([C@@H]3CCCO3)CC2)ccc(F)c1F 1971552965 FXLXVIMTQQLBFQ-NSHDSACASA-N 269.291 2.472 10 10 CECE CCNCc1cc(F)c(N2CC[C@@H](O)[C@H](C)C2)c(F)c1 166511028 HXOGLCKVJZPBLO-QMTHXVAHSA-N 284.350 2.281 10 10 CECE Oc1cc(Cl)ccc1CNC[C@@H]1C[C@@H]2OCC[C@@H]2O1 1974129044 SVKVQFKWKGHYLI-UBHSHLNASA-N 283.755 2.082 10 10 CECE CN(C)c1ccc(CN[C@H]2CCN(C)C3(CC3)C2)cc1 1974261276 NILMOWMFGJUFOC-HNNXBMFYSA-N 273.424 2.469 10 10 CECE CN1CCCc2cc([C@H](O)[C@H](N)c3ccco3)ccc21 2147626634 XTLHGZGXTVHFAU-CVEARBPZSA-N 272.348 2.395 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@@]2(C)CCCCO2)cc1 2144881223 YPIBMVHCESKRKL-JKSUJKDBSA-N 278.396 2.418 10 10 CECE CNCc1cc(F)c(N2CC[C@@H]3COCC[C@H]32)c(F)c1 2145011397 UBLPZFZNZGARMI-BXUZGUMPSA-N 282.334 2.299 10 10 CECE CC(C)(C)NCc1ccc(N2CC[C@@H]2C(N)=O)c(Cl)c1 2145597831 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CNCc1ccc(OC[C@@H]2COCC(C)(C)O2)c(C)c1 2155019076 MVNWXHPSFTXCCH-AWEZNQCLSA-N 279.380 2.287 10 10 CECE CCC(CC)NC(=O)COc1ccc(CNC)cc1C 2155021066 DQHQDJOWIYUUNZ-UHFFFAOYSA-N 278.396 2.398 10 10 CECE CNCc1ccc(N2CC([C@@H]3CC3(F)F)C2)cc1 2036161347 DUHAAXDCUCUGRW-ZDUSSCGKSA-N 252.308 2.497 10 10 CECE CNCC1CCN([C@H](C)c2ccc(O)cc2O)CC1 63158827 BZHPYQAYMCCZJR-LLVKDONJSA-N 264.369 2.090 10 10 CECE Oc1ccc(F)cc1CN1CCC[C@H]1[C@H]1CCCN1 300417682 YGCUQYFGIPLDLN-KGLIPLIRSA-N 264.344 2.248 10 10 CECE CCOc1cccc(CN(C)[C@H]2CO[C@@H](C)C2)c1O 401510290 HZKKMFAOHVGTHA-WCQYABFASA-N 265.353 2.400 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)C2CCCC2)C1 403673532 QQDSVSQSFWZUIO-VIFPVBQESA-N 258.347 2.034 10 10 CECE C[C@H](NCc1ccns1)c1cc(O)ccc1O 404428990 NOHGDCXDYKGNJA-QMMMGPOBSA-N 250.323 2.405 10 10 CECE C[C@H](N[C@@H]1C[C@@H]1CO)c1cc(Br)ccc1O 309528405 CYIYUEVEAWIWSJ-VAOFZXAKSA-N 286.169 2.186 10 10 CECE CC(C)NC(=O)CSCCc1ccc(N)cc1 310061079 PUTNGPWNCBGSPL-UHFFFAOYSA-N 252.383 2.069 10 10 CECE CC(C)OCOc1ccc(N2CCC(N)CC2)cc1 311565979 AWQDHLFAWFHPIS-UHFFFAOYSA-N 264.369 2.375 10 10 CECE Cc1cc([C@H](NN)c2ccc(N(C)C)cc2)sn1 311787235 QBLAAVHIKRWBLF-CYBMUJFWSA-N 262.382 2.070 10 10 CECE CC(C)C[C@H](C)CN(CC(N)=O)Cc1ccc(N)cc1 312153063 HMHFMCNBVGUFQU-ZDUSSCGKSA-N 277.412 2.238 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])C[C@H](C)c2ccccc21 312527703 FPKOHZDJQUPCBM-IINYFYTJSA-N 274.324 2.462 10 10 CECE COC[C@H]1CCN(CCCOc2ccc(N)cc2)C1 81041914 URKPDISWARITHC-ZDUSSCGKSA-N 264.369 2.006 10 10 CECE Oc1ccc(CNCc2ccc3c(c2)CCCO3)nc1 2160556233 FCYNFEGMHHPRGW-UHFFFAOYSA-N 270.332 2.402 10 10 CECE COc1cccc(O)c1CN[C@@H]1CCCN(C(C)C)C1 2160728461 MAHYOIUNSUBXMN-CYBMUJFWSA-N 278.396 2.363 10 10 CECE CCCN1CC[C@@H](CNCc2c(O)cccc2OC)C1 2160735796 KIJOBIFWXWSOJB-ZDUSSCGKSA-N 278.396 2.222 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)c1cnc(F)cc1C 2161763606 DBRUSEBLUAQYAL-CABCVRRESA-N 276.311 2.229 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CC[C@H]1SC 702430403 ZYBYQUCFTAALOY-GHMZBOCLSA-N 266.366 2.361 10 10 CECE Cc1cc(C)c(C(=O)N(C)c2ccc(N)cc2)c(O)n1 702111471 UFQDFGWRUGQJPX-UHFFFAOYSA-N 271.320 2.263 10 10 CECE C[C@@H](Cn1ccnc1)NCc1ccc(F)c(F)c1O 703417382 KXFLLHLRBYMSKD-VIFPVBQESA-N 267.279 2.045 10 10 CECE C[C@@H]1CN(C)CCN(Cc2ccc(F)c(F)c2O)C1 703517098 IYAKVEZPGNFDRC-SNVBAGLBSA-N 270.323 2.054 10 10 CECE CC(C)n1cnnc1SCC(=O)NCCCCN=[N+]=[N-] 706393418 RTJLQBDYCSMLKX-UHFFFAOYSA-N 297.388 2.158 10 10 CECE O=C(O)CCN(Cc1cc(F)cc(F)c1O)C1CC1 708214571 CLNPWFRLSMSPJF-UHFFFAOYSA-N 271.263 2.110 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)C[C@@H](C)CO 708443421 GFIZQUOUQRBXNT-GFCCVEGCSA-N 262.397 2.312 10 10 CECE CN1CC[C@H]2CN(Cc3cc(F)cc(F)c3O)C[C@@H]2C1 708423340 SGCHMCAIPTXZEH-JQWIXIFHSA-N 282.334 2.054 10 10 CECE CC1(C)C[C@@H](C(=O)NCCCN=[N+]=[N-])C(C)(C)O1 710074694 KVTDQEGGPDIWOU-VIFPVBQESA-N 254.334 2.397 10 10 CECE C[C@H](c1cc(O)ccc1O)N1C[C@H](C)[C@@](C)(C(=O)O)C1 710325895 LVEVREYOBJMKNJ-WMFXKJRFSA-N 279.336 2.201 10 10 CECE Cc1cc(N(C)[C@H](C)c2cn(C)cn2)ccc1CN 710489815 UWDQIEHJXXSZLG-GFCCVEGCSA-N 258.369 2.385 10 10 CECE CCCN1CC(NCc2cccc(Cl)c2O)C1 379166164 MGISOUXLGKMLAW-UHFFFAOYSA-N 254.761 2.229 10 10 CECE C[C@@H]1CSCCN(Cc2cc(N)ccc2O)C1 379518007 LEELKMJASHBAJO-JTQLQIEISA-N 252.383 2.159 10 10 CECE CCc1cccc(CN2CC[C@H]3COC[C@@H]3C2)c1O 690800023 WORUMWIYSBTYKI-GJZGRUSLSA-N 261.365 2.423 10 10 CECE CC[C@](CC1CCCCC1)(NCCN=[N+]=[N-])C(N)=O 720411280 XMJLKFXNHXHFHY-CYBMUJFWSA-N 267.377 2.491 10 10 CECE C[C@H]1[C@H](N(C)C)CCN1Cc1cc(F)ccc1O 380990543 FKAFQCFYLDNQPQ-GXFFZTMASA-N 252.333 2.056 10 10 CECE CN1CC[C@H]2CN(Cc3cc(Cl)ccc3O)C[C@H]2C1 388655032 NEBBAUSFSDZRMR-WCQYABFASA-N 280.799 2.429 10 10 CECE Cc1ccc([C@H](C)NCC2OCCCO2)c(O)c1 716369132 GCNOGCQNVNXUCJ-NSHDSACASA-N 251.326 2.114 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@H](N)C(C)(C)C1 720775708 UAXXMRBVANMFKV-TVQRCGJNSA-N 252.333 2.261 10 10 CECE Oc1ccc(CNCc2cccc(Cl)c2O)cn1 392689889 XUULNZRRHNEQHZ-UHFFFAOYSA-N 264.712 2.436 10 10 CECE CCN(Cc1cnn(C)c1)c1ccc(CNC)c(C)c1 2169980225 ULDBNPVIKQDVBK-UHFFFAOYSA-N 272.396 2.474 10 10 CECE 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Cn1ccc2ccc(C3([C@@](C)(N)C(=O)O)CC3)cc21 1951875327 FIYSDTACIRCHJL-AWEZNQCLSA-N 258.321 2.012 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2C[C@@H](O)C2)c(Br)c1 2212790080 PNWPLWSUWDPJND-INTQDDNPSA-N 299.212 2.428 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCc1ncn(C)n1 148741967 IGPDSZHAWVGTKQ-NWDGAFQWSA-N 286.379 2.210 10 10 CECE C[C@H]1CN[C@H](C)CN1[C@@H](C)c1cc(F)ccc1O 94621963 QUNMRTCCAFQVLI-VWYCJHECSA-N 252.333 2.275 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CCS[C@H]1C 233699151 RZXFRJOAVWDVIE-ONGXEEELSA-N 272.374 2.104 10 10 CECE CCOC[C@@H](NCc1ccc(O)cc1O)C(C)C 233735484 OPEIBLMFTFOOOZ-CYBMUJFWSA-N 253.342 2.249 10 10 CECE CN[C@@H](CO)c1c(C)c(Br)cc(C)c1O 238354384 YAOAVVQKQZKSOU-VIFPVBQESA-N 274.158 2.024 10 10 CECE NC[C@@](CCc1ccc(N)cc1)(CC1CC1)C(=O)O 236228851 WRSIOCJETXZNJB-OAHLLOKOSA-N 262.353 2.031 10 10 CECE CCCNCc1ccc(N2CCC[C@@H]2CO)c(C)c1 50560935 RXPFERDDXGDFSQ-OAHLLOKOSA-N 262.397 2.456 10 10 CECE COc1ccc([C@@H](C)N2CCOC[C@H]2C)c(O)c1 251820257 OXDUWTIEBAZCRB-GHMZBOCLSA-N 251.326 2.183 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C)c2cn[nH]c2)c1 273345735 APJAPZIGPJPQAQ-NXEZZACHSA-N 289.335 2.314 10 10 CECE C[C@@H](N)[C@H]1CCCN(c2ccc3c(c2)OCCCO3)C1 2162631024 KOTHZGLCEOVPDC-OLZOCXBDSA-N 276.380 2.412 10 10 CECE COc1cc(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)ccn1 2166947933 GZIDNABXSGMCJM-JTQLQIEISA-N 275.312 2.253 10 10 CECE COc1cc(N)c(N(C)C[C@@H]2C[C@H](C)CO2)cc1OC 2166258601 WHZXRDMVOXJIPG-QWRGUYRKSA-N 280.368 2.147 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@]1(O)CCS[C@@H]1C 2163130008 CZRDCDNIVGAMAE-HFBAOOFYSA-N 292.448 2.196 10 10 CECE CCN(CC)c1ccc([C@H](NC)[C@H](O)[C@H](C)OC)cc1 2163147203 KTBSOHPIQRBQJG-VBNZEHGJSA-N 280.412 2.189 10 10 CECE N[C@@H](c1ccc(N2CCCC2)cc1)[C@H](O)c1cscn1 2163245490 WXXKGIKKBXPODK-LSDHHAIUSA-N 289.404 2.477 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1[C@H]2C[C@H]2[C@H]2C[C@H]21 2166613398 PDOCHUDIBYRWBE-LFPSSSAGSA-N 270.376 2.314 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC(C[S@](C)=O)C1 2166656868 JTPOWDODLRIPFF-FQEVSTJZSA-N 292.448 2.062 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)c1c(C)n[nH]c1C 2164023169 GECLAPGOWWWQMS-INIZCTEOSA-N 270.380 2.328 10 10 CECE O=C(O)[C@@H](O)c1cc(S)c2c(O)csc2c1 396377233 OJYLRHRLPCTXJD-VIFPVBQESA-N 256.304 2.014 10 10 CECE CC[C@H](NCc1ccc(OC)c(C)c1)[C@@H](O)C(F)F 295071655 PIEZKJMGJPLFAW-WCQYABFASA-N 273.323 2.498 10 10 CECE C[C@@H](O)C(C)(C)NCc1cc(Cl)c(F)cc1O 293594960 KPZQTWAKDSEEQR-SSDOTTSWSA-N 261.724 2.434 10 10 CECE COc1cnc(NCc2c(O)cccc2Cl)nc1 811837313 CMCHLEKRRVEJHL-UHFFFAOYSA-N 265.700 2.456 10 10 CECE COCCNCc1ccc(N2CC=CCC2)cc1C 723166557 YOSDVEUVJNTCJV-UHFFFAOYSA-N 260.381 2.497 10 10 CECE C[C@@]1(CNC(=O)COc2ccc(N)cc2)CCCS1 133870065 OBXVISRJOZXQPD-AWEZNQCLSA-N 280.393 2.050 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2CCN(C)C2=O)cc1Cl 723199319 RDGMVDZYXGVFOW-QMTHXVAHSA-N 295.814 2.287 10 10 CECE CC[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)CCO1 823752441 FPDVCDSRYAKRGE-DGCLKSJQSA-N 280.324 2.348 10 10 CECE C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C(C)(C)CO1 588407894 QVBSGHBOGPGKJU-JPVGGKMYSA-N 291.347 2.137 10 10 CECE C[C@@H](CC(F)(F)F)C(=O)NCc1ccc(O)cc1O 910945756 XWWOKXOFCHSZTL-ZETCQYMHSA-N 277.242 2.303 10 10 CECE COC(=O)c1cnc(SC[C@@H]2C[C@@]23CCOC3)s1 917778347 PYZAYUNOQGMPNR-QPUJVOFHSA-N 285.390 2.448 10 10 CECE C[C@@H]1C[C@@H](NC/C=C\c2ccc(N(C)C)cc2)CCN1 841064116 YJFWMNFKZKOOIX-PJFORWJISA-N 273.424 2.496 10 10 CECE CCc1cccc(CN2C[C@H](C(N)=O)CC[C@H]2C)c1O 848881211 LZQLKBTWZJPJGU-BXUZGUMPSA-N 276.380 2.040 10 10 CECE CCN(CC)c1ccc(CN2CCO[C@@H]([C@@H](C)O)C2)cc1 840978904 XAXVTOBCWGPGKA-RHSMWYFYSA-N 292.423 2.114 10 10 CECE COC1(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 843581027 MDWFUSXTLATWQC-NSHDSACASA-N 262.353 2.109 10 10 CECE COc1ccc(O)c(CN2CCO[C@@]3(CCSC3)C2)c1 843418029 NTFRTGXJUYSRAF-HNNXBMFYSA-N 295.404 2.109 10 10 CECE Cc1cc(O)c(CNC[C@H](O)C2CCOCC2)c(Cl)c1 840897556 BCMHPJMPRIFTBT-HNNXBMFYSA-N 299.798 2.231 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@H]1CCCC[C@@H]1O 131192003 YKIPUPMYYDPVLG-STQMWFEESA-N 270.323 2.163 10 10 CECE C[C@H]1SCC[C@@H]1NC(=O)NCc1c(O)cccc1F 923047115 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COc1cccc(CN2CCC[C@@H](C(=O)O)[C@@H]2C)c1O 384366793 GPYBPOZYMGHBPP-CMPLNLGQSA-N 279.336 2.086 10 10 CECE CCNCc1ccc(N2CCC[C@@H](O)[C@H]2C)cc1C 384917299 ZGRJPVNGRGAXSH-CZUORRHYSA-N 262.397 2.454 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC[C@@H](CO)[C@@H]2C)c1O 386269055 LUVLVZNVGGNYBI-ONGXEEELSA-N 297.782 2.451 10 10 CECE C[C@@H](NCc1nn(C)cc1Cl)c1c(O)cccc1O 393324941 MDQYTAVCGRUGAK-MRVPVSSYSA-N 281.743 2.336 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CCCC12CCC2 394846371 CKFAIAGQXHJYFM-LBPRGKRZSA-N 252.318 2.454 10 10 CECE COCCCCN(C)c1c(F)cc(CN)cc1F 397360671 BFNJAGCLBBNMFP-UHFFFAOYSA-N 258.312 2.286 10 10 CECE COc1ccc([C@@H](C)N(C)C[C@@H]2CCOC2)c(O)c1 398852716 RXOKQPFQEUULEX-NEPJUHHUSA-N 265.353 2.430 10 10 CECE CC(C)[C@@H](C)CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 399466827 SDJJIUJIKIKHEF-XHDPSFHLSA-N 275.396 2.391 10 10 CECE CC[C@H]1CN(c2ccc(CNC3CC3)cc2)C[C@H]1O 399979399 WLRJJWMFBQDTSX-XJKSGUPXSA-N 260.381 2.146 10 10 CECE Cn1cc(C(=O)N2CCC(N=[N+]=[N-])CC2)c(C(F)F)n1 2178754392 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CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)C1[C@@H](C)[C@@H]1C 2190761203 KUVIOJVPCKCJKZ-BNBDDXAPSA-N 274.408 2.202 10 10 CECE CN(Cc1cn(C)cn1)c1ccc(CO)cc1Cl 2042266039 YSLQLQIVWQSTNG-UHFFFAOYSA-N 265.744 2.202 10 10 CECE CN(c1ccc(CO)cc1F)[C@H]1CO[C@H](C(F)(F)F)C1 2185569005 ZKLYVJMVARSOBL-SKDRFNHKSA-N 293.260 2.474 10 10 CECE CN1CCCN(Cc2c(O)cccc2F)CCC1 2042599593 OYWQAOWCJFWRCT-UHFFFAOYSA-N 252.333 2.059 10 10 CECE CN(Cc1c(O)cccc1F)[C@@H]1CCC[C@@H](N)C1 2042625534 KTUOZFJSZXYVDD-GHMZBOCLSA-N 252.333 2.233 10 10 CECE COc1ccc(N2CC[C@H](N)C(C)(C)C2)cc1F 2044281915 RWKVGOZSWWVYJK-ZDUSSCGKSA-N 252.333 2.398 10 10 CECE C[C@H]1CCNC[C@@H]1N(C)Cc1cc(Cl)ccc1O 2045223746 ZTRNZVXNUFTFDJ-GWCFXTLKSA-N 268.788 2.475 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])[C@H](C)C1CCC1 2045879952 ORLZIVAELPCXBB-KOLCDFICSA-N 254.334 2.254 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@@H]2C[C@@H]2[C@@H]1CO 2198996141 PKQNHPUYSUBGPF-QRTARXTBSA-N 272.392 2.064 10 10 CECE O=C(O)C1=CCN(Cc2ccc(Cl)cc2O)CC1 2048886385 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LVXWECYKKTWOHQ-VXGBXAGGSA-N 265.353 2.400 10 10 CECE COc1cccc(O)c1CN1CC[C@H](OC)C[C@@H]1C 2104433777 LVXWECYKKTWOHQ-RYUDHWBXSA-N 265.353 2.400 10 10 CECE COC[C@H]1CCOCCN1Cc1c(O)cccc1Cl 2104914800 WCHPKOCLXLHYNI-LLVKDONJSA-N 285.771 2.283 10 10 CECE CO[C@@H]1C[C@H](C)CN(Cc2c(O)cccc2F)C1 2085083251 KGSBTNDJMHALMQ-WDEREUQCSA-N 253.317 2.388 10 10 CECE N[C@H]1C[C@H]2C[C@@H](C1)N(c1ccc3c(c1)COCC3)C2 2106383504 QEVLDAZYHBHGFM-PJODQICGSA-N 258.365 2.075 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCCO3)C[C@@H]1CCN 2106387972 IHBLELFFRHZNHX-JSGCOSHPSA-N 260.381 2.433 10 10 CECE CN1CCc2cc([C@@](C)(O)C[C@H]3CCCN3)ccc21 2106790647 KKBGGFGIABJAKN-ZBFHGGJFSA-N 260.381 2.029 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3C[C@H]4CC[C@H]3O4)ccc21 2106796463 QUNAJIWEDQRIJG-RRCSTGOVSA-N 258.365 2.246 10 10 CECE C[C@@H]1CCC[C@]1(O)[C@H](N)c1ccc2c(c1)CCN2C 2106851647 WSXNUCCIKKQBDM-HFBAOOFYSA-N 260.381 2.230 10 10 CECE CN(C)c1ccc([C@](C)(O)[C@@H]2C[C@@H]3CCO[C@@H]32)cc1 2106802305 UHYLGTRVYJVEOI-MWNCTCPHSA-N 261.365 2.385 10 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CCN(CC(=O)NC(C)C)[C@H](C)c1cc(F)ccc1O 133198027 YNKYUVNWNMVQBF-LLVKDONJSA-N 282.359 2.439 10 10 CECE CCCOc1ccc(O)c([C@@]2(C)CO[C@@H](C)CN2)c1 83482174 VPRBLHUKKQIZGV-XHDPSFHLSA-N 265.353 2.405 10 10 CECE COc1cccc2c1CCN[C@H]2c1cc(O)ccc1O 83597479 UVCXCFXZFVOHBI-MRXNPFEDSA-N 271.316 2.342 10 10 CECE CCCOC(=O)[C@H](CC)N1CCOc2cc(CN)ccc21 74338330 SEKLWJVKPBHDDW-ZDUSSCGKSA-N 292.379 2.076 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1cc(C)cc(C)c1 90256710 CWERIMBDAOYNPG-GFCCVEGCSA-N 262.313 2.417 10 10 CECE COC[C@H](C)CNC(=O)c1cc2cc(O)c(O)cc2s1 895895754 XYXVJUIJVLVUTO-MRVPVSSYSA-N 295.360 2.325 10 10 CECE Oc1cccc(Cl)c1CNCC[C@H](O)C(F)(F)F 717403759 ACYNWGWKYXSODN-JTQLQIEISA-N 283.677 2.449 10 10 CECE C[C@@H](N[C@@H](CO)CC(F)(F)F)c1ccc(O)cc1O 717767649 IFFXWCHCPZFAFF-HTQZYQBOSA-N 279.258 2.062 10 10 CECE COc1ccc(N(C)C[C@@H]2CCCN(C)C2)c(N)c1 705107887 AXTPFIRDRGTQMD-GFCCVEGCSA-N 263.385 2.055 10 10 CECE Nc1ccc(CS(=O)(=O)NC[C@@H]2CCCC23CC3)cc1 707087553 HNPXRPBXEQJAHO-ZDUSSCGKSA-N 294.420 2.269 10 10 CECE Cn1nc2c(c1[C@@H](O)Cc1ccc(N)cc1)CCCC2 686055605 IEJQPNSFGIAREV-HNNXBMFYSA-N 271.364 2.157 10 10 CECE COc1ccc(CN[C@@H]2CCC[C@H](N(C)C)C2)c(O)c1 715582313 ZKZBYIMXLBDUKF-KGLIPLIRSA-N 278.396 2.363 10 10 CECE Cc1ccc(O)c([C@@H](C)NCC(C)(C)CS(C)(=O)=O)c1 723879273 MZNUMSVMLGXEIR-GFCCVEGCSA-N 299.436 2.422 10 10 CECE Cc1nn(C)c(CC(=O)Cc2ccc(N)cc2)c1Cl 166825672 MAEPNHCCUGJAAU-UHFFFAOYSA-N 277.755 2.318 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@]2(C)CCOC2)cc1O 687509194 BICZTKFYZXEXRL-XHDPSFHLSA-N 264.369 2.275 10 10 CECE CC(C)(C)n1cc([C@H](NCCCN=[N+]=[N-])C(=O)O)cn1 691238253 PLTIDJRJTRVQFB-JTQLQIEISA-N 280.332 2.054 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CCC[C@@H]2O)c(C)c1 689815623 URUSMROIBGEOMM-HOCLYGCPSA-N 262.397 2.312 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CC(C)(C)C3(C)C)cc21 690128119 SKGFDBSIXMLBKY-ZDUSSCGKSA-N 273.380 2.288 10 10 CECE CCN1CC(CN(C)c2ccc(CO)c(Cl)c2)C1 692256800 QVCJJFNNZNTIHX-UHFFFAOYSA-N 268.788 2.220 10 10 CECE CO[C@@]1(CN(Cc2ccc(N)cc2)C2CC2)CCOC1 692422895 CKVRMIOLMXPZGG-MRXNPFEDSA-N 276.380 2.039 10 10 CECE COc1cc2c(cc1OC)N1CCCC[C@H]1CC(=O)N2 694407889 LHUVUAVDBKIWRE-JTQLQIEISA-N 276.336 2.405 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@@H]2CCCCO2)cc1 695027120 HXACEZJCOVZFAU-GJZGRUSLSA-N 264.369 2.028 10 10 CECE CN(C[C@H]1C[C@@H]1C1CC1)C(=O)Cc1ccc(N)cc1 698243766 QURFMPDYZQBSBZ-UKRRQHHQSA-N 258.365 2.316 10 10 CECE COCCNCc1ccc(N2CC[C@@H]3C[C@@H]3C2)cc1 699283588 YGJPXJXVRJLLQO-HUUCEWRRSA-N 260.381 2.269 10 10 CECE Nc1ccc(OCc2nc([C@H]3CSCCO3)no2)cc1 94501402 YNBBSCHZRNEFNP-LLVKDONJSA-N 293.348 2.035 10 10 CECE COC(=O)c1ccc(N[C@H](C)c2ccccc2O)nn1 1307188936 XCFSWIFZQWCGRE-SECBINFHSA-N 273.292 2.142 10 10 CECE O=C1C[C@@H](C(=O)NCc2ccc(O)cc2O)c2ccccc21 1162278762 LMWLDISVKXPETP-CQSZACIVSA-N 297.310 2.084 10 10 CECE O=C(NCc1cccc(O)c1O)c1cc(Cl)ccc1O 1176564677 CWWOATLNHQUKKX-UHFFFAOYSA-N 293.706 2.387 10 10 CECE COC[C@H]1CC[C@H](CNCc2ccc(O)cc2O)C1 2125492413 ZPPXKFJQNULZHW-RYUDHWBXSA-N 265.353 2.250 10 10 CECE CC[C@H](N)CN(CC)c1ccc(OC)cc1[N+](=O)[O-] 2116679996 WGMWAFUOQVUNAI-JTQLQIEISA-N 267.329 2.167 10 10 CECE C[C@H](O)c1ccc(N(C)CC2[C@@H]3COC[C@@H]23)c(F)c1 2118052945 RGGWXLIREOCUKU-XDTLVQLUSA-N 265.328 2.208 10 10 CECE CN(c1ccc(CN)cc1F)C1C[C@H]2C=C[C@@H](C1)O2 2118501676 DDMZNVMLPKKATL-YHWZYXNKSA-N 262.328 2.207 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2CO[C@H]3C[C@@H]2C3)cc1O 2126695654 OWHYOIUTNQGXJV-KLTVKPSUSA-N 263.337 2.059 10 10 CECE CCN1[C@H](C)CN(Cc2cccc(F)c2O)C[C@H]1C 2130387874 ULNUWWQYVZCAHM-VXGBXAGGSA-N 266.360 2.446 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3O)C[C@@H]1F 2128268958 MUZFOLLVINHDCA-RRFJBIMHSA-N 265.328 2.229 10 10 CECE CN(C)[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128277389 NIGDXPPZZXZZLH-GOEBONIOSA-N 260.381 2.197 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H](CO)C3)c(N)c1 2128253200 QSBXEJSAGIXQEY-ZSBIGDGJSA-N 262.353 2.017 10 10 CECE C[C@]1(O)CCCN(c2ccc3c(c2)CC[C@H]3O)CC1 2128317583 QHGZYAXLWQHCAM-CVEARBPZSA-N 261.365 2.408 10 10 CECE CO[C@H]1CN(c2ccc3c(c2)CC[C@@H]3N)CC1(C)C 2128328016 PZIGOSSNNCLKQW-GJZGRUSLSA-N 260.381 2.494 10 10 CECE CCCN(Cc1ccc(N)cc1)CC1[C@H]2COC[C@H]12 2132391577 WYHJZOWNHDVNPI-HZPDHXFCSA-N 260.381 2.373 10 10 CECE Oc1ccc(F)cc1CN1[C@H]2CC[C@H]1[C@H]1CC[C@@H]2O1 1901266023 OJBOJUMMWCYSBF-NZBPQXDJSA-N 263.312 2.426 10 10 CECE Cc1cc(CN)ccc1N1CCC2(CC[C@H]2O)CC1 2130899776 DSNSPQPXGWIKLC-OAHLLOKOSA-N 260.381 2.195 10 10 CECE CN(C[C@@H]1CC1(F)F)c1ccc(CO)c([N+](=O)[O-])c1 2132058133 MTBUJOYVYUKCOL-VIFPVBQESA-N 272.251 2.179 10 10 CECE CN(C)c1ccc([C@H](N)[C@@]2(O)CCC3CC2C3)cc1 2133143740 NDJRSISHMBXNJK-XNZZJLCSSA-N 260.381 2.304 10 10 CECE CO[C@@H]1CCCC[C@H]1N1CCc2cc(CN)ccc21 2133388763 VIFGQCKRCJVPPX-HZPDHXFCSA-N 260.381 2.465 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1cc(Cl)cn1C 1912167382 KHRHAFQXGKJWSK-UHFFFAOYSA-N 255.709 2.451 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C[C@@H]2CC(F)(F)CO2)C1 1912164865 DMJBUSLRGCDMGL-ZJUUUORDSA-N 260.288 2.433 10 10 CECE CO[C@@H](C(=O)N(C)CCN=[N+]=[N-])C1CCCCC1 1912154227 ARXDOUBUYODRQV-LLVKDONJSA-N 254.334 2.350 10 10 CECE O=C(NC[C@H]1C[C@H]1C1CCC1)c1ccc(O)c(O)c1 2135219323 VTAAESKUMUVITI-NEPJUHHUSA-N 261.321 2.264 10 10 CECE C[C@@H](C(=O)N1CCCCC1)N(C)CCCN=[N+]=[N-] 1912174983 HBUBUMGMNZMQSU-NSHDSACASA-N 253.350 2.020 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CCCOC2)c(F)c1 104193777 ISVRIDNCWCBWMV-ZDUSSCGKSA-N 266.360 2.408 10 10 CECE CCN(CC)C(=O)[C@@H](C)N1CCC[C@@H](N=[N+]=[N-])C1 1912197231 QGKFUWDCQBYDGD-GHMZBOCLSA-N 253.350 2.018 10 10 CECE COc1ccc(N2CC[C@@]3(O)CCCC[C@@H]3C2)c(N)c1 213459169 GQDCOVGCXGRWMB-WBMJQRKESA-N 276.380 2.409 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 1912165417 KMDXTVFMWZUFBX-UHFFFAOYSA-N 281.659 2.383 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)COc2ccc(F)cc2F)C1 1912201451 UVGYKSOTTANUDL-SECBINFHSA-N 282.250 2.255 10 10 CECE CC(C)CN1CCO[C@@H](CN2CCC(N=[N+]=[N-])CC2)C1 1912201729 YIXGQDRJPGONHB-AWEZNQCLSA-N 281.404 2.118 10 10 CECE COC1CC(N(C)c2ccc([C@H](C)O)cc2F)C1 1914789639 IYXCNXCYWKCROB-GCVQQVDUSA-N 253.317 2.493 10 10 CECE Nc1ccc(NC(=O)CN2CCCCC23CC3)cc1 1915551205 NHAWVPSAMJUKNN-UHFFFAOYSA-N 259.353 2.226 10 10 CECE CN[C@@H](C)c1ccc(N(C)C(C)(C)C(N)=O)c(Cl)c1 1915544945 QAIRXDFEBZQFLR-VIFPVBQESA-N 283.803 2.321 10 10 CECE C[C@@H]1CCN(Cc2ccc(N)cc2)[C@H](C)[C@H]1C(=O)O 2135947183 BASKFWSPGRHNKD-GYSYKLTISA-N 262.353 2.200 10 10 CECE C[C@H]1CCO[C@H]1CCNCc1cc(F)ccc1O 1918123568 UPKUWMBIDJEQLU-HZMBPMFUSA-N 253.317 2.436 10 10 CECE CC(C)(C)OC(=O)N1CC(NCc2cccc(F)c2O)C1 226613425 NQQFVLIYSZXYOY-UHFFFAOYSA-N 296.342 2.240 10 10 CECE O=C(N[C@H]1COCc2ccccc21)c1cc(O)cs1 1626808559 HRGRZKCKPSSQRX-LBPRGKRZSA-N 275.329 2.455 10 10 CECE Cc1nc[nH]c1C(=O)NCc1cc(Cl)ccc1O 1557387601 WZHIHWCSTDCZCH-UHFFFAOYSA-N 265.700 2.007 10 10 CECE CCOc1cccc(CN2C[C@H](N)CC2(C)C)c1O 1925265823 ZNVNBFKFFUMYFQ-GFCCVEGCSA-N 264.369 2.103 10 10 CECE O=C(NCc1c(O)cccc1F)c1cccc(F)c1O 1558456736 DREOFEHQQOHYIF-UHFFFAOYSA-N 279.242 2.306 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1C[C@H](N)CC12CCC2 1925213424 BBHSPLWDWXUMBR-WDEREUQCSA-N 262.353 2.115 10 10 CECE Nc1cc(F)cc(NC(=O)c2cccc(O)c2O)c1 229536117 MFNSEKYWEWOJKH-UHFFFAOYSA-N 262.240 2.071 10 10 CECE CCOC(=O)[C@@H](CC)[C@H](N)c1ccc(N(C)C)cc1 1927420761 PHBSCQULCWCBBR-UONOGXRCSA-N 264.369 2.342 10 10 CECE CCCNCc1ccc(N(C)C[C@@H](C)O)cc1OC 2139698438 IYPCXXFWQIFYOL-GFCCVEGCSA-N 266.385 2.012 10 10 CECE Oc1cc(F)ccc1CN[C@H]1COC[C@@H]1CC1CC1 2139881889 QYOSXVUWFKLIGT-JSGCOSHPSA-N 265.328 2.436 10 10 CECE Nc1cc2c(cc1N1CC[C@@H]3CCCC[C@@H]31)NC(=O)CO2 162318554 WCQHGWVHJDOPRY-GWCFXTLKSA-N 287.363 2.369 10 10 CECE CNCc1ccc(N2CCC[C@@](C)(O)C2)c(Cl)c1 163356953 VBDGWLVQPPIQSU-CQSZACIVSA-N 268.788 2.411 10 10 CECE Cc1ccnc(NCc2ccc(N)cc2)c1[N+](=O)[O-] 159526223 XBJFSSKVXLJGLQ-UHFFFAOYSA-N 258.281 2.493 10 10 CECE CCN1CCC/C1=C/C=C1/SC(=S)NC1=O 207525029 VXDMQGYKVBQJGW-LDFAFZTOSA-N 254.380 2.018 10 10 CECE Cc1nc(N2C(=O)CCc3cc(N)ccc32)ccc1N 258925853 XBMDINLEYWWRRR-UHFFFAOYSA-N 268.320 2.165 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCCC[C@H]1C 22153717 RTHLAOKDNXFCTN-NEPJUHHUSA-N 261.369 2.470 10 10 CECE Cc1cc2c(cc1N(C)CC(C)(C)CN)OCCO2 258658493 BJMCOTFATSCPDF-UHFFFAOYSA-N 264.369 2.187 10 10 CECE O=C(O)/C=C1/CCCN(c2ccc3c(c2)OCO3)C1 259329014 XBMHHRKEAFNAHB-POHAHGRESA-N 261.277 2.027 10 10 CECE CC[C@H](NC[C@@H]1CCCCNC1=O)c1ccccc1O 2144036988 PPVZWZFSUFISRT-JSGCOSHPSA-N 276.380 2.349 10 10 CECE c1cc2c(cc1CNC[C@@H]1C[C@H]3C[C@H]3CO1)CCO2 1875658453 ACTXYMFRVGLHIE-ILXRZTDVSA-N 259.349 2.136 10 10 CECE CC(C)(CCF)NC(=O)CCOc1ccc(N)cc1 1875804932 WDNPAMKPMIVXPJ-UHFFFAOYSA-N 268.332 2.292 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1CCCC[C@@H]1CCO 2143387767 GNWQEVZXEDBVDK-MFKMUULPSA-N 278.352 2.320 10 10 CECE Cc1cc(N(C)[C@@H]2[C@H]3[C@@H]4C[C@@H]5[C@H]([C@H]34)[C@@H]52)ccc1CN 2143310360 OYUJARKXRHMGEZ-NOCMYWHHSA-N 254.377 2.400 10 10 CECE C[C@H]1CCN(c2c(F)cc([C@@H](C)O)cc2F)[C@@H]1CO 1880489310 YGYUYDFGVDKHOE-IGJMFERPSA-N 271.307 2.225 10 10 CECE C[C@H](O)c1cc(F)c(N2CCCN(C)CC2)c(F)c1 1880486414 GDMHXKWFPVLAAU-JTQLQIEISA-N 270.323 2.160 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCO[C@H](CF)C2)c(F)c1 1880961184 ULXPPMCONCIXTK-PSASIEDQSA-N 274.286 2.159 10 10 CECE OC[C@]1(C(F)(F)F)CCN(Cc2cc(F)ccc2O)C1 895835397 CFGVAVHXYJEGNI-LBPRGKRZSA-N 293.260 2.278 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1C(=O)NCCN=[N+]=[N-] 1885563283 RZOBTLUPCOKILJ-NXEZZACHSA-N 297.359 2.106 10 10 CECE CCn1nnc(Br)c1OCc1ccc(N)cc1 1950431459 XZXLMGDHVPYNQU-UHFFFAOYSA-N 297.156 2.222 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CCOC12CCCCC2 2148164859 QQTFBMSWILMMJT-ZBFHGGJFSA-N 277.364 2.246 10 10 CECE CCCN[C@H](c1ccccc1O)[C@]1(O)COC[C@@H]1CC 2148164184 UUYKCKKXJFIKRB-MAZHCROVSA-N 279.380 2.220 10 10 CECE C[C@H](NC[C@@H]1CCC[C@H]1CO)c1cc(O)ccc1O 251424998 IFSBNRYMXQFVKI-SRVKXCTJSA-N 265.353 2.157 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@H]3C[C@H]2C[C@H]3O)c1O 1967768736 YIJPPNSJSAZVBY-REWJHTLYSA-N 277.364 2.040 10 10 CECE COc1ccc(CN[C@@H]2C[C@H]3C[C@H]2C[C@H]3O)cc1C 1967766017 NVJKVVDWWXTBKR-GBJTYRQASA-N 261.365 2.253 10 10 CECE COc1ccc(N(C)C[C@H]2OC(=O)CC23CC3)cc1 1968599217 KMRZKTBKAHZKSV-CYBMUJFWSA-N 261.321 2.227 10 10 CECE C[C@H](N[C@@H](C)[C@@H](C)S(C)(=O)=O)c1ccc(F)cc1O 1970409298 LLJYRUGRLKSAJE-LPEHRKFASA-N 289.372 2.004 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1C[C@@H]2OCCC[C@@H]21 1972247022 ZPMLOBNVYVOHAT-RTXFEEFZSA-N 269.291 2.328 10 10 CECE CO[C@]1(CNCc2ccc(N(C)C)cc2)CCCOC1 1974255099 LGAGIDKGAQMZRE-INIZCTEOSA-N 278.396 2.038 10 10 CECE CCc1nnc(CN2CCc3cc([C@H](C)N)ccc32)o1 2145825181 AAYIQHVNAAYFBP-JTQLQIEISA-N 272.352 2.214 10 10 CECE COc1ccc(N2CCCNC[C@@H]2C(F)(F)F)cc1 258065507 JARBCZPGBRLETG-GFCCVEGCSA-N 274.286 2.426 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](CO)C2)c(F)c1 162180294 GCCVFUHYEDQYJP-ZDUSSCGKSA-N 266.360 2.142 10 10 CECE CC(C)CN1CC[C@H](N(C)CCc2ccc(N)cc2)C1 2160009840 QNVANDCSXCOGJP-KRWDZBQOSA-N 275.440 2.473 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H](N)C(C)(C)C 40468792 LVWJBOBBLZEBQC-ZWNOBZJWSA-N 264.369 2.285 10 10 CECE C[C@H](O[C@H]1COCC[C@@H]1C)C(=O)Nc1ccc(N)cc1 2152507316 DKIZJPSXQNJIDO-MJVIPROJSA-N 278.352 2.037 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2cc(Cl)c[nH]2)CC1 2006021095 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COc1ccc(CN(C)Cc2cc(N)ccc2O)cn1 2157152003 DTSDEGPSLUJZJU-UHFFFAOYSA-N 273.336 2.010 10 10 CECE COCCCN(C)c1ccc(CNCCOC)c(C)c1 62738429 QZXUTTQJNDLQIB-UHFFFAOYSA-N 280.412 2.204 10 10 CECE NCc1ccc(N2CC([C@@H]3CC3(F)F)C2)cc1F 2036160956 BVBPAKRUECBFHM-NSHDSACASA-N 256.271 2.376 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1ccncc1F 2157388038 QTLNGOGHDDXFJG-NSHDSACASA-N 281.291 2.115 10 10 CECE CO[C@H](C(=O)N1CCC[C@H](N=[N+]=[N-])CC1)C(C)C 2038005290 RGYBFDBJRWYFRS-QWRGUYRKSA-N 254.334 2.349 10 10 CECE CNCC[C@H]1CCCCN1Cc1cc(OC)ccc1O 70190462 QYZAFTQPWLWIDA-CQSZACIVSA-N 278.396 2.365 10 10 CECE Cc1cnc(C)c(NC(=O)c2ccc(O)c(O)c2)c1 404631841 GQCYAMOCDIZPEX-UHFFFAOYSA-N 258.277 2.362 10 10 CECE CC(F)(F)C(C)(C)NC(=O)[C@@H]1CNc2ccccc2N1 405882722 LJTFAWOISCDUBW-NSHDSACASA-N 283.322 2.443 10 10 CECE C[C@H](O)c1ccc(N2CC3(C2)OCCC[C@@H]3O)c(Cl)c1 2159660682 DOXOFPJQNDVMCD-HZMBPMFUSA-N 297.782 2.123 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H]2NCC[C@@H]2C1 312110931 YYDOJKLNQABDGC-JTNHKYCSSA-N 264.344 2.276 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1C[C@H]2CC[C@H]1C2 313512857 ILCYQJRFYHBDSV-NNYUYHANSA-N 266.345 2.254 10 10 CECE Oc1c(F)cc(F)cc1CN(CC1CCC1)C1CNC1 2160200617 YZSZEAUSSWEXIE-UHFFFAOYSA-N 282.334 2.244 10 10 CECE c1cc2c(cc1CNCc1nnc(C3CC3)o1)CCO2 2160560850 SMJNXWWZYLFTBQ-UHFFFAOYSA-N 271.320 2.172 10 10 CECE COc1cccc(O)c1CN[C@@H]1CCCC[C@@H]1CCO 2160721971 DBACOYOVNAVPMH-TZMCWYRMSA-N 279.380 2.432 10 10 CECE C[C@@H]1O[C@H](C)[C@@H](NC(=O)Nc2ccc(N)cc2)[C@@H]1C 701056707 PTMKLLXOQRKJJH-COMAGPEQSA-N 263.341 2.202 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2CCCC2(F)F)cc1 327438852 JYUJMUDATLDEKZ-NSHDSACASA-N 254.280 2.320 10 10 CECE C[C@H](NC[C@]12COC[C@H]1C2(F)F)c1cc(F)ccc1O 2161875693 DBTCVRPUZKCWIZ-CKLFPEKLSA-N 287.281 2.464 10 10 CECE CC(=O)c1ccc(O)c(CN2CCOCC3(CC3)C2)c1 2171034934 YAENGKUGAAFDDZ-UHFFFAOYSA-N 275.348 2.207 10 10 CECE CCN1CCC[C@@H](NCc2ccc(F)c(F)c2O)C1 703308085 MLMKVEGIXNUNMA-LLVKDONJSA-N 270.323 2.244 10 10 CECE CCC[C@H](C)NC(=O)NCCOc1ccc(N)cc1 704172012 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10 10 CECE CN1CCN(c2ccc(CN)c3ccccc23)[C@H]2C[C@@H]21 2168374205 PVIGMUINWHSRBY-IRXDYDNUSA-N 267.376 2.191 10 10 CECE O=C(CN1CC=CCC12CCC2)c1ccc(O)c(O)c1 2169179204 GRRCYPBWNKUFOG-UHFFFAOYSA-N 273.332 2.465 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2ccc3cncn3c2)CC1 2187791531 HTJQMFJFCXHXBF-UHFFFAOYSA-N 270.296 2.155 10 10 CECE O=C(O)C[C@@H]1C[C@@H](NCc2c(O)cccc2Cl)CCO1 2187961083 PHJZKMFMKMHULQ-UWVGGRQHSA-N 299.754 2.158 10 10 CECE CC[C@@H](CN(C)c1cc2c(cc1Cl)[C@@H](O)C(=O)N2)OC 2188438314 SUVVGPQLFBBZML-ISVAXAHUSA-N 298.770 2.187 10 10 CECE O=C(c1cccc(O)c1O)N1C[C@H]2CCC(F)(F)[C@H]2C1 2189991126 FZWOFADZTDLPMW-SCZZXKLOSA-N 283.274 2.215 10 10 CECE Cc1ccc(O)c([C@H](C)NC2CC(n3cnnc3)C2)c1 2184105447 JRAPVUCZYZTFMR-HIFPTAJRSA-N 272.352 2.346 10 10 CECE CN[C@@H]1CCCc2cc(N3CC[C@H](C)[C@@H](O)C3)ccc21 2184679295 GLZBUKONTOIHID-VUCTXSBTSA-N 274.408 2.491 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](C)[C@@H](CO)C3)ccc21 2184711996 YPXOGZKNGVPIKJ-DXCKQFNASA-N 274.408 2.348 10 10 CECE 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CECE C[C@H](N)c1ccc(N2C[C@@](C)(CO)CC2(C)C)cc1O 2199559160 XQVWFPATFJCQCR-ZBEGNZNMSA-N 278.396 2.399 10 10 CECE CCOc1cccc(CNCCCC[S@](C)=O)c1O 2110342146 ZTJZHZCTIILEKL-IBGZPJMESA-N 285.409 2.039 10 10 CECE CC[C@@H]1CC[C@H](CNCc2cccc(O)c2O)O1 2081663863 RTKAPUGWUPRYOI-VXGBXAGGSA-N 251.326 2.145 10 10 CECE CCN(C)c1cc(NCc2ccccc2O)ncn1 2101982037 XYYHRNYWQXRMIO-UHFFFAOYSA-N 258.325 2.250 10 10 CECE CCC(=O)NCCCN[C@@H](C)c1cc(C)ccc1O 2102499684 IISCYXAMHVXUDH-LBPRGKRZSA-N 264.369 2.268 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H]2c2ncon2)cc1 2104146980 WJLNWISKGGZQQM-GWCFXTLKSA-N 258.325 2.431 10 10 CECE COc1cc(N2CC(C(F)(F)F)C2)ccc1CO 2084004142 HULVWUZZQWQMRK-UHFFFAOYSA-N 261.243 2.186 10 10 CECE CCc1nc(C)c(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)o1 2104300713 GEWFAXZYGKIARB-VIFPVBQESA-N 263.301 2.318 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c(Cl)c2)C[C@@H]1CO 2084892587 GTIADICMWADPFT-ZYHUDNBSSA-N 269.772 2.287 10 10 CECE C[C@]1(C(F)(F)F)C[C@H]1NCc1ccc(O)c(O)c1O 2105438191 DVMZDNQVRVLIHR-KCJUWKMLSA-N 277.242 2.234 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252.333 2.142 10 10 CECE CCCN(Cc1ccccc1O)[C@@H](COC)C(C)(C)O 2197242359 VCSZGEUYNYYOHR-HNNXBMFYSA-N 281.396 2.390 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2CCOC3(CCC3)C2)cc1 2197369137 MRKRGTFRTZDREJ-CQSZACIVSA-N 274.364 2.029 10 10 CECE CC(=O)c1cc(Cl)cc(CN(C)C[C@@H]2CCN2C)c1O 2186454796 PEHJJPPFKLONQW-ZDUSSCGKSA-N 296.798 2.384 10 10 CECE CO[C@@H]1CC[C@H]1CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2066826798 LPUQVIQPIVTKPB-HBNTYKKESA-N 252.318 2.103 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H](O)[C@H]3CC[C@@H]32)c(F)c1 2194689636 LPGLFWGVZDSKPF-WNIABHAQSA-N 282.334 2.334 10 10 CECE CCN(C(=O)c1cc(O)c(O)c(O)c1)C(C)(C)C 2068575964 GJAVZWWIULXPQF-UHFFFAOYSA-N 253.298 2.064 10 10 CECE CCCOc1cc(N2CC[C@H](C3(O)CC3)C2)ccc1N 2187042680 RADMNYRSQVMYMJ-LBPRGKRZSA-N 276.380 2.409 10 10 CECE NCc1ccc(N(CC(F)F)C2COC2)cc1Cl 2075874666 ZZXAXSOXIFYUJA-UHFFFAOYSA-N 276.714 2.269 10 10 CECE OCc1cc(F)c(N2[C@H]3CC[C@H]2[C@H]2CC[C@@H]3O2)c(F)c1 2198721016 KAZZQMWPHRWFKF-XDQVBPFNSA-N 281.302 2.356 10 10 CECE 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[N-]=[N+]=NC1CCN(C(=O)c2cccn3nccc23)CC1 1912163481 KBMUOOXQTSVQDH-UHFFFAOYSA-N 270.296 2.249 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)c2ccncc2O)C1 1912162879 BVDGAEHTFSGNIQ-JTQLQIEISA-N 275.312 2.340 10 10 CECE COc1ccc(CC(=O)N(C)CCN=[N+]=[N-])cc1OC 1912166688 AMMZGOBQDXXSSO-UHFFFAOYSA-N 278.312 2.015 10 10 CECE C[C@H](Oc1ccccc1)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1912153605 CPAZPWAGDPZMOQ-WDEREUQCSA-N 260.297 2.365 10 10 CECE CO[C@@H](C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1)C(C)C 1912154698 DEAISBVAULRYPR-WDEREUQCSA-N 254.334 2.206 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1cccc2c1OCCO2 1912204995 ZUFTVADGOUMFES-UHFFFAOYSA-N 276.296 2.230 10 10 CECE CNCc1ccc(OC)c(CN2CC[C@H](OC)[C@@H]2C)c1 1914319920 AXHCJSPSJCRYAW-WFASDCNBSA-N 278.396 2.024 10 10 CECE NCc1ccc(N2CC[C@](F)(CO)C2)cc1C(F)(F)F 1917067456 LKRIMQYLZIPTAA-GFCCVEGCSA-N 292.276 2.075 10 10 CECE COc1ccc(N(C)C(=O)/C=C\c2cnc(OC)nc2)cc1 1527657998 XNSUEKPJGOHWQE-WTKPLQERSA-N 299.330 2.170 10 10 CECE O=C(Nc1cccnc1-n1cccn1)c1cc(O)cs1 1464124573 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CCN(C)[C@H]1CCCN(c2ccc(CNC)cc2)C1 2114837223 HLJUPNVWCIMLTL-INIZCTEOSA-N 261.413 2.327 10 10 CECE OC[C@H]1CC[C@H]1NCc1c(O)cccc1Br 2210355014 GCGBXPTVAPJNSL-LDYMZIIASA-N 286.169 2.015 10 10 CECE CO[C@@H]1CCN(c2ccc(CO)cc2Cl)C[C@@]1(C)OC 2201530115 FRGOZLHUEHLEOC-HUUCEWRRSA-N 299.798 2.463 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)c1cc(C)ncn1 2120876733 HEAPWMDWBFIORE-HNNXBMFYSA-N 256.353 2.160 10 10 CECE COc1cc(N(C)C[C@H]2COC(C)(C)C2)ccc1CN 2204559577 QOJBUWBFICRCAN-LBPRGKRZSA-N 278.396 2.405 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CCC[C@@H]2O)cc1OC 2204544386 AQETUYOTLGSHHI-ZFWWWQNUSA-N 278.396 2.012 10 10 CECE COc1cc(N(C)CC[C@H]2CC[C@@H]2OC)ccc1CO 2204540937 FQDSORJQZLAGPL-DOMZBBRYSA-N 279.380 2.439 10 10 CECE COC[C@@]1(C)CCCN1c1ccc(CO)c([N+](=O)[O-])c1 2204739659 WDQPHHGLSXMLQZ-CQSZACIVSA-N 280.324 2.092 10 10 CECE O[C@@H]1CCc2cc(N3CC(c4nncs4)C3)ccc21 2270018464 OXGMPUDBIBFIRT-CYBMUJFWSA-N 273.361 2.122 10 10 CECE CSc1ncc(CNCC[C@H]2CC(C)(C)NC2=O)s1 2208813898 BHCJRQYLSXMJTP-VIFPVBQESA-N 299.465 2.259 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@H](F)C2)c(Cl)c1 2219164068 CUTARGDRZADBTD-LSJOCFKGSA-N 272.751 2.269 10 10 CECE COc1ccc(N2C[C@H](CO)CC[C@@H]2C)cc1F 2219607585 IURIYAGMYVZYAJ-WDEREUQCSA-N 253.317 2.432 10 10 CECE CN(Cc1ccc(N)cc1)CC1(C(=O)O)CCCC1 2230889863 SNPXXKZBLKPXGC-UHFFFAOYSA-N 262.353 2.346 10 10 CECE Oc1cc(F)ccc1CN[C@H](C(F)F)[C@@H]1CCOC1 2231044394 JJKNRYCFVGIJKS-SKDRFNHKSA-N 275.270 2.291 10 10 CECE Nc1ccc(O)c(CNc2nncc3c2CCCC3)c1 2232763146 UFUCABGTAMPGNR-UHFFFAOYSA-N 270.336 2.255 10 10 CECE Cc1cn2cc[nH]c(=NCc3cccc(C)c3O)c2n1 2232767989 STXWGVKZLVOOAG-UHFFFAOYSA-N 268.320 2.086 10 10 CECE COc1cccc(O)c1CNC[C@@H]1OC[C@H]2CCC[C@H]21 2233214192 BZWUWMBHXNPGNL-HSMVNMDESA-N 277.364 2.306 10 10 CECE OC[C@H]1[C@H]2CC[C@@H](C2)N1c1ccc2c(c1)OC(F)(F)O2 2235066846 JSJNBMMULNWOSF-QXEWZRGKSA-N 283.274 2.358 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@@H](F)[C@H](O)C3)c(OC)c1 2235122292 NOJFKVTZWCWTRD-GCVYGYKWSA-N 281.327 2.144 10 10 CECE COc1ccc(N2CCC[C@@](O)(CO)C2)cc1C(C)C 2235143196 LNYGJTMTJMRFOR-INIZCTEOSA-N 279.380 2.142 10 10 CECE COc1ncc(N(C)Cc2ccc(N)cc2)cc1F 2225528209 GTSYWDMEQMAJSP-UHFFFAOYSA-N 261.300 2.448 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cc(F)ccc1O 2225801338 UXBPBUDOVWSANW-NXEZZACHSA-N 264.260 2.493 10 10 CECE COC[C@H]1C[C@@H]1CN(C)c1ccc(OC)cc1C(=O)O 2235956161 JSPOEJCFFHBKJA-GHMZBOCLSA-N 279.336 2.112 10 10 CECE Cc1cc(C)cc(S(=O)(=O)Nc2ccc(O)c(N)c2)c1 2236144061 RFYHIYNWJPSXNJ-UHFFFAOYSA-N 292.360 2.392 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1[C@H]2CC[C@@H]1CN(C)C2 2226366138 AKRCWSDSERXTKK-WCFLWFBJSA-N 264.344 2.371 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4C[C@H]4[C@@H]3CO)cc21 2226667451 HQLFAVZBSLNSRW-SUHUHFCYSA-N 259.349 2.174 10 10 CECE COc1ccc(N2CC[C@@H](O)C[C@H](C)C2)cc1OC 2226814434 OCRQRICRQYMFTI-WCQYABFASA-N 265.353 2.301 10 10 CECE COc1ccc(N2CCC[C@H]2C[C@@H](C)O)c(OC)c1 2226803274 ARTIXOLJFAGCPU-NEPJUHHUSA-N 265.353 2.444 10 10 CECE COc1ccc(N(C)Cc2cc(C)on2)c(CN)c1 2227675247 GLWKJVBTDFSGOE-UHFFFAOYSA-N 261.325 2.087 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@]3(C)C2)c(CCN)c1 2227685900 MIOWHDYIMNKAMX-BBRMVZONSA-N 260.381 2.433 10 10 CECE COC[C@H]1CN(c2ccc(OC)cc2C=O)C[C@@H]1C 2227692072 IAVYVOKFOPKAFT-WCQYABFASA-N 263.337 2.226 10 10 CECE O=[N+]([O-])C1CN(c2ccc(CNC3CCC3)c(Cl)c2)C1 2240085142 FTKDAAJJDUQGAY-UHFFFAOYSA-N 295.770 2.447 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1CC([C@H](C)O)C1 2240049082 HVTFFIJZCPYJBF-ZDUSSCGKSA-N 274.408 2.454 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](S(C)(=O)=O)CC[C@@H]2C)cc1 2279429644 SLSWMMLLYMQILO-HUBLWGQQSA-N 297.420 2.142 10 10 CECE CN[C@H](C)c1ccc(N2CC(F)(F)C[C@H]2CO)c(C)c1 2240829831 OBGRPTJLVRUHSH-YPMHNXCESA-N 284.350 2.482 10 10 CECE Nc1ccc(N2CC[C@H](N)C[C@H]2C(F)(F)F)cc1 2254997989 ANQBPGHHQATBBY-ONGXEEELSA-N 259.275 2.127 10 10 CECE CSc1ncc(CNC[C@H](CN)C2CCC2)s1 2248732093 DZYGKCJURXSTPX-JTQLQIEISA-N 271.455 2.330 10 10 CECE COCC1([C@H](N)c2ccccc2O)CC(F)(F)C1 2263686758 NHNLAZUQZUGXBD-LLVKDONJSA-N 257.280 2.454 10 10 CECE CC[C@@H](C)[C@@H](NCc1cc(Cl)ccc1O)C(N)=O 2264140118 VSRFNAGFVJVMFC-PRHODGIISA-N 270.760 2.035 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@]4(O)C[C@@H]4C3)ccc21 2265180512 FYGUNEIQJRBFOT-WQVCFCJDSA-N 259.349 2.017 10 10 CECE Cc1nsc(CNCc2ccc3c(c2)CCN3C)n1 2265238330 KUJINGFBHGPJCB-UHFFFAOYSA-N 274.393 2.129 10 10 CECE COC[C@H](CN(C)c1ccc([C@@H](C)N)c(C)c1)OC 2269652412 WDFRJGZPNBIPGK-OCCSQVGLSA-N 266.385 2.112 10 10 CECE Cc1cc(N2CCS(=O)(=O)C(C)(C)C2)ccc1[C@H](C)O 2285171632 ILPQDTLDOXWIHH-LBPRGKRZSA-N 297.420 2.062 10 10 CECE CCN(c1ccc([C@H](C)O)c(C)c1)[C@H]1CCS(=O)(=O)C1 2285173997 GCIOQLQUUNHHNY-JSGCOSHPSA-N 297.420 2.062 10 10 CECE CCCN(CCCCCC(N)=O)c1ccc(CN)cc1 2295815448 JJZNASXURYVSBZ-UHFFFAOYSA-N 277.412 2.407 10 10 CECE O[C@@H](c1ccc(N2CCNCC2)cc1)[C@H]1C[C@@H]2C[C@@H]2C1 2286065081 FVXXEPDLXIEBOT-IVSAIRAKSA-N 272.392 2.176 10 10 CECE COc1cc(OC)c(N2CCC[C@@H]2[C@@H](C)O)c(OC)c1 2287068760 JPINMTJAPMLNQZ-ZYHUDNBSSA-N 281.352 2.062 10 10 CECE C[C@@H](Nc1ncnc2ncn(C)c12)c1ccccc1O 2287156503 YZSPDKPJBTYMDL-SECBINFHSA-N 269.308 2.242 10 10 CECE COc1cc(OC)c(N2CC[C@@H](O)C[C@H]2C)cc1OC 2289333340 WGDLMJCMYSTLJY-GHMZBOCLSA-N 281.352 2.062 10 10 CECE COc1cc(OC)c(N(C)[C@H](C)C(C)(C)O)cc1OC 2289448035 QVSVZJFXVXCFEC-SNVBAGLBSA-N 283.368 2.308 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cc(C(=O)O)cnn1 2289734929 JHKVCOWATLPCMX-VIFPVBQESA-N 273.292 2.078 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ncncc1Br 2300525357 DWWWQJYLJUZFNG-UHFFFAOYSA-N 299.132 2.012 10 10 CECE Cc1ccc(CN2C[C@@H]3C[C@H](C2)N3)c(O)c1Br 2307476349 ADUZCGQQOUUZPN-PHIMTYICSA-N 297.196 2.009 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1N(c1ccc(CO)cc1Cl)C2 2317404470 TVXQGHFOMQDDEH-LERXQTSPSA-N 267.756 2.182 10 10 CECE CSc1ncc(CNCC[C@@]23CC[C@@H](C2)NC3)s1 2318205637 KAOWUCUNTNSTGJ-GWCFXTLKSA-N 283.466 2.487 10 10 CECE C[C@H](CN(C)C)N(C)Cc1ccc(F)c(F)c1O 2326804067 ULPVKKDNRCHXSU-SECBINFHSA-N 258.312 2.052 10 10 CECE CN1CCc2cc(C3(N)CC4(CSC4)C3)ccc21 2328135279 QVMWQGXUZCBJDJ-UHFFFAOYSA-N 260.406 2.360 10 10 CECE CSc1cc(N2CCN(C)[C@H](C)C2)ccc1CN 2328549276 URCVAYZRIZQTRP-LLVKDONJSA-N 265.426 2.008 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](CO)[C@@H]3C2)cc1 2330495003 AXJRRKHBNGRBKB-YYWXWVFPSA-N 260.381 2.032 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@]3(C)O)c1O 2330900495 FBXZBOGSAPTGRW-YXWQFLTLSA-N 261.365 2.340 10 10 CECE CC1(C)COC[C@@H]1CNCc1ccc2c(c1)CCO2 2336142307 RZDWFBIFAGQWDF-AWEZNQCLSA-N 261.365 2.384 10 10 CECE CC[C@@]1(C)[C@H](O)CCN1c1ccc2c(c1)OCCO2 2336871312 KZSIJJKLKOMXST-CABCVRRESA-N 263.337 2.198 10 10 CECE CCN(CCN=[N+]=[N-])C[C@H]1COc2ccccc2O1 2337775559 BLTXLWHWZHUODR-NSHDSACASA-N 262.313 2.459 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[C@H](N(C)C)C2)c1C 2340859441 KCZGWAFQKGOYOY-KBPBESRZSA-N 261.413 2.463 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC[S@@](=O)[C@@H](C)C2)c1C 2341065413 VMSIAPCBKHWSOX-KEVGGSHVSA-N 281.421 2.314 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@H]1[C@@H]2CCC(F)(F)[C@@H]21 2355533802 DZPLAWKPRPWVHL-AATLWQCWSA-N 288.298 2.109 10 10 CECE O=[N+]([O-])c1cc(N2C[C@@H]3C[C@H]2C(F)(F)C3)ccc1CO 2356883524 DFTKOTAICQGEMS-PELKAZGASA-N 284.262 2.321 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H](O)C2)cc1Cl 78905403 BJCXYNXGAYDNTA-ONGXEEELSA-N 254.761 2.321 10 10 CECE CCNC(=O)N1CC[C@H](N[C@@H](C)c2ccc(C)cc2O)C1 186110138 AIWLSAUPPXWWLJ-STQMWFEESA-N 291.395 2.155 10 10 CECE COc1ccc(S(=O)(=O)Nc2ccc(N)cc2)cc1 34955743 GESJVJWIDWIAKQ-UHFFFAOYSA-N 278.333 2.078 10 10 CECE CN(Cc1ccccc1O)C(=O)C[C@@H](N)c1ccccc1 37823763 QLHNOTUDAQBQKH-OAHLLOKOSA-N 284.359 2.441 10 10 CECE CN[C@H]1CCN(c2cc(OC)c(OC)c(OC)c2)C[C@H]1C 49694291 FGZFFGJHGWENKQ-YPMHNXCESA-N 294.395 2.147 10 10 CECE CCCNCc1ccc(N2C[C@@H](C(N)=O)CC[C@@H]2C)cc1 42438224 YMAYZTHXQWUTMK-ZFWWWQNUSA-N 289.423 2.276 10 10 CECE Oc1cccc(CNCc2ccc3c(c2)OCCO3)c1O 41116502 HZNAXTRUZJHGCT-UHFFFAOYSA-N 287.315 2.159 10 10 CECE CCN(CC)c1ccc([C@H](N)C(C)=O)c(OC)c1 1952046429 LAMCOWNRWPJVPT-CQSZACIVSA-N 250.342 2.130 10 10 CECE COC[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 228153397 JDKVAXCLALICIC-SNVBAGLBSA-N 299.212 2.381 10 10 CECE N[C@@H](c1cc(Cl)cc(Cl)c1O)[C@H](O)C1CC1 95814972 JKTBBHYSBWOZLN-VHSXEESVSA-N 262.136 2.470 10 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ALGRVDPGULHPEU-UHFFFAOYSA-N 259.309 2.309 10 10 CECE COC(=O)c1cncc(NCc2cc(C)ccc2O)c1 181717876 DVUDTCZFZHODCD-UHFFFAOYSA-N 272.304 2.494 10 10 CECE O=C(NCc1ccc(O)c(O)c1)C1[C@H]2CCCC[C@@H]12 182538465 QHGIJLYMGDMBHZ-BVUQATHDSA-N 261.321 2.150 10 10 CECE CC[C@@H](NC(=O)CCOc1ccc(N)cc1)c1ncc[nH]1 138365688 JHKUHLJNXBUBND-CYBMUJFWSA-N 288.351 2.028 10 10 CECE CC(C)(C)OC(=O)C[C@](C)(N)c1cc(F)ccc1O 1951874150 XGXBZGLQZVCIGO-AWEZNQCLSA-N 269.316 2.437 10 10 CECE CC(C)(C)OC(=O)C[C@](C)(N)c1cc(O)ccc1O 1951871110 XSOZOYIAXIXCQX-AWEZNQCLSA-N 267.325 2.004 10 10 CECE CCC(=O)CCN1CCN(c2ccc(OC)cc2)CC1 190170810 SZIPXAKHTHUJRH-UHFFFAOYSA-N 276.380 2.186 10 10 CECE CC(C)(C)OC(=O)N1CC(=O)C[C@H]1c1c(O)cccc1O 1951966284 FXBXQDDSQQBNTO-JTQLQIEISA-N 293.319 2.349 10 10 CECE CCN(CC)c1ccc([C@](C)(O)[C@@H](C)N)c(OC)c1 1951905834 MJJDVDSTQDLXNS-IAQYHMDHSA-N 266.385 2.096 10 10 CECE O=C(Nc1ccc(F)nc1F)c1cccc(O)c1O 231793362 JZOJOUCPIXTBAO-UHFFFAOYSA-N 266.203 2.023 10 10 CECE C[C@@H](O)[C@H](N)c1cc(Br)cc(Cl)c1O 95706569 UJDOOFVAKHGXME-VHWMUFPASA-N 280.549 2.189 10 10 CECE CCCn1ncnc1C[C@@H](NC)c1ccc(N(C)C)cc1 97282121 ILQFNMZVCKMERO-OAHLLOKOSA-N 287.411 2.257 10 10 CECE CC1CCN(C(=O)Nc2cc(O)c(O)c(O)c2)CC1 243319014 LMEMPUGIOOBQTN-UHFFFAOYSA-N 266.297 2.067 10 10 CECE C[C@@]1(F)CCCN(Cc2cc3c(cc2O)OCO3)C1 296115182 SPXHYFNWWOBZSY-CQSZACIVSA-N 267.300 2.445 10 10 CECE COc1cc(N(C)Cc2ccn(C)n2)cc(OC)c1OC 271903800 HEXSIXOLHMTHIT-UHFFFAOYSA-N 291.351 2.082 10 10 CECE C[C@H](N[C@@H]1CCc2nc[nH]c2C1)c1ccccc1O 377409040 HIJMHBPETGSBGM-WDEREUQCSA-N 257.337 2.323 10 10 CECE CN1CCc2cc(N3CC[C@H]4NCCC[C@H]4C3)ccc21 2163067894 BJXIQUWOJVHIAF-GOEBONIOSA-N 271.408 2.257 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@H]1OCCO[C@@H]1C 2163078865 KTUPPXCNXYJNQN-WQVCFCJDSA-N 278.396 2.207 10 10 CECE CCO[P@@H](=O)[C@H](N)c1c(O)cc(F)cc1F 382739495 DTYUGMMUCBGJLS-VIFPVBQESA-N 251.169 2.139 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@]2(OC)CCOC2)cc1 2163100177 ONNZLXBECDLSGV-HOTGVXAUSA-N 279.380 2.372 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H](O)C3(SC)CC3)ccc21 2163129762 ATHKZYSMEZEKIK-HUUCEWRRSA-N 292.448 2.325 10 10 CECE COCC1([C@@H](NN)c2ccc(N(C)C)cc2)CCCC1 2163132643 DWFVWXJZDAIUMG-HNNXBMFYSA-N 277.412 2.464 10 10 CECE CCN1CCc2cc([C@@H](N)[C@](C)(O)C(F)(F)F)ccc21 2163135763 NBLUQBIEHHDNBS-OLZOCXBDSA-N 288.313 2.382 10 10 CECE CCn1nccc1[C@H](NC)c1ccc2c(c1)CCN2C 2163137637 FBXGIGXXCQHVDI-MRXNPFEDSA-N 270.380 2.204 10 10 CECE Cc1cccc(CN(C)C[C@@H]2C[C@@H]3OCC[C@@H]3O2)c1O 2163198722 GOHJXTSGHDHBMK-KKUMJFAQSA-N 277.364 2.079 10 10 CECE CN1CCCc2cc([C@@H](N)[C@@H](O)c3cscn3)ccc21 2163229752 LRKSUEUYIVNTBR-CABCVRRESA-N 289.404 2.259 10 10 CECE COC[C@]12C[C@H]1CN(c1ccc(C[C@H](C)N)c(C)c1)C2 2165444586 UICIXMYDONLGDE-JLJPHGGASA-N 274.408 2.357 10 10 CECE CN1CCCc2cc([C@H](O)[C@H](C(=O)O)C3CC3)ccc21 2167001001 OFPIVDOFDMPZOI-CABCVRRESA-N 275.348 2.213 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)C[C@H]1CC12CC2 2165877070 FXSAELHAQXKSCR-GFCCVEGCSA-N 273.380 2.329 10 10 CECE CC(=O)C(=O)COC(=O)C1(Cc2ccccc2)CCC1 808526554 RCJRLQOCDIVJEG-UHFFFAOYSA-N 274.316 2.101 10 10 CECE COc1ccc(N(C)[C@@H]2CCN3CCC[C@H]2C3)c(N)c1 2164415983 RBRGYSZYABEREK-SWLSCSKDSA-N 275.396 2.198 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3C[C@H]4CCC[C@@H]4N3)ccc21 2164670847 PKXXYOWUFPPVOB-ZUFFMMDNSA-N 272.392 2.243 10 10 CECE CCCOc1ccc(N2CCC[C@@H](NCCO)C2)cc1 2162654204 YDMWKUPVPIYMRT-CQSZACIVSA-N 278.396 2.026 10 10 CECE COc1ccc(N2CCc3sc(CN)nc3C2)cc1F 2162671773 SZSCBAVHBQOUON-UHFFFAOYSA-N 293.367 2.312 10 10 CECE CCOC1([C@H](NN)c2ccc3c(c2)CCN3CC)CC1 2166560564 ZOYRUYJNSQUADM-OAHLLOKOSA-N 275.396 2.143 10 10 CECE CCN(C)c1ccc(CN2C[C@@H](O)CC[C@H]2C)cc1 817288468 JJHJCLYEJBXXPM-CJNGLKHVSA-N 262.397 2.488 10 10 CECE CC(C)[C@]1(O)CCCN(c2c(F)cc(CO)cc2F)C1 710284684 PDSHKSLWIMYABY-HNNXBMFYSA-N 285.334 2.444 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H]3COC[C@@H]32)c1O 2129799899 SEVHGLDXFCFTQX-GWCFXTLKSA-N 281.739 2.079 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1C[C@@H](O)C12CCC2 827364585 FXWURSVUEVLAMS-NWDGAFQWSA-N 267.756 2.439 10 10 CECE COc1ccc(CN[C@H]2CCn3ccnc32)cc1C 824521427 JQSJLBRQYUHPIF-ZDUSSCGKSA-N 257.337 2.435 10 10 CECE CC[C@H](N[C@@H](C)c1cc(Cl)ccc1O)C(=O)NC 834915761 ZUUGIRIFOHQVRM-KWQFWETISA-N 270.760 2.221 10 10 CECE CCN(CC)c1ccc(CN2CC(C)(CO)C2)cc1F 839144882 BXYLEHFGYAYZSC-UHFFFAOYSA-N 280.387 2.486 10 10 CECE Cc1ccc([C@@H](C)NC[C@H]2CCCCN2CCO)c(O)c1 834850584 NCWNNQVIZSXWPL-HUUCEWRRSA-N 292.423 2.198 10 10 CECE COC[C@](C)(O)CCN[C@H](C)c1ccc(C)c(C)c1O 834844711 UFGCVLNZOVFEGK-CZUORRHYSA-N 281.396 2.447 10 10 CECE CC[C@@H](CC(F)F)C(=O)NCc1ccc(O)cc1O 910945737 XDSUUYCPUULQCE-QMMMGPOBSA-N 273.279 2.395 10 10 CECE CCOCc1cc(CN[C@H]2CCNC[C@@H]2C)ccc1OC 841063154 FDICYUWIMJMJQR-BBRMVZONSA-N 292.423 2.319 10 10 CECE Cn1ncc(C(F)(F)F)c1C(=O)NCc1ccccc1O 857471618 FPWLFQFCHKDKRR-UHFFFAOYSA-N 299.252 2.075 10 10 CECE NC(=O)[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2O)C1 858248999 GYRVKPRWWSRRBM-JOTVFPGJSA-N 289.162 2.053 10 10 CECE COc1ccc2c(c1)CCCN2C[C@@H]1C[C@H]2COC[C@@H]2O1 929238801 XWYLVXMIYYUIHJ-QRTARXTBSA-N 289.375 2.252 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3[C@H]4CCC[C@@H]3C4)ccc21 1899694031 SGUPSJKRCSMNGM-RBZYPMLTSA-N 257.337 2.030 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)[C@H]3CC3(C)C)C2)cc1 855231482 AOXYPIUJZJLMNW-IUODEOHRSA-N 288.391 2.436 10 10 CECE C[C@H](NC[C@H]1COCCN1C)c1cc(Cl)ccc1O 858522535 FTRKZNCWEDNIHR-JQWIXIFHSA-N 284.787 2.027 10 10 CECE COc1ccc(O)c(CN[C@H]2CCN(C)C(C)(C)C2)c1 858137163 HXMJMCUWKAFDPJ-ZDUSSCGKSA-N 278.396 2.363 10 10 CECE C[C@@H](NC(=O)c1ccnnc1)c1ccc(N(C)C)cc1 773022657 IINVSMGXYHBCSW-LLVKDONJSA-N 270.336 2.034 10 10 CECE CC(C)(C)OCCNC(=O)/C=C/c1ccc(O)c(O)c1 779504797 DKIGBUQAKWQUGV-FNORWQNLSA-N 279.336 2.042 10 10 CECE CC(C)c1nnc([C@@H](N)c2cc(F)ccc2O)o1 83384436 ITVJMKDNGLZMKY-JTQLQIEISA-N 251.261 2.086 10 10 CECE CC(C)[C@@H]1CN[C@@](C)(c2cc(F)ccc2O)CO1 83396057 VZGJVMUCRNKNLE-UONOGXRCSA-N 253.317 2.391 10 10 CECE Cc1cc(O)ccc1NCc1ccc(O)c(O)c1O 83444033 VMBWGMOJCCRAST-UHFFFAOYSA-N 261.277 2.430 10 10 CECE C[C@H]1CN[C@@](C)(c2cc(F)c(F)c(F)c2O)CO1 83443492 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715992032 SWNAUGIDPHOVBL-SKDRFNHKSA-N 279.311 2.389 10 10 CECE CCC[C@@H](CCO)NCc1ccc(F)c(F)c1O 716826097 CIAKQSFTCBLZFI-JTQLQIEISA-N 259.296 2.311 10 10 CECE CCNCc1ccc(N(C)[C@H]2CCN(CC)C2)c(F)c1 688458208 SNLMVELGSKUEMU-AWEZNQCLSA-N 279.403 2.466 10 10 CECE CN(CCC1CCC1)c1ccc2c(c1)N(C)C(=O)[C@H]2O 688686667 CNGINSZBSUURGM-HNNXBMFYSA-N 274.364 2.323 10 10 CECE O=C(NC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F)c1cccc(O)c1O 693384324 XLIKQNFVYSDOKR-LETLQTKMSA-N 283.274 2.119 10 10 CECE CNCc1ccc(N2CC3CC2(CO)C3)cc1Cl 694510690 BXURKWVWHSKAAL-UHFFFAOYSA-N 266.772 2.021 10 10 CECE CC(C)(C)OCCCNCc1ccc(O)c(O)c1O 695284013 MWFTYRVXQQCMAH-UHFFFAOYSA-N 269.341 2.098 10 10 CECE CC[C@@]1(C)CN(c2ccc(OC)c(OC)c2)CCN1 86123230 RQTHCZNOIVIMOS-HNNXBMFYSA-N 264.369 2.282 10 10 CECE Nc1c(C(=O)N2Cc3cccc(O)c3C2)cccc1[N+](=O)[O-] 1152573177 JTZOYLDFIYCVPE-UHFFFAOYSA-N 299.286 2.039 10 10 CECE C[C@@H]1CCC(F)(F)CN1C(=O)Cc1ccc(O)c(O)c1 1305308399 YAEVOJHMOKJCFE-SECBINFHSA-N 285.290 2.287 10 10 CECE 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CN1CCc2cc([C@H](N)C[C@H]3[C@@H]4CCOC[C@@H]43)ccc21 2355952447 ABVYBAMZNPJMRS-YHUYYLMFSA-N 272.392 2.351 10 10 CECE Nc1ccc(NC(=O)CCOCCc2ccccn2)cc1 20519462 VVPYKBZAOGVXKH-UHFFFAOYSA-N 285.347 2.252 10 10 CECE CO[C@H](C)CN(Cc1ccccc1O)C[C@H]1CCCO1 248416640 IYWJLRSLMXSZHH-UKRRQHHQSA-N 279.380 2.408 10 10 CECE Cc1cnn(-c2ccc(O)c(O)c2)c1Br 2069872734 DQHFDMNCZYFREZ-UHFFFAOYSA-N 269.098 2.354 10 10 CECE CO[C@@H]1CCCN([C@H](C)c2c(O)cccc2O)C1 300442351 QKKFWNQOOWPHMT-GHMZBOCLSA-N 251.326 2.270 10 10 CECE COCCNCc1ccc(N2CCO[C@@H]3CCC[C@@H]32)cc1 62737968 ZWDVLGBNWCTPSK-DLBZAZTESA-N 290.407 2.180 10 10 CECE C[C@@H]1CCN(c2ccc(CN)cc2Br)[C@H]1CO 300420396 HLGVQIRRQZJWKH-RNCFNFMXSA-N 299.212 2.115 10 10 CECE COc1cccc(CNC(=O)[C@@H]2C[C@@H]2C(C)C)c1O 184977237 HZDPADVFZSHSSB-VXGBXAGGSA-N 263.337 2.309 10 10 CECE CC1(C)CC[C@H](CNCc2cc([N+](=O)[O-])ccc2O)O1 189716297 AEUNWXKSCOHTGK-GFCCVEGCSA-N 280.324 2.348 10 10 CECE COc1ccccc1NC[C@H](O)COC(C)(C)C 37874526 HFYFVHHIAQKOEW-NSHDSACASA-N 253.342 2.283 10 10 CECE CCC[C@](C)(N[C@@H](C)c1cc(O)ccc1O)C(=O)O 86731811 MSSLUDUXXQLRNX-XPTSAGLGSA-N 267.325 2.392 10 10 CECE CCN(C(=O)CC[C@H](C)OC)c1ccc(N)cc1 228491143 RYXDKJIOLHWXFX-NSHDSACASA-N 250.342 2.437 10 10 CECE COc1ccc(CNC(C)C)cc1C[S@@](C)=O 84045842 KJGJVPGKXZRSKV-KRWDZBQOSA-N 255.383 2.072 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](O)C2)cc1Br 235508625 NWXVOMQRPISPGM-GXSJLCMTSA-N 299.212 2.430 10 10 CECE CN[C@]1(C(=O)O)CCC[C@H](Sc2nccs2)C1 93778696 QPWBZVVZGROBBB-GZMMTYOYSA-N 272.395 2.221 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CC[C@H](C2)O3)c(F)c1 90906362 NSIKVVNZONDKEL-ZMLRMANQSA-N 250.317 2.213 10 10 CECE O=C(O)CC[C@@H]1CCN(Cc2cc(F)ccc2O)C1 236427569 GHVNEIASVKUOFX-SNVBAGLBSA-N 267.300 2.218 10 10 CECE CNCc1ccc(N2CCOC[C@@H]2C)cc1Cl 234451860 ILYJKMXRIDEAKU-JTQLQIEISA-N 254.761 2.285 10 10 CECE C[C@](CCc1ccccc1)(NCCN=[N+]=[N-])C(=O)O 90256496 GDXOSGWBHRAJNB-CYBMUJFWSA-N 262.313 2.362 10 10 CECE O=C(O)C1(c2cc(O)c(O)cc2C(F)(F)F)CC1 258338986 DENLQGIUNBHZQH-UHFFFAOYSA-N 262.183 2.233 10 10 CECE 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2.186 10 10 CECE CNCCOCCN(C)c1ccc2c(c1)C(C)(C)CO2 2162672982 NTMNHFRPFBLYBR-UHFFFAOYSA-N 278.396 2.029 10 10 CECE COc1ccc(N(C)CCN2CCOCC2(C)C)cc1 2165162869 ALRMLJPCPZWDID-UHFFFAOYSA-N 278.396 2.242 10 10 CECE CCN1CCc2cc(N3C[C@H]4[C@@H](N)CC[C@H]4C3)ccc21 2163074047 OPQRASIDAUDZGY-IMJJTQAJSA-N 271.408 2.243 10 10 CECE CN1CCc2cc([C@@H](N)[C@@](C)(O)c3ccco3)ccc21 2163131016 NDVRMKAPVQRAIO-CVEARBPZSA-N 272.348 2.179 10 10 CECE CCN1CCc2cc([C@H](N)[C@H](O)[C@H](C)C3CC3)ccc21 2163136690 VZXXMMHHTVYRGP-ZTFRIQLXSA-N 274.408 2.476 10 10 CECE C[C@]1([C@@H](NN)c2ccc(N3CCCC3)cc2)CCOC1 2163157866 ISMBJJFHCPVWQS-HOTGVXAUSA-N 275.396 2.218 10 10 CECE Nc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@H]3C2=O)c(Cl)c1 2166998283 ZEYYQPYAUDTPFP-GRUGVGOFSA-N 288.734 2.234 10 10 CECE CN1[C@H]2CC[C@@H]1CN([C@@H]1CCc3cccc(O)c31)C2 723703304 BHQBCKSBIUGUSF-HZSPNIEDSA-N 258.365 2.158 10 10 CECE C[C@@H]1CC[C@H](O)CN1Cc1ccc(N(C)C)c(F)c1 817415274 WAGVIQPOOVUNDC-YPMHNXCESA-N 266.360 2.237 10 10 CECE 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CO[C@@H]1CCC[C@H]([C@H](NN)c2ccc(N(C)C)cc2)C1 686369854 IUXFQKXQNIKQFL-NUEKZKHPSA-N 277.412 2.462 10 10 CECE Oc1c(F)cc(F)cc1CNCc1ccns1 708452790 BMKPSMKYKZDPTF-UHFFFAOYSA-N 256.277 2.417 10 10 CECE COc1ccc(O)c(CN2CCO[C@@H](C(F)F)CC2)c1 687288937 KEEHHVQRRHBBMF-CYBMUJFWSA-N 287.306 2.257 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@@H](C(F)F)CC2)cc1O 687575681 BGUFNAQMECPMLB-TVQRCGJNSA-N 286.322 2.272 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@](C)(N)C(F)F 2172045743 SNJCQMYYWUWVCH-OTYXRUKQSA-N 286.322 2.284 10 10 CECE COC(=O)C[C@@H](C)NCc1ccc2c(c1)CCCN2C 380183179 ANDURMKUKJGTKB-GFCCVEGCSA-N 276.380 2.110 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)C[C@@H]1CCCCO1 691689024 WKCKMXSKXRWMIH-QWRGUYRKSA-N 252.318 2.247 10 10 CECE Cc1cc(CNCc2ccc(O)c(O)c2O)cs1 381105686 BEXLWAFDMZQWOA-UHFFFAOYSA-N 265.334 2.463 10 10 CECE O=C([C@@H]1CNc2ccccc2N1)N1CC2CCC1CC2 383786439 VMFUHLQFEWKAAF-QOZQQMKHSA-N 271.364 2.294 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CN(C)C(=O)c1cccc(O)c1O 716633298 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10 10 CECE C[C@@H]1SCCC[C@@H]1N(C)c1ccc2c(c1)NC(=O)[C@H]2N 2197307313 ZGHZHXSXQQSIPP-HERUPUMHSA-N 291.420 2.359 10 10 CECE CN(C)C[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2184681562 FKNXYOUOGNXUNH-GUYCJALGSA-N 274.408 2.444 10 10 CECE NCc1cc(F)c(N2[C@H]3CC[C@@H]2C[C@H](CO)C3)c(F)c1 2184662221 BXAOHFYDRIJDFA-ZSBIGDGJSA-N 282.334 2.163 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3O)C[C@H]1N(C)C 2184733342 GTHQKOYBLMNMKV-JLZZUVOBSA-N 274.408 2.443 10 10 CECE Cc1cccc(CNC[C@H]2C[C@H](n3cncn3)C2)c1O 2184868119 VQAKQGQWFQLBDS-MQMHXKEQSA-N 272.352 2.033 10 10 CECE COc1ccc(N(C)[C@H]2CCNC[C@H]2C)cc1F 2044527007 ZVPFWVFDEVUEBL-MFKMUULPSA-N 252.333 2.269 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@@H]1CC[C@]2(C)C[C@@H]12 2185456946 ZZWYVYCHHWDUOK-SQWLQELKSA-N 273.380 2.328 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)cc2Cl)CC[S@@]1=O 2051915743 VMKCKNHYXYPLFD-VOQFUICPSA-N 286.828 2.317 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3CCO[C@@H]3C2)c(F)c1 2052026020 DUDWEZQDJRATJF-NURSFMCSSA-N 251.301 2.104 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)C3O)cc1Cl 2052757758 VCYFWKVLNZBJSG-UDAJDXAQSA-N 267.756 2.210 10 10 CECE C[C@@H]1CC[C@@](N)(C(=O)N(C)[C@H](C)c2ccccc2O)C1 2194507101 AUCMCPVLTAEJJG-HSMVNMDESA-N 276.380 2.429 10 10 CECE COC[C@@]12C[C@H]1CN(c1c(F)cc([C@H](C)O)cc1F)C2 2194502532 AINJFUKMKGMQNW-ZSGNIPIJSA-N 283.318 2.491 10 10 CECE C[C@@H]1CCC[C@H]1S(=O)(=O)N1CC[C@H](CN=[N+]=[N-])C1 2055209379 IZRRXWJSJGFJPI-GMTAPVOTSA-N 272.374 2.137 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@@H](O)CC3(CC3)C2)c(F)c1 2194710241 QBLFHZREECBTIK-KOLCDFICSA-N 282.334 2.336 10 10 CECE CC[C@@](C)(CN(C)C(=O)CCc1ccc(N)cc1)OC 2186323591 TVUHVKOJIWEZII-INIZCTEOSA-N 278.396 2.475 10 10 CECE CC(C)NCc1ccc(N2C[C@H](O)[C@H]2C)cc1Cl 2062258381 DUPZBFFKQXZGDA-YGRLFVJLSA-N 268.788 2.407 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](F)C[C@@H](F)C2)cc1O 2062408274 PWYSYARXVQUNAE-IVZWLZJFSA-N 256.296 2.298 10 10 CECE CN(C[C@H]1OCCOC1(C)C)c1ccc(CO)c(Cl)c1 2186855812 UZRFVRXVPZGGOI-CQSZACIVSA-N 299.798 2.463 10 10 CECE 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2.203 10 10 CECE Cc1cc(C)c(C(=O)Nc2ccc(N)cc2)c(O)n1 701147400 LHWZNFUWXUXYNM-UHFFFAOYSA-N 257.293 2.239 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)CCc2ccccn2)C1 701306804 RIHIBUCWDMOZGO-GFCCVEGCSA-N 259.313 2.316 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H](C(=O)O)C2CCC2)c1 399102728 FZBKRTKQTNYDOX-YMTOWFKASA-N 279.336 2.305 10 10 CECE CN[C@H](C)c1ccc(N2CCCC[C@@H]2C(N)=O)cc1Cl 689074645 CPDJXCDLQDIXTD-QMTHXVAHSA-N 295.814 2.465 10 10 CECE CCN[C@@H](C)c1ccc(N(C)Cc2ncnn2C)cc1 707665589 NBWZQLXOURKANH-LBPRGKRZSA-N 273.384 2.122 10 10 CECE CC(C)[C@@H]1CN(c2ccc(CN(C)C)cc2)CCN1 689491647 NNAURXHTOJNSAH-INIZCTEOSA-N 261.413 2.182 10 10 CECE NCc1ccc(N2CCCN3CCC[C@@H]3C2)c(Cl)c1 62939739 QYRSLRWKVHCVLK-CYBMUJFWSA-N 279.815 2.473 10 10 CECE O=C(NCC[C@H]1C[C@H]1C1CC1)c1cccc(O)c1O 712843672 QDKBOMUREAJNMW-JQWIXIFHSA-N 261.321 2.264 10 10 CECE C[C@H]1CN(Cc2ccc3c(c2)CCCN3C)[C@H](C)CN1 86467220 QGNUGNMRCSQXRC-UONOGXRCSA-N 273.424 2.251 10 10 CECE C[C@@H]1CN(c2ccc([C@@H](C)N)c(O)c2)CC(C)(C)O1 93671293 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CSc1ncc(CNC(=O)[C@@H]2CCC[C@H](CN)C2)s1 2269092786 KSKIAVLWIMQHKZ-VHSXEESVSA-N 299.465 2.246 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@@H]3CNC(=O)[C@H]32)cc1Cl 2279275912 MYZWJBCVHQCXLD-RULNRJAQSA-N 294.782 2.108 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H](C)C[S@](C)=O)cc1C 2269652357 VRJFICFELPGHRY-VPZZIHKRSA-N 282.453 2.479 10 10 CECE Cc1cc(N2CC[C@H](C)[C@H](CO)C2)ccc1[C@H](C)N 2269651124 HMZAJVNMKGTYBI-UBHSHLNASA-N 262.397 2.469 10 10 CECE CN[C@H](C)c1ccc(N2CC3(CN(C)C3)C2)cc1C 2269669144 YRBXVAIXFJTIMV-CYBMUJFWSA-N 259.397 2.027 10 10 CECE CN(C[C@H]1CCC1(C)C)C(=O)c1cc(O)c(O)c(O)c1 2280826355 BUTLXSNLUGFHPB-SNVBAGLBSA-N 279.336 2.312 10 10 CECE COc1cc(C)c(N2CCC(OCCO)CC2)c(C)c1 2285058840 SIIYIZVHZBTLBZ-UHFFFAOYSA-N 279.380 2.290 10 10 CECE COc1ccc(N2[C@H]3CCNC[C@H]2CC3)c(OC)c1C 2295434616 JHDUGCLLMACQKS-CHWSQXEVSA-N 276.380 2.343 10 10 CECE COc1ccc(N(C)[C@@H]2CNCC[C@@H]2C)c(OC)c1C 2295435072 OKTJICZQNPNVQZ-SMDDNHRTSA-N 278.396 2.446 10 10 CECE COc1ccc(N(C)C[C@H]2CCCNC2)c(OC)c1C 2295433014 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C[C@@H](CN(C)C)N(C)c1cc(Cl)c(CN)cc1F 2326776983 IQUWHBRPRRQSIJ-VIFPVBQESA-N 273.783 2.324 10 10 CECE C[C@H](N[C@H]1C[C@H](CO)[C@@H]2C[C@H]12)c1ccc(F)cc1O 2329877011 MVGDWLAIRDWSRC-FMHBKDTISA-N 265.328 2.199 10 10 CECE C[C@H]1COCCN(c2ccc(CN)c(C3CC3)c2)C1 2339147621 YHUMIOZXSGOUQE-GFCCVEGCSA-N 260.381 2.495 10 10 CECE C[C@]1(CO)C=CCN1c1ccc(CO)c(C2CC2)c1 2339148015 PJTDJZMOTAKWAI-MRXNPFEDSA-N 259.349 2.184 10 10 CECE COc1ccc(CNC(C)(C)[C@@H](O)C(C)C)c(O)c1 2340357237 QXFWHSURXFMYNG-AWEZNQCLSA-N 267.369 2.286 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[C@@](F)(CO)C2)c1C 2340849504 WOLHHEIAVIFMBS-WFASDCNBSA-N 266.360 2.234 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[S@](=O)[C@@H](C)C2)c1C 2340859707 NIVVPAGXBMSREE-JXBWDGJFSA-N 280.437 2.280 10 10 CECE Cc1cc(NS(=O)(=O)N(C)C2CCC2)cc(C)c1O 2340884896 YBJCSHNLWMTPIT-UHFFFAOYSA-N 284.381 2.150 10 10 CECE Cc1nc(CCN(C)[C@@H](C)c2ccccc2O)n[nH]1 2351829432 BINQEIMIZYHOCF-JTQLQIEISA-N 260.341 2.054 10 10 CECE CO[C@H]1C[C@@H](CF)N(c2ccc(CN)c(SC)c2)C1 2353859746 IQZGTRLHPHZVRA-STQMWFEESA-N 284.400 2.430 10 10 CECE CCN1CCCN(c2ccc(CN)c(SC)c2)CC1 2353848849 OGBZOAZSHCKLAO-UHFFFAOYSA-N 279.453 2.399 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2C[C@@H]3CC[C@H]2C3)cc1 2354299265 XMTBPPHXGPAOHK-TYNCELHUSA-N 274.364 2.343 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]2C[C@@H]32)c([N+](=O)[O-])c1 2354423999 LDXCMUIVIAKEHU-JAXUZKKOSA-N 274.320 2.493 10 10 CECE C[C@]1(O)C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(F)c(F)c1O 2355712713 GZLHLGOTVCOQHG-OUCVZQCGSA-N 283.318 2.310 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H](F)[C@H](CO)C3)ccc21 2356171946 FASYQXWQMDBEHU-MAZHCROVSA-N 278.371 2.050 10 10 CECE CC1CCC(CO)(NCc2cc3c(cc2O)OCO3)CC1 53114143 MYFXKRRWHWWOGA-UHFFFAOYSA-N 293.363 2.152 10 10 CECE COC[C@@H](C)N(C)[C@@H](CN)c1ccc2c(c1)CCCN2C 50287295 GFVXTIXLIWFKNR-DYVFJYSZSA-N 291.439 2.036 10 10 CECE CCCN(CC(=O)OC(C)C)c1ccc(N)cc1 63116110 VFRQRPJECXOHIS-UHFFFAOYSA-N 250.342 2.437 10 10 CECE O=C(Nc1cccc(Cl)n1)c1cccc(O)c1O 126906320 LGGSITNPBJEDET-UHFFFAOYSA-N 264.668 2.399 10 10 CECE Cc1cc(Cl)cc(CN2CCC[C@H](CC(N)=O)C2)c1O 180560928 ZQLBMCPKWBANFK-LLVKDONJSA-N 296.798 2.441 10 10 CECE C[C@@H](CCC(=O)O)NC(=O)/C=C/c1ccc(N(C)C)cc1 70310033 OWDORMXXAXSRMP-PMDBQALLSA-N 290.363 2.135 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)C2)c(Cl)c1 227054720 ZEIUXNJHOMMBDU-MWLCHTKSSA-N 254.761 2.191 10 10 CECE CCC(CC)(CC)NC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 86643059 AYFNVBKOQBXGTO-LBPRGKRZSA-N 294.395 2.053 10 10 CECE COc1cc(OC)c(N2CCNC[C@@H]2C)cc1Cl 86177150 RHVLLAHDCPQNRK-VIFPVBQESA-N 270.760 2.155 10 10 CECE CCC[S@](=O)CCCC(=O)Nc1ccc(N)cc1 40967512 GTTHFIXUVFVYEU-GOSISDBHSA-N 268.382 2.146 10 10 CECE COC(=O)[C@@H](NC1CCCC1)c1cc(F)ccc1O 234535215 CPJHFOQZIYDOTC-ZDUSSCGKSA-N 267.300 2.278 10 10 CECE C[C@H](NCC1CCOCC1)c1c(O)cccc1O 235512325 KBBVCDUPDBTJQT-JTQLQIEISA-N 251.326 2.175 10 10 CECE CC[C@H](O)[C@H](N)c1cc(Br)c(F)c(F)c1O 95805605 CMDATAWYDIIRCG-IMTBSYHQSA-N 296.111 2.204 10 10 CECE COc1ccc([C@H](C)N[C@H](C)[C@H]2CCOC2)c(O)c1 252814902 UMGAORQUKKGWBG-WOPDTQHZSA-N 265.353 2.476 10 10 CECE COc1ccc(N(C)C(=O)/C=C\c2cncc(C)c2)cn1 255894488 WAPGQMCLCPGVSM-DAXSKMNVSA-N 283.331 2.470 10 10 CECE C[C@@H](CCN)c1c(O)c(O)cc(Br)c1F 258494218 GMGQDDCMSVBXBS-YFKPBYRVSA-N 278.121 2.452 10 10 CECE C[C@H]1CCc2cc(N3CCS(=O)(=O)[C@H](C)C3)ccc2N1 707582035 ICDMGXVHAQFCRO-NWDGAFQWSA-N 294.420 2.057 10 10 CECE CCN1CCc2cc([C@@H](O)c3ccc(C)nn3)ccc21 2163065585 BOOSDSWBBXOPJO-MRXNPFEDSA-N 269.348 2.249 10 10 CECE CCN1CCc2cc([C@H](O)c3nn(C)cc3C)ccc21 2163072667 YVTSZUDOQLXEKC-INIZCTEOSA-N 271.364 2.193 10 10 CECE Cn1ccc(C[C@H](N)c2ccc(N3CCCC3)cc2)n1 2163094756 NZNNNCKRVCRERN-INIZCTEOSA-N 270.380 2.263 10 10 CECE CCN1CCc2cc([C@@H](C[C@H]3CCCO3)NN)ccc21 2163133734 PCNOJRUHXFNJJI-HUUCEWRRSA-N 275.396 2.143 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@](C)(O)[C@@H](C)OC)cc1 2163147243 LGUGITPZZPVGFM-KCXAZCMYSA-N 280.412 2.319 10 10 CECE CN(Cc1cccc(Cl)c1O)C[C@@H]1C[C@@H]2OCC[C@@H]2O1 2163206097 ZZLWLUVHWXGLQT-UBHSHLNASA-N 297.782 2.424 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H](O)c3ccco3)ccc21 2163227815 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285.391 2.279 10 10 CECE C[C@H](NC(=O)c1cc(O)cs1)[C@@](C)(O)c1ccccc1 855018033 OADXZBYLEPTWBT-ZUZCIYMTSA-N 291.372 2.480 10 10 CECE CC(C)(C)OC(=O)Nc1ccc([C@@H](N)C2(O)CC2)c(O)c1 1952818478 HSHFKCNXSUXPHZ-GFCCVEGCSA-N 294.351 2.264 10 10 CECE CO[C@H](CNC(=O)NCc1c(O)cccc1F)CC(C)C 922914036 BNJXOFQXSBUHTQ-NSHDSACASA-N 298.358 2.392 10 10 CECE CN(C)c1ccc(CNCc2cn(C3CCC3)nn2)cc1 850010763 HPJGDNUMBMPDRA-UHFFFAOYSA-N 285.395 2.359 10 10 CECE CCC(F)(F)CNC(=O)CCc1ccc(N)cc1 697654214 IEAKMOMKIGIRHC-UHFFFAOYSA-N 256.296 2.363 10 10 CECE C[C@H](NC(=O)N[C@H]1CO[C@H](C2CC2)C1)c1ccccc1O 868814602 FDIBXCXNNNTBSP-NVBFEUDRSA-N 290.363 2.320 10 10 CECE Cn1ncc(NCc2cc3c(cc2O)OCO3)c1C1CC1 769926631 XHTNNRJWMMQIQN-UHFFFAOYSA-N 287.319 2.344 10 10 CECE CSCCONC(=O)N[C@@H](C)c1ccccc1O 868564836 LNJZZDSYLFSJQU-VIFPVBQESA-N 270.354 2.047 10 10 CECE COC[C@H]1CCN1Cc1cc(F)c(N(C)C)cc1F 862377869 WHCKBMDDBGLEAQ-LLVKDONJSA-N 270.323 2.252 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)OCCCO3)CCN1 49660959 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C[C@H](N)c1ccc(N2CC[C@H](C(C)(C)O)C2)c(F)c1 721789404 MSQRKYPCKDJJIG-JQWIXIFHSA-N 266.360 2.443 10 10 CECE Cc1nn(C)c(C)c1-c1csc(-c2cn[nH]c2N)n1 71382778 YRHMNIKIWUQBSK-UHFFFAOYSA-N 274.353 2.133 10 10 CECE CC[C@@]1(C)COCCN1c1ccc([C@H](C)O)c(O)c1 687888351 NRGWWAQCWVXSCN-NHYWBVRUSA-N 265.353 2.451 10 10 CECE C[C@H](N[C@@H](CO)CC(F)(F)F)c1ccc(O)cc1O 717767652 IFFXWCHCPZFAFF-JGVFFNPUSA-N 279.258 2.062 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@]23COC[C@@H]2C3)cc1 689305835 RUCDMIPCHGUSAG-INWMFGNUSA-N 260.381 2.440 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N(C)[C@H]3CCC3(C)C)cc21 694276867 KZHOZCIJZIMXAZ-UONOGXRCSA-N 273.380 2.288 10 10 CECE Nc1ccc(CC(=O)NC[C@@H]2CCC[C@@H]3C[C@H]23)cc1 694298342 JNLNMJCDTAKVLI-IPYPFGDCSA-N 258.365 2.364 10 10 CECE C[C@@H](NCC1(O)CCCCC1)c1ccc(O)cc1O 87017478 HTUCLZMWAYDSLI-LLVKDONJSA-N 265.353 2.444 10 10 CECE CN(c1ccc(CO)cc1F)[C@H]1C[C@@H]2CC[C@H](C1)O2 2124956224 UMVIYFLKTGXGMX-XYYAHUGASA-N 265.328 2.464 10 10 CECE CC1(C)[C@@H]2[C@H](CCN2c2ccc(CO)cc2Cl)[C@H]1O 2121663229 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2.470 10 10 CECE COc1cc(C(=O)NCCN=[N+]=[N-])sc1Cl 1901688163 FQCJYKLCTMJGNM-UHFFFAOYSA-N 260.706 2.450 10 10 CECE CCC[C@]1(O)CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128314609 ILMYRSMOBBALEJ-CVEARBPZSA-N 261.365 2.408 10 10 CECE OCCC[C@@H]1CCCN1c1ccc2c(c1)CC[C@@H]2O 2128317506 POLOOVQANAJOAH-BBRMVZONSA-N 261.365 2.408 10 10 CECE COc1cccc(O)c1CN1CC[C@H]2CCO[C@@H]2C1 2128411460 PEOGLIOMBKBUGS-XHDPSFHLSA-N 263.337 2.012 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H]2CCOC[C@@H]2C1 2128986210 KJMNHVCOJJPPGP-GJZGRUSLSA-N 261.365 2.350 10 10 CECE Cc1ccsc1CNC(=O)c1cc(O)c(O)c(O)c1 2132348268 HRLLBAHEHXNVJP-UHFFFAOYSA-N 279.317 2.103 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H](CN)C[C@H]2C)c1 216031269 UBHVIFCIZLQUPV-WOPDTQHZSA-N 264.369 2.131 10 10 CECE Nc1ccc(CCNC(=O)C=Cc2cccnc2)cc1 1911932020 OMFNHYUXHLPBAA-UHFFFAOYSA-N 267.332 2.036 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 1912075386 PJKSOAVLKPFWMM-PWSUYJOCSA-N 274.276 2.291 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 1912187628 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N[C@@H]1C(=O)Nc2cc(N3CCC[C@@H]4CCC[C@@H]43)ccc21 227169036 OHAYQBSRVIOLFN-LKTVYLICSA-N 271.364 2.407 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1Cl 227325423 XOAJNSBZGXEQCP-VHSXEESVSA-N 281.787 2.061 10 10 CECE CC(C)[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)CCS1 1629050141 OWWIHDNOLLZPEY-AWEZNQCLSA-N 295.404 2.240 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCCC1(F)F 1624370379 LVPRKAFGSRETLX-JTQLQIEISA-N 285.290 2.192 10 10 CECE N[C@@H]1CN(Cc2ccc(O)c(O)c2)C2(CCCCC2)C1 1925252282 GKEQEORDAIKRMH-ZDUSSCGKSA-N 276.380 2.334 10 10 CECE C[C@H](N[C@H](C)c1cc(O)ccc1O)C(=O)NC(C)(C)C 228966463 GOMRHJVTPZAJBX-ZJUUUORDSA-N 280.368 2.052 10 10 CECE O=C(Cc1ccccc1F)NCc1cccc(O)c1O 1644708386 JPLMURBLTRARNS-UHFFFAOYSA-N 275.279 2.096 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1ccc2c(c1)CCOC2 1640607812 TVAWUSZHNXDUHE-UHFFFAOYSA-N 299.326 2.352 10 10 CECE O=C1CC[C@@H]2[C@@H]1[C@@H]2C(=O)NCc1c(O)ccc2ccccc12 1647790944 CPLLNRLELUFJBH-OAUYIBNBSA-N 295.338 2.387 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@H](F)Cc1ccccc1 1570462190 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261.413 2.373 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]23CC[C@@H](CNC2)C3)cc1 2114442830 SQACTDZYRZXTGY-UHOFOFEASA-N 260.381 2.176 10 10 CECE Nc1ccc(CC(=O)N2CCC[C@H](C3CC3)C2)cc1 2114997398 QIWDOKUPIXIQGF-AWEZNQCLSA-N 258.365 2.460 10 10 CECE CCNCc1ccc(N(C[C@@H](C)O)C2CC2)cc1OC 2204553751 MLRBLVFGDLMDKZ-GFCCVEGCSA-N 278.396 2.154 10 10 CECE CNCc1ccc(N2C[C@@H](O)CCC2(C)C)cc1OC 2204549779 PFNXYCWLWKATPT-AWEZNQCLSA-N 278.396 2.154 10 10 CECE CCn1c(C)c(C)[nH]c1=NCCOc1ccc(N)cc1 2205845489 FNCMAYMDKKMMGW-UHFFFAOYSA-N 274.368 2.015 10 10 CECE CO[C@@H]1C[C@H](C)CN(C(=O)CCc2ccc(N)cc2)C1 2205853694 YRARGOUBSSLAJH-SWLSCSKDSA-N 276.380 2.085 10 10 CECE CSc1ncc(CNC(=O)c2ccc(N)c(C)n2)s1 2269135016 REQFFFORPFZOFA-UHFFFAOYSA-N 294.405 2.081 10 10 CECE CSc1ncc(CNC(=O)CC[C@H]2CC[C@@H](N)C2)s1 2269203531 RXHWUTMCKQWNHD-NXEZZACHSA-N 299.465 2.389 10 10 CECE Nc1ccc(CCC(=O)O[C@H]2[C@H]3[C@H]4[C@H]3C[C@@H]3[C@@H]2[C@@H]43)cc1 2208365806 KOJQXQKQAJPZKV-KGDYQQENSA-N 269.344 2.255 10 10 CECE COc1ccc(N2CC[C@@H]3C[C@]3(F)C2)c(CCN)c1 2230345312 CHIOGJGPONHHHH-DOMZBBRYSA-N 264.344 2.135 10 10 CECE CN(C)c1ccc(OCCc2c[nH]c(=N)s2)cc1 2221882732 KQPWDXBONDQQKL-UHFFFAOYSA-N 263.366 2.243 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@H](O)[C@@H]2CC[C@@H]21 2232096801 UWPHSOPLDJEJND-YOENINGUSA-N 260.381 2.364 10 10 CECE Oc1cc(F)ccc1CNCC[C@]12COC[C@H](C1)C2 2274566576 SLTWLLRKGRDZFV-WGRBQBNCSA-N 265.328 2.438 10 10 CECE C[C@@H]1CN([C@H](C)c2ccc(N(C)C)cc2)CCCN1 2224767203 BMUWOGNFIOORMD-ZIAGYGMSSA-N 261.413 2.497 10 10 CECE CCN1CCc2cc(N3CC(O)(C(F)(F)F)C3)ccc21 2235036391 BIRSNEAUYDTQAR-UHFFFAOYSA-N 286.297 2.182 10 10 CECE COc1ccc(N2CC[C@](O)(C(F)(F)F)C2)c(F)c1F 2235213882 UNAITUIVSYGTFE-LLVKDONJSA-N 297.223 2.477 10 10 CECE Cc1cccnc1CC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2225796866 AXVGZXNJOLWGLS-MNOVXSKESA-N 259.313 2.280 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cnn(C2CC2)c1 2225792142 KJSWBFFJKLWCNJ-GHMZBOCLSA-N 260.301 2.179 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H](C)C[C@@H](O)[C@@H]3C)ccc21 2235874901 BPZJUKFHJKAMGE-CZAMWMTLSA-N 274.408 2.489 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@H](C)[C@H](O)C3)c(C=O)c1 2235992386 MYQDTPAJZMNWMF-YLUJIRGKSA-N 275.348 2.246 10 10 CECE COC(=O)[C@H]1CCCCN1c1ccc(OC)cc1C=O 2235984108 SRERONGODRBXNW-CQSZACIVSA-N 277.320 2.040 10 10 CECE CC[C@@H]1C[C@@H](N(C)c2ccc(OC)cc2C(=O)O)CO1 2235959888 ZYOIEARSQHLUFS-GHMZBOCLSA-N 279.336 2.397 10 10 CECE COCc1cc(NCc2cc(N)ccc2O)ccn1 2226238875 QWXRCEZKLQVCGL-UHFFFAOYSA-N 259.309 2.128 10 10 CECE Cc1c(NC(=O)c2ccc(O)c(O)c2)cnn1C1CC1 2236572585 DCJLGLPCEZYRAK-UHFFFAOYSA-N 273.292 2.190 10 10 CECE O[C@H]1CCN(c2ccc(OC(F)(F)F)cc2)C[C@@H]1F 2226539966 DZPHAYNVHHASFA-QWRGUYRKSA-N 279.233 2.494 10 10 CECE OCC[C@@H]1CN(c2ccc3c(c2)CCCO3)CCS1 2226661320 GSDHHGLUMURGBD-CQSZACIVSA-N 279.405 2.316 10 10 CECE C[C@H]1C[C@H](CO)CN(c2ccc3c(c2)CCCO3)C1 2226663578 CJZMKJOIBREDAK-STQMWFEESA-N 261.365 2.466 10 10 CECE OC[C@@H](F)C1CN(c2ccc(OCC(F)F)cc2)C1 2226746331 PLSJJZONWLWLIB-GFCCVEGCSA-N 275.270 2.097 10 10 CECE COc1ccc(N2CCn3ncc(O)c3C2)cc1Cl 2226921912 JHVWCILOTKHJQX-UHFFFAOYSA-N 279.727 2.271 10 10 CECE COc1ccc(N(C)C[C@@H]2CCC[C@H]2O)c(C=O)c1 2227698384 YZMSOIRYRDTMMW-XHDPSFHLSA-N 263.337 2.105 10 10 CECE CCN(CC)c1ccc(OC)cc1CNCCOC 2227674010 TWSRMHJWBAOEDL-UHFFFAOYSA-N 266.385 2.277 10 10 CECE CC[C@@](COC)(Oc1ccc(N(C)C)cc1)C(=O)O 2229369766 JADMSMVLTMCWPW-AWEZNQCLSA-N 267.325 2.011 10 10 CECE C[C@H](N[C@H](C(F)F)[C@@H]1CCOC1)c1c(O)cccc1O 2239519483 YXZSXBWCZCAKHF-RWEMILLDSA-N 287.306 2.419 10 10 CECE CC1(C)[C@@H]2CNC[C@@H]2CN1c1ccc(OCF)cc1 2278494053 TYOOUYJHFVACKJ-BXUZGUMPSA-N 264.344 2.427 10 10 CECE CN(CC[S@@](C)=O)c1ccc(CNC2CCC2)cc1F 2240008629 ZDAYLWHGPOVUGV-HXUWFJFHSA-N 298.427 2.283 10 10 CECE Oc1ccc(CNC[C@@H]2OCC[C@@H]2C(F)(F)F)cc1O 2240534974 LKMLUWCHPLBWRQ-CABZTGNLSA-N 291.269 2.155 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@H](C)O)cc2C)C1 2240837506 OPPBXDLNHAZRPC-QEJZJMRPSA-N 279.380 2.288 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC(=O)NC[C@H]1C(C)C 2240831523 USKWLLNUTYHNMA-DOMZBBRYSA-N 276.380 2.009 10 10 CECE CCCCCN(C)CCC(=O)NCc1ccc(N)cc1 2240931580 VCTFJTNPSSNNBG-UHFFFAOYSA-N 277.412 2.397 10 10 CECE Cc1cc(N(C)CC2(S(C)(=O)=O)CC2)ccc1[C@H](C)O 2285160086 ZRGMQFPMAVSQSA-LBPRGKRZSA-N 297.420 2.062 10 10 CECE CN(Cc1nncs1)c1ccc(CO)cc1Cl 2247591656 WCSPRDNXGITQAY-UHFFFAOYSA-N 269.757 2.320 10 10 CECE Cc1cc(O)c([C@H](C)N2CCS(=O)CC2)cc1Cl 2258553191 MEQDUDQMJGUYLJ-JTQLQIEISA-N 287.812 2.479 10 10 CECE Cc1cc(N(CC(C)C)C[C@H](C)O)ccc1CN 2259725301 UAEACXYRPJEJGR-ZDUSSCGKSA-N 250.386 2.297 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@@H]3[C@H]2CN)cc1Cl 2270410494 MLKOGTFXRUEYCB-HOTUBEGUSA-N 282.771 2.141 10 10 CECE CC[C@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@]3(C)O)cc1 2270692098 DCCBLXJNVGYNKS-XRGAULLZSA-N 261.365 2.337 10 10 CECE COc1cc(OC)c(N2CCC[C@@H](N)CC2)cc1OC 2289391161 BFOINZCOCKZWJM-LLVKDONJSA-N 280.368 2.030 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1c(F)cc([C@H](C)N)cc1F 2273209419 BDVNILUDJHWYOD-ZEGGKSINSA-N 270.323 2.334 10 10 CECE O[C@H]1CN(c2ccc(OC(F)F)cc2)C12CCC2 2263842942 WSOHWPOVNXUELC-NSHDSACASA-N 255.264 2.392 10 10 CECE COc1ccc(N2CC(F)(F)C[C@H]2CN)cc1F 2264306595 AQSMOGOKQGDKFZ-VIFPVBQESA-N 260.259 2.007 10 10 CECE CNC[C@H]1CCCN1c1ccc(OC)c(C)c1OC 2278034772 FZLANFHFPUARDV-GFCCVEGCSA-N 264.369 2.200 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3C[C@H]2CN(C)C3)cc1C 2269668493 VDFSTGBXJXVTMW-SNPRPXQTSA-N 259.397 2.168 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1cccc(OC)c1Cl 2283335941 XJBGESYXFYVDAY-LLVKDONJSA-N 298.730 2.463 10 10 CECE Cc1cc(N2CCN(C[C@H](C)F)CC2)ccc1[C@H](C)N 2285121210 KYXFKBCXQYOWFD-KBPBESRZSA-N 279.403 2.495 10 10 CECE Nc1cc(F)cc(F)c1C(=O)NCc1ccccc1O 2286769365 DUOQGILAWFUKHS-UHFFFAOYSA-N 278.258 2.183 10 10 CECE C[C@@H]1CNCCC[C@]1(Sc1nccs1)C(=O)O 2307041219 IQDXWBUIVNOHTR-LDYMZIIASA-N 272.395 2.078 10 10 CECE Cc1ccc(CN[C@@H]2CC[C@H](N)C2)c(O)c1Br 2307482728 SAHZIOFXNJMKAI-WDEREUQCSA-N 299.212 2.433 10 10 CECE C[C@@H]1CCC[C@H]1S(=O)(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333248 FBVVCVMPPAJENG-LMLFDSFASA-N 272.374 2.326 10 10 CECE Cc1cc(NS(=O)(=O)c2ccns2)cc(C)c1O 2318382244 FYLYZRHYRMBUSF-UHFFFAOYSA-N 284.362 2.266 10 10 CECE Cc1cc(N(C)[C@@H](CO)C(C)C)ccc1[C@@H](C)N 2318840816 PNVUOSHJNALKSM-DOMZBBRYSA-N 250.386 2.468 10 10 CECE O=C(O)[C@@]1(Sc2nccs2)CCCCC12CNC2 2327016290 WZNPBAUZYNHLEW-LBPRGKRZSA-N 284.406 2.222 10 10 CECE COc1cccc(O)c1CN[C@H]1C[C@@]2(C)CCO[C@@H]12 2329330151 FAUBKNIOBHIJDA-TUKIKUTGSA-N 263.337 2.058 10 10 CECE CN(C)c1ccc([C@@H](N)[C@H](O)[C@@H]2C[C@H]2C2CC2)cc1 2332643652 UBSDYGVHQIMFEY-ZJIFWQFVSA-N 260.381 2.159 10 10 CECE Cc1cc([C@H](C)N)ccc1N1[C@H]2CC[C@@H]1C[C@@H]2CO 2333978241 QSRROICXRQGUNP-DCDXPUDHSA-N 260.381 2.364 10 10 CECE CO[C@@H](C)[C@@H](NCCc1ccc(N)cc1)C(F)(F)F 2336580712 VYLIKIDCNQSYFB-JOYOIKCWSA-N 276.302 2.367 10 10 CECE NCc1ccc(N2CCCC[C@@H]2CO)cc1C1CC1 2339144596 ZKOVCBCVGRZINA-OAHLLOKOSA-N 260.381 2.374 10 10 CECE CN(c1ccc(CO)c(C2CC2)c1)C1(CO)CCC1 2339156290 USTRSZGFJGIOLZ-UHFFFAOYSA-N 261.365 2.408 10 10 CECE CO[C@H]1C[C@@H]2C[C@H]1CN2Cc1ccc(F)c(F)c1O 2340761887 HIJFELOZMCCNIN-NHCYSSNCSA-N 269.291 2.280 10 10 CECE COc1cccc(CN2C[C@@H]3C[C@H]2C[C@H]3OC)c1O 2340763747 SGEOUUQGHVWHOI-SGMGOOAPSA-N 263.337 2.010 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2c1ccc(CN)c(F)c1F 2340781175 PWUAASGDHNHZSR-JBLDHEPKSA-N 268.307 2.037 10 10 CECE Oc1cc2c(cc1O)CN(CC[C@@H]1CCCO1)CC2 2341214649 MZVLAYCLOAQNCF-ZDUSSCGKSA-N 263.337 2.025 10 10 CECE C[C@@H](NC[C@@]1(O)CCCSC1)c1ccc(F)cc1O 2343694655 UBAMHCNNDBXAPM-YGRLFVJLSA-N 285.384 2.440 10 10 CECE CCc1cnn(CCN2CCC[C@H](CN=[N+]=[N-])C2)c1 2349098946 AWYBHIFIHDBERK-CYBMUJFWSA-N 262.361 2.468 10 10 CECE CSc1cc(N2CC[C@@H](O)[C@H]2C(C)C)ccc1CN 2353856433 AXINSLBJDDSGOF-UKRRQHHQSA-N 280.437 2.463 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@H]2C[C@@H]3CC[C@H]2O3)cc1O 2355010816 POODYGXBPYKEHR-RLSLPTNOSA-N 277.364 2.449 10 10 CECE CO[C@@]1(C)C[C@H]2C[C@@H]1C[C@@H]2NCc1cccc(O)c1O 2356193514 XGKQNFQJYQUDSC-FOCJUVANSA-N 277.364 2.391 10 10 CECE CN(C)CCCN(C)c1ccc(CN)c(Cl)c1 111129325 DEHHHFAXOAVLBK-UHFFFAOYSA-N 255.793 2.187 10 10 CECE Cc1cc(/C=C/C(=O)O)ccc1N1CCCOCC1 61920586 NVPIIIDNSYQMMJ-GQCTYLIASA-N 261.321 2.320 10 10 CECE CCCc1cc(NC(=O)c2ccc(C)c(O)c2O)n[nH]1 177683709 ZKXGKIKHLITGAF-UHFFFAOYSA-N 275.308 2.334 10 10 CECE CN(C)Cc1cc(C2(C(=O)O)CCCC2)ccc1O 1951685640 UWRYAJTZUHAQDC-UHFFFAOYSA-N 263.337 2.350 10 10 CECE CC=Cc1nnc([C@@H](N)c2ccc(N(C)C)cc2)o1 1951318374 RLBXZVHGBLQLKY-ZDUSSCGKSA-N 258.325 2.217 10 10 CECE CC[C@@H]1CCCN1C(=O)c1ccn(-c2ccc(N)cc2)n1 37912713 XNVGMWQSZFVDQI-CYBMUJFWSA-N 284.363 2.469 10 10 CECE COc1ccc([C@H](C)NC2CCC(C(N)=O)CC2)c(O)c1 37152081 BZNRTLRHEXSEFM-UNXYVOJBSA-N 292.379 2.096 10 10 CECE CCCN(Cc1ccc(N)cc1)c1ncccc1C(N)=O 37672212 CQLAZUVLXKYUNF-UHFFFAOYSA-N 284.363 2.179 10 10 CECE COc1cc(C(=O)C(C)=O)ccc1Br 1951479748 LPGTZLRTRXFAPC-UHFFFAOYSA-N 257.083 2.229 10 10 CECE CNCc1cc(Br)c(COC)cc1O 214629352 JHLHGCNWCFXDSG-UHFFFAOYSA-N 260.131 2.021 10 10 CECE COc1cc(N)ccc1C(=O)Nc1ccc(N)cc1 34300958 BSOIJOQMWWJBSL-UHFFFAOYSA-N 257.293 2.112 10 10 CECE CN(O)Cc1c(O)cc(F)c(Br)c1F 218287527 LBQXNBNMTGTQKA-UHFFFAOYSA-N 268.057 2.254 10 10 CECE CC(C)NCc1ccc(N(C)[C@H](C)CO)c(F)c1 122669459 OQGIOPWOVMGBFX-LLVKDONJSA-N 254.349 2.141 10 10 CECE O=C(O)C[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 128835941 HPCYYQMXKDZXQZ-VIFPVBQESA-N 269.728 2.342 10 10 CECE CC(C)(C(=O)O)[C@@H](O)c1ccc(N2CCCC2)cc1 1951898123 PWLOLHKHGSBPIH-ZDUSSCGKSA-N 263.337 2.431 10 10 CECE CCN(CC)c1ccc([C@@](C)(O)[C@H](C)N)c(OC)c1 1951905836 MJJDVDSTQDLXNS-NHYWBVRUSA-N 266.385 2.096 10 10 CECE Nc1ccc(OCCCOC2CCOCC2)cc1 40992125 MEHMHRZURQGLQW-UHFFFAOYSA-N 251.326 2.233 10 10 CECE CN(C[C@@H]1CCCCO1)c1cc2c(cc1N)NC(=O)CC2 48947478 JNFQGEUMEQPNMI-LBPRGKRZSA-N 289.379 2.159 10 10 CECE CCOc1cccc(CN2CC[C@@H](CCC(=O)O)C2)c1O 134711279 QGCVVBCMBWNTHG-GFCCVEGCSA-N 293.363 2.478 10 10 CECE CCC(O)(CC)CN[C@@H](C)c1cc(O)ccc1O 87015114 CXPKTZZWPJBTOP-JTQLQIEISA-N 253.342 2.300 10 10 CECE CCC1C[C@H]2C(=O)N(CCc3ccc(N)cc3)C(=O)[C@@H]2C1 229873405 WGZCSEYIKWSADZ-HUUCEWRRSA-N 286.375 2.233 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](N(C)C)[C@H](C)C2)cc1 227226808 MXADKIFAUMMYRL-XJKCOSOUSA-N 261.413 2.353 10 10 CECE Oc1ccc(F)cc1CN[C@H]1CCO[C@H]1C1CC1 226618175 VCKXSESNABGUED-JSGCOSHPSA-N 251.301 2.188 10 10 CECE CN[C@]1(C(=O)O)CCC[C@H]1CCSc1nccs1 93629934 XMQNSHOSJPAIAR-JOYOIKCWSA-N 286.422 2.468 10 10 CECE CC(C)[C@H](CCO)N[C@H](C)c1ccc(O)cc1O 231072275 QUTIUNWKCVIYEQ-MFKMUULPSA-N 253.342 2.155 10 10 CECE CC(C)(CO)[C@H](N)c1cc(F)cc(Br)c1O 95706833 UFPGTTVXVWNADR-SNVBAGLBSA-N 292.148 2.312 10 10 CECE COc1cccnc1N(C)C(=O)/C=C\c1cncc(C)c1 255868632 ODMSMEPHMYZCIM-SREVYHEPSA-N 283.331 2.470 10 10 CECE COC(=O)[C@@H](C)c1ccc(Br)c(O)c1O 260234889 NBRSJGSBQZPCJX-YFKPBYRVSA-N 275.098 2.137 10 10 CECE C[C@@H](N)[C@](O)(c1ccc2c(c1)CCCN2C)C(F)(F)F 2163111770 VPUDJAIFYUPOGL-RNCFNFMXSA-N 288.313 2.166 10 10 CECE C[C@H](N[C@H]1CCn2nccc2C1)c1ccc(F)cc1O 2165193481 IYVJEWJEWNCHQA-JQWIXIFHSA-N 275.327 2.393 10 10 CECE CN1CCCc2cc([C@H](O)[C@]3(N)CC[C@@H]4C[C@H]43)ccc21 2165546079 WXXTYDHELKFADL-OFIKQIQMSA-N 272.392 2.230 10 10 CECE CO[C@@H]1CC(C)(C)CC[C@@]1(O)[C@@H](N)c1ccccc1O 2162134577 YUJDXKHVHAWGLI-YCPHGPKFSA-N 279.380 2.348 10 10 CECE CCCCc1ccc(CC(=O)OCC(=O)C(C)=O)cc1 808497355 YLUMCTIOSWFUIO-UHFFFAOYSA-N 276.332 2.273 10 10 CECE Cc1c(Br)cc(C=O)c(O)c1CN(C)C 642879321 IHGWKQLLXDPCNP-UHFFFAOYSA-N 272.142 2.337 10 10 CECE CC1(c2cncn2Cc2ccccc2O)CCNCC1 393306271 MPWGIGZOJSVATL-UHFFFAOYSA-N 271.364 2.278 10 10 CECE COc1cccc(CNC(=O)[C@@]2(C)C[C@@H]3C[C@@H]3C2)c1O 815834279 BLYWBMDSQFYDIS-DRXBFXEBSA-N 275.348 2.453 10 10 CECE C[C@@H](N[C@H]1CNCCC1(F)F)c1ccc(N(C)C)cc1 817978414 ANDODRPTPCNCFF-RISCZKNCSA-N 283.366 2.400 10 10 CECE CN1CCCc2cc(CN3CC[C@@H](CCN)C3)ccc21 723701518 JBRXFWXCIKFMML-CQSZACIVSA-N 273.424 2.240 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C[C@H]2CCN2C)cc1 2129883391 XYBZRIJOZNRNBY-XJKSGUPXSA-N 261.413 2.497 10 10 CECE COC(=O)[C@@H]1CCCN1C/C=C\c1ccc(N(C)C)cc1 835025771 NIAYNBGCVUVDPL-LEXSJLIMSA-N 288.391 2.403 10 10 CECE C[C@@H](Nc1cccnn1)c1ccc(N2CCOCC2)cc1 742397767 UNPDWNGPHIYTSF-CYBMUJFWSA-N 284.363 2.486 10 10 CECE Cc1cc(N(C)C)ccc1CN1CC[C@](O)(C(F)F)C1 840951621 ZUOOYPBHAHQEES-OAHLLOKOSA-N 284.350 2.263 10 10 CECE Cc1cc(O)c(CNCCCn2ccnn2)c(Cl)c1 840939330 LLWZZQYTZDHDGB-UHFFFAOYSA-N 280.759 2.125 10 10 CECE Oc1c(Cl)cc(Cl)cc1CNC1=NCCCN1 849214713 IDZSDAPTRGONIK-UHFFFAOYSA-N 274.151 2.138 10 10 CECE CC1(C)CC(NC(=O)c2c(F)ccc(O)c2O)C1 857339574 SPSVZJWCLCFSRI-UHFFFAOYSA-N 253.273 2.155 10 10 CECE COCCN(CCF)c1ccc([C@@H](C)N)cc1F 697285484 OFFCHRFTQNLTQS-SNVBAGLBSA-N 258.312 2.268 10 10 CECE Cc1cc(C)c(O)c(CN2CC[C@@H](Cn3ccnn3)C2)c1 853522917 QZPZIYKATVECEQ-CQSZACIVSA-N 286.379 2.123 10 10 CECE C[C@H](Cn1cncn1)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756491082 XVVWQTLKXVDOOH-CKYFFXLPSA-N 290.342 2.349 10 10 CECE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1 866766677 ANXYRBTVLHCUAL-DALJILGISA-N 287.359 2.309 10 10 CECE O=C(N[C@@H](C1CCC1)[C@H]1CCCO1)c1cccc(O)c1O 871120455 PQBPEXYTBBTYKB-KGLIPLIRSA-N 291.347 2.175 10 10 CECE COc1ccc(N2CC(C)(C)NC[C@@H]2C)cc1OC 58460245 DZSZTOPBCRZIOT-NSHDSACASA-N 264.369 2.281 10 10 CECE O=C(O)c1ncccc1NCc1cc(F)ccc1O 83451487 DMQILJWMPKQWER-UHFFFAOYSA-N 262.240 2.237 10 10 CECE Oc1ccc2c(c1O)[C@@H](c1ccc(F)cc1)NCC2 83620902 JIKZUPLZLVMXSN-CQSZACIVSA-N 259.280 2.472 10 10 CECE COc1cccc(O)c1CN(C)Cc1cnn(C)c1C 790937810 GYHXWOUALQOIBV-UHFFFAOYSA-N 275.352 2.075 10 10 CECE Cc1nc([C@@](C)(NCCCN=[N+]=[N-])C(=O)O)sc1C 702019617 KFXGSPSIZFNTHP-LLVKDONJSA-N 283.357 2.350 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](C)[C@H](CO)C2)c(F)c1 708116093 URAOKGXGOBZXPO-PWSUYJOCSA-N 284.350 2.139 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1O 709838359 AIHBOKACMUDOGQ-OXHZDVMGSA-N 276.380 2.022 10 10 CECE Oc1cccc(CNC[C@@]23CCC[C@H]2OCC3)c1O 687481886 QKFQSGFFISBFOY-HIFRSBDPSA-N 263.337 2.147 10 10 CECE Nc1ccc(CN2CCO[C@@H](C(F)(F)F)CC2)cc1 687571963 AZGNWQGRKGVPHU-GFCCVEGCSA-N 274.286 2.422 10 10 CECE CCn1cc(CN(C)CCc2ccc(N)cc2)c(C)n1 716409786 HKXABCRROMRIDS-UHFFFAOYSA-N 272.396 2.468 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@]23COC[C@@H]2C3)c(F)c1 689307628 ZUQJEUQOTYEUOI-IFUGULHKSA-N 264.344 2.318 10 10 CECE CC(C)[C@@H]1CNCCN1c1ccc(CN(C)C)cc1 689490928 HJIDDQUPWVMWRA-INIZCTEOSA-N 261.413 2.182 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)CN(C)C3)[C@@H](C)[C@H]1C 689494432 ZOVZPKQNRBIROG-IIYDPXPESA-N 273.424 2.455 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@@H]2CCC[C@H]2O)c1 689674289 AHHXMVSMWCZWBT-DZGCQCFKSA-N 277.364 2.188 10 10 CECE CCN[C@H](C)c1ccc(N2CC3(CCO3)C2)c(F)c1 2115159651 UYGCNZDSDZGHJK-LLVKDONJSA-N 264.344 2.475 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC23COC3)c(F)c1 2115158700 MHOYRXFKXTTZHL-NSHDSACASA-N 264.344 2.475 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCC[C@H]2CC[C@@H]21 2115758248 FYSMSKGXZFZSJQ-GVXVVHGQSA-N 266.345 2.398 10 10 CECE CCCN(CCC)C(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2123016463 XZKNHPHQWIPQCR-LBPRGKRZSA-N 267.377 2.410 10 10 CECE CCC[C@@H](CO)CNCc1cccc(OCC)c1O 2120748536 SVCVMYPGSMYTQB-GFCCVEGCSA-N 267.369 2.289 10 10 CECE CCN[C@H]1CCc2cc(N(C)CC[S@](C)=O)ccc21 2128297623 XISMEOMWKKBFFG-KXBFYZLASA-N 280.437 2.098 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2[C@H]2CC[C@@H]3O2)c(F)c1 1901312207 ZHIXFZYHEXEUFE-ZQDZILKHSA-N 262.328 2.183 10 10 CECE CC(C)N1CCN(c2ccc3c(c2)CC[C@H]3N)CC1 2128310993 OOGCPAYDUKRDPJ-MRXNPFEDSA-N 259.397 2.163 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H]3CC(O)C[C@@H]3C2)cc1 2128758120 JPYWTLNGOQFSGV-IOASZLSFSA-N 260.381 2.304 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H]2CN3C)cc1 2131040250 HQWPEFWQBRNVKN-RCBQFDQVSA-N 259.397 2.250 10 10 CECE CC[C@H](O)CNCc1ccc(C)c(Br)c1O 1905143020 MTDNAYQNOXTUJT-JTQLQIEISA-N 288.185 2.324 10 10 CECE C[C@@H](F)[C@@H](N)[C@H](O)c1ccc(N2CCCCC2)cc1 2133634853 ZPUQRLJJNDAEJD-KCPJHIHWSA-N 266.360 2.396 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@@H]3CC[C@H]32)c(Cl)c1 2133731660 JFLUDQNJJJRMJO-KYOSRNDESA-N 280.799 2.409 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@H]2[C@@H](C1)C2(F)F 1912148135 PUSMPTKIXFKMSB-NGZCFLSTSA-N 288.298 2.253 10 10 CECE CC[C@H](CCOC)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912189106 UKDOUWTUBNIWBW-GHMZBOCLSA-N 254.334 2.350 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CCO[C@@H]2CCOC2)C1 1912152630 WQFZKJXHNUIBPK-CHWSQXEVSA-N 268.361 2.204 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)CC1CCCC1 1912155349 HMWMKYQNMHPKPV-LLVKDONJSA-N 272.374 2.281 10 10 CECE CO[C@@H](CSc1ncc(C(=N)N)s1)C(C)C 2246259234 AHQJWDNGROIFMM-ZETCQYMHSA-N 259.400 2.190 10 10 CECE CO[C@H]1CCN(c2ccc([C@H](C)O)cc2[N+](=O)[O-])[C@H]1C 1914237648 AOFRUPSOLVVFJG-BHDSKKPTSA-N 280.324 2.262 10 10 CECE CCOC(=O)c1csc(NC(=O)c2cc(O)cs2)n1 1443358839 RLXLVHGCSOSQBQ-UHFFFAOYSA-N 298.345 2.339 10 10 CECE C=C/C=C\CC(=O)NCc1ccc(N2CCOCC2)cc1 1292065761 LMBNDIUWEQNTQS-ARJAWSKDSA-N 286.375 2.272 10 10 CECE CN(CCNCc1ccc(O)cc1O)C(=O)OC(C)(C)C 222016812 MAANUWMWJFOMND-UHFFFAOYSA-N 296.367 2.054 10 10 CECE NC[C@@]12CCC[C@@H](CN1Cc1c(O)cccc1F)C2 2135971529 ZSCCDBKAOWVJJD-ABAIWWIYSA-N 264.344 2.235 10 10 CECE COC1CN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)C1 1543544570 DVALNBYJEFKGRF-UHFFFAOYSA-N 298.386 2.494 10 10 CECE CN(CC(F)(F)F)c1ccc2c(c1)CC(=O)N2C 259191732 VVFHHVOIIUZETB-UHFFFAOYSA-N 258.243 2.204 10 10 CECE CS[C@H]1CCC[C@@H]1NCc1ccc(O)c(O)c1O 226758325 WQYCPLXKFAVOIO-ONGXEEELSA-N 269.366 2.177 10 10 CECE Nc1ccc(NC(=O)CSc2cccnc2)cc1 1921662588 ZJZBTHKQZKOLJN-UHFFFAOYSA-N 259.334 2.395 10 10 CECE CS[C@@H]1CC[C@@H](NC(=O)CCOc2ccc(N)cc2)C1 235047688 HYHGXZYQBULKIE-TZMCWYRMSA-N 294.420 2.438 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4CC[C@H]43)c(Cl)cc21 1923963822 KYOZJXQUJXDGDX-QUUYKZCZSA-N 277.755 2.281 10 10 CECE C[C@@H](NC(=O)c1coc(C=O)c1)c1ccccc1O 1643742338 ZLJJLSUICKCWHX-SECBINFHSA-N 259.261 2.289 10 10 CECE Cc1cccc(CNOCCNC(=O)OC(C)(C)C)c1O 1928525513 XEYUMVMVRXBJNY-UHFFFAOYSA-N 296.367 2.247 10 10 CECE COc1cc(N(C)C[C@H]2C[C@H](C)CO2)ccc1CN 2139690781 ZVLGNUMKNZXMPA-SMDDNHRTSA-N 264.369 2.015 10 10 CECE COCC[C@H](COC)N(C)Cc1ccc(C)cc1O 2139796466 PIYJIAZHDXIAPO-CQSZACIVSA-N 267.369 2.184 10 10 CECE Cc1ccc(CN2CC[C@](CN)(C3CC3)C2)c(O)c1 2139755615 HGQUCYUWBMJSDX-MRXNPFEDSA-N 260.381 2.261 10 10 CECE Cc1ccc(CN2CC[C@@]3(CCCNC3)C2)c(O)c1 2139775786 PRHJQFQUGPJTIU-MRXNPFEDSA-N 260.381 2.276 10 10 CECE Cc1ccc(CN(C)[C@H](CC(=O)O)C(F)F)c(O)c1 2139773025 YCSZVQUEQXVQIM-SNVBAGLBSA-N 273.279 2.241 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2CCC(=O)NC(C)C 162137819 QBXQEFZTLSIJMU-ZDUSSCGKSA-N 289.423 2.244 10 10 CECE C[C@@H]1OCCN(Cc2cc3c(cc2O)CCC3)[C@H]1C 164171607 UKALUZHVVMRIMJ-RYUDHWBXSA-N 261.365 2.490 10 10 CECE COc1ccc(CNC2CCS(=O)CC2)cc1C 157987178 OVCUCOFBBQENJI-UHFFFAOYSA-N 267.394 2.004 10 10 CECE NC(=O)C1CCN(/N=N/c2ccc(F)c(F)c2)CC1 1860496317 AUOCTKIKFIZQIC-WUKNDPDISA-N 268.267 2.161 10 10 CECE Nc1ccc(NC(=O)c2c[nH]c3ccccc3c2=O)cc1 1866053206 FUVKWRQSSPWVHX-UHFFFAOYSA-N 279.299 2.363 10 10 CECE COc1ccc(N(C)[C@H](CO)C(C)C)c(OC)c1 258873882 PJPNRHMLQISHKJ-CYBMUJFWSA-N 253.342 2.157 10 10 CECE Cc1cc2c(cc1N(C)C[C@@H](C)CC(=O)O)OCO2 258959931 VQQNFVYZAMMMST-VIFPVBQESA-N 265.309 2.271 10 10 CECE CCCOc1cc(N2CC[C@H](N)[C@@H](C)C2)ccc1N 1876325710 MZWDULKCGSKNAD-AAEUAGOBSA-N 263.385 2.231 10 10 CECE C[C@H](c1ccccc1O)N(C)CCc1c[nH]c(=N)s1 1877547363 YKFVARFXUSJLOI-SNVBAGLBSA-N 277.393 2.497 10 10 CECE CCCN(Cc1ccccc1O)Cc1nc(C)nn1C 2143366270 ITJAZBUCNNMDLS-UHFFFAOYSA-N 274.368 2.241 10 10 CECE C[C@H]1[C@@H](NCc2ccccc2O)CN1C(=O)OC(C)(C)C 1885890116 VVXCJRSZRUFKKK-AAEUAGOBSA-N 292.379 2.490 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1C[C@H]2O[C@H]1[C@H]1C[C@@H]12 2144068677 MBKIUMIYAYRPQK-OEAYZANCSA-N 281.302 2.183 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@@H]1CCNC1 1948871485 HWBGRTPUQOEBJH-SNVBAGLBSA-N 254.761 2.087 10 10 CECE CN(Cc1ccccc1O)S(=O)(=O)[C@H]1CC12CCC2 1965751494 GPHCTPZWDYPFEZ-ZDUSSCGKSA-N 281.377 2.096 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(C)C[C@H]3C[C@@H]3C)ccc21 250752943 WVSOLAJDMRPHCH-RWSFTLGLSA-N 273.380 2.382 10 10 CECE COc1ccc(CNCc2cnn3c2CCC3)cc1C 1965915512 SZGLNRGTELPNSI-UHFFFAOYSA-N 271.364 2.436 10 10 CECE COc1ccc([C@H](C)N(C)C[C@H]2CCN(C)C2)c(O)c1 251486923 BVGLACWGKHLOCH-STQMWFEESA-N 278.396 2.345 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC[C@@H](N)[C@H](C)C1 251672052 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2145933553 IRTYFONWRCYISA-KNPMLCFXSA-N 277.364 2.189 10 10 CECE CC[C@H]1CN(CC(=O)Nc2ccc(N)cc2)CCS1 157303165 ICTMBZDXWFTLLX-ZDUSSCGKSA-N 279.409 2.035 10 10 CECE OCc1ccc(N2C[C@@H]3CCO[C@H]3C2)cc1Br 2004625766 VRGUGYZJEYPSBE-ZANVPECISA-N 298.180 2.167 10 10 CECE Cc1c(F)cc(C(N)=O)cc1NCc1ccc(N)cc1 2148944005 QFWAGCYFAICQDY-UHFFFAOYSA-N 273.311 2.427 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1C[C@H]2CCC[C@H]2C1 157987695 DZQMDLDBFOEPCE-RWMBFGLXSA-N 273.380 2.328 10 10 CECE CCC[C@H]1CCN(S(=O)(=O)Cc2ccc(N)cc2)C1 158250024 JYVKYTAQDVUUBT-LBPRGKRZSA-N 282.409 2.221 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC[C@@H](C2CNC2)C1 2149003630 HQFKSAQJMSOJHI-SNVBAGLBSA-N 282.334 2.102 10 10 CECE Nc1ccc(CCCN2C[C@H]3C[C@H](O)CC[C@H]3C2)cc1 2146753770 MXEFDOQAFISBPH-ZMSDIMECSA-N 274.408 2.294 10 10 CECE Cc1ccc(N2CCN(c3ccc(N)cc3)CC2)nc1 37671399 DUKTVQJZMWSEJR-UHFFFAOYSA-N 268.364 2.299 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)c(F)c1 2149517671 DISKSGJGSLPRJX-SAXRGWBVSA-N 278.371 2.171 10 10 CECE 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10 10 CECE NCc1ccc(N2CCC[C@@H]([C@@H]3CCOC3)C2)cc1 2115011877 PITCTLVIHGXRPQ-HUUCEWRRSA-N 260.381 2.398 10 10 CECE C[C@H](c1ccc(O)cc1O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)O 2201096797 TVSIAZVWRVLHRO-MAGOMRGPSA-N 277.320 2.096 10 10 CECE CO[C@@H]1CC[C@@H]1CSc1ncc(CCN)s1 2212333229 SWHYNERBQZTIRI-PSASIEDQSA-N 258.412 2.161 10 10 CECE Cc1ccc(CN2CC[C@H]3CCN(C)C[C@H]3C2)c(O)c1 2204652922 YXHDJPLKCWAVKD-ZBFHGGJFSA-N 274.408 2.474 10 10 CECE Cc1cc(N(C)Cc2cccnn2)ccc1[C@H](C)O 2269689481 PARRZAGVBJZUMV-LBPRGKRZSA-N 257.337 2.475 10 10 CECE CC[C@@H](C)NC(=O)[C@@H](C)NCc1cnc(SC)s1 2208472663 CZEGSHXTRUIRTC-RKDXNWHRSA-N 287.454 2.258 10 10 CECE COc1ccc(N2CC[C@@H](O)CC23CC3)cc1F 2219608389 MRBPEBKKNSLWIO-LLVKDONJSA-N 251.301 2.328 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@@H]2CF)c(CO)c1 2220431816 VGQRLNUKCFCMNF-GHMZBOCLSA-N 253.317 2.229 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 2234173555 YGLLQFWJAMMQPJ-VPOLOUISSA-N 278.312 2.001 10 10 CECE CCN1CCc2cc(N3C[C@@H]4CC[C@@H](O)[C@H]4C3)ccc21 2235035398 GGYQQRBYTOQHTR-JLJPHGGASA-N 272.392 2.276 10 10 CECE CC1(C)[C@@H](CO)OCCN1c1ccc(OC2CC2)cc1 2235101882 RTEWWNPMQUCLFP-OAHLLOKOSA-N 277.364 2.204 10 10 CECE Nc1ccc(O)c(CN=c2[nH]c(C(F)(F)F)cs2)c1 2226415513 AQCAJYVLOIPTGZ-UHFFFAOYSA-N 289.282 2.484 10 10 CECE O[C@@H]1C[C@H]2CN(c3ccc4c(c3)CCCO4)CC[C@H]12 2226675541 VSHIDLSMAOKLDT-AEGPPILISA-N 259.349 2.219 10 10 CECE C[C@H]1C[C@@H](CO)CCN1c1ccc2c(c1)COCC2 2226709793 AQCLPJLAAUEUOI-STQMWFEESA-N 261.365 2.357 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](C)C[C@H](O)[C@H]2C)c(F)c1 2227598679 IXSOUWRQMPJIJY-OZWUEAAUSA-N 267.344 2.475 10 10 CECE COC[C@@H]1CC[C@@H]1N(C)c1ccc(OC)cc1CN 2227688111 MXBAVYOXEDDQKN-FZMZJTMJSA-N 264.369 2.015 10 10 CECE CCc1nccnc1CNCc1cccc(F)c1O 2228422991 LAKSONWZSNZXDC-UHFFFAOYSA-N 261.300 2.174 10 10 CECE CCN(C[C@H](F)[C@@H]1CCOC1)c1ccc(CN)cc1 2229952553 MQXPZJTXEHKBEP-HIFRSBDPSA-N 266.360 2.346 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)C[C@@H]1OCCO[C@H]1C 2240839809 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Cc1cc(N(C)[C@H]2CCN(C)C(=O)C2)ccc1[C@@H](C)O 2285160578 MDXVMFSPKPGXCX-OCCSQVGLSA-N 276.380 2.105 10 10 CECE N[C@H]1C[C@@H]2CC[C@H](C1)[C@H]2NCc1ccc2c(c1)CCO2 2285853413 HWRXASISBPFXAG-LTBQPASTSA-N 272.392 2.227 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)[C@@H]1COC2(COC2)C1 2286273249 WXHHPOTWFBEMLZ-OCCSQVGLSA-N 276.380 2.009 10 10 CECE COc1cc(OC)c(N2C[C@@H](N)CC2(C)C)c(OC)c1 2287138207 LUPUTNKEDMGVLH-JTQLQIEISA-N 280.368 2.028 10 10 CECE CCNCc1cc(F)c(N2CC[C@H](O)[C@H]2CC)c(F)c1 2288895363 OPPCYXHGPNPXNL-KGLIPLIRSA-N 284.350 2.424 10 10 CECE C[C@@H](NCc1ccc(N(C)C)cc1)[C@@H]1CC[C@H](N)C1 2296794769 OBDHVJDUPYEIEF-YUELXQCFSA-N 261.413 2.358 10 10 CECE CCN(CCCS(=O)(=O)C(C)(C)C)CCN=[N+]=[N-] 2315987764 ZGHXKTYVYFTSBP-UHFFFAOYSA-N 276.406 2.222 10 10 CECE Oc1cc2c(cc1CN[C@H]1C[C@H]3C=C[C@@H]1C3)OCO2 2330999860 KACRREATWJLPSN-UMNHJUIQSA-N 259.305 2.175 10 10 CECE C[C@@H](c1ccccc1O)N(C)C[C@@H]1[C@H]2CNCC[C@H]21 2333119778 GFGRALOLXJVIJB-ATGSNQNLSA-N 260.381 2.241 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@@H](O)[C@@H]2CC[C@@H]21 2333977551 UWPHSOPLDJEJND-RUAUBTSSSA-N 260.381 2.364 10 10 CECE Cc1ccc2sc(NN(C)S(=O)(=O)C3CC3)nc2c1 2339724904 XKGCALGVILBADB-UHFFFAOYSA-N 297.405 2.356 10 10 CECE Cc1c([C@H](C)N)ccc(N2CCN(C)[C@@H]3C[C@H]32)c1C 2340856009 NTSKPNZNTUKWEK-APHBMKBZSA-N 259.397 2.216 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC[C@@]3(O)C[C@H]3C2)c1C 2340859974 QUEPBDFDSKNLBW-DVOMOZLQSA-N 260.381 2.284 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2C[C@@H]3N(C)C)cc1 2340986142 BMBWZAOSZRGYJD-MZGVZZPPSA-N 260.381 2.269 10 10 CECE CC1(C)[C@@H](N)CCN1c1ccc2c(c1)OC(F)(F)O2 2352327492 QQUIKFKJOZUTLU-NSHDSACASA-N 270.279 2.324 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H]1CCC[C@]1(C)N 2353981357 SQTGXAWORRMOBX-RBOXIYTFSA-N 276.380 2.429 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H]3CO)c(F)c1 2354261131 KKPAEMWLIYEDGK-GUTXKFCHSA-N 278.371 2.285 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2C[C@@H]3C[C@H]2C[C@@H]3F)cc1 2354311361 NEIFIOHCVKQEJX-NZBPQXDJSA-N 276.355 2.454 10 10 CECE CN(CCCc1ccc(N)cc1)C[C@H]1[C@@H]2CCOC[C@@H]21 2355958670 KKGQDWHTYDGCGV-ULQDDVLXSA-N 274.408 2.416 10 10 CECE CNCc1ccc(N2[C@@H]3CC[C@@H]2CC(O)C3)cc1C 111392678 UWKRYUAQWSWKIF-HUUCEWRRSA-N 260.381 2.207 10 10 CECE Nc1ccc(OCc2nc(Cc3ccncc3)no2)cc1 111338735 DEGDXNAORDNBQB-UHFFFAOYSA-N 282.303 2.217 10 10 CECE C[C@H]1COCCN1c1c(F)cc(/C=C/C(=O)O)cc1F 62723219 PIHISHSDHZQTAU-HPOULIHZSA-N 283.274 2.288 10 10 CECE C[C@H](N[C@@H]1C[C@H]2[C@H]3CC[C@H](O3)[C@@H]12)c1ccc(O)cc1O 2356930676 HPLMTBFIGLXHIB-CGIRXUQKSA-N 275.348 2.314 10 10 CECE CC(C)C[C@H](N[C@@H](C)c1ccc(O)cc1O)C(=O)N(C)C 36924552 WUAJHWKWIAWVNN-FZMZJTMJSA-N 294.395 2.251 10 10 CECE CN(Cc1ccc(N)cc1)Cc1cc(C(N)=O)ccc1F 35360439 IEWFXKPEHXNEPA-UHFFFAOYSA-N 287.338 2.139 10 10 CECE CCCCNC(=O)[C@H](C)N(c1ccc(CN)cc1)C1CC1 34655523 JMPJRUSVIRKVRH-ZDUSSCGKSA-N 289.423 2.419 10 10 CECE COC[C@@H](O)CSc1ncc(-c2ccccc2)n1C 180646090 DRDVXPSGMZBPND-GFCCVEGCSA-N 278.377 2.187 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)c(F)c1 2358071075 MGHQUDKYXFCLMK-LESCFKLSSA-N 278.371 2.313 10 10 CECE N[C@H](C(=O)O)c1cccc(OCc2ccccc2)c1O 72196888 FFXHYPLSRPEGAB-ZDUSSCGKSA-N 273.288 2.056 10 10 CECE Cc1cccc(CN2CC[C@@H](c3cnn(C)c3)C2)c1O 180330881 SAXZFNLPJCTAGA-CYBMUJFWSA-N 271.364 2.424 10 10 CECE COc1cccc(C(=O)NCc2ccc(N)cc2)c1OC 37666300 SYUXYTDBKLURRG-UHFFFAOYSA-N 286.331 2.216 10 10 CECE Cc1nc(C(=O)NCc2ccc(O)c(O)c2)c(C)s1 182537945 LWVLSILMRMUASV-UHFFFAOYSA-N 278.333 2.101 10 10 CECE NCCSCC(=O)c1sc2ccccc2c1O 72261584 JWEDKVYWYREYTH-UHFFFAOYSA-N 267.375 2.482 10 10 CECE CCN(CC)CCOc1ccc(N2CCC[C@@H](N)C2)cc1 43471009 YMHFFADENTYCOM-OAHLLOKOSA-N 291.439 2.335 10 10 CECE C[C@H]1CN(Cc2cc(Cl)ccc2O)CCN1C 133886663 XYHMYKCMQRZVQW-JTQLQIEISA-N 254.761 2.182 10 10 CECE CN(C)C[C@@H](NCc1cccc(O)c1O)c1ccccc1 41116589 UBHQBKAZQRYFNE-OAHLLOKOSA-N 286.375 2.490 10 10 CECE Cn1c(COc2ccc(N)cc2)nc2cnccc21 88861184 VWSSQMHRYGHFNG-UHFFFAOYSA-N 254.293 2.130 10 10 CECE Cc1cc(N2CCn3cnnc3C2)ccc1CNC(C)C 81537609 SLNNBBWSQXRDHV-UHFFFAOYSA-N 285.395 2.105 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N1CC(C(=O)O)C1 86811240 GTJGKULYNJUHBG-GXSJLCMTSA-N 261.321 2.265 10 10 CECE OC[C@H]1CCCC[C@@H]1CNCc1cc2c(cc1O)OCO2 89524529 KYAWQZCPPKFNRP-VXGBXAGGSA-N 293.363 2.009 10 10 CECE CCN[C@H](C)c1ccc(N2CCN(C)C[C@@H]2C)cc1 233636454 BBTKMQLIOREQAV-UONOGXRCSA-N 261.413 2.497 10 10 CECE Cc1cc(Cl)ccc1[C@@H](NCCCN=[N+]=[N-])C(N)=O 235847596 PSGGJNRPPPRDCJ-LLVKDONJSA-N 281.747 2.465 10 10 CECE CC[C@H](C)C[C@@](CC)(NCCCN=[N+]=[N-])C(N)=O 90260441 AJKXHZUZDGUSAK-CMPLNLGQSA-N 255.366 2.347 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C2)cc1Br 233542059 GSIAFUCSRNUGCM-LBPRGKRZSA-N 299.212 2.130 10 10 CECE CC(C)[C@H](N)[C@@H](N)c1ccc(Br)cc1O 95839598 GOCDZKYWXSBODQ-QWRGUYRKSA-N 273.174 2.138 10 10 CECE C[C@H]1CC[C@H](NC(=O)COc2ccc(N)cc2)CC1 253123884 KGMDOHFLNLUKDH-AULYBMBSSA-N 262.353 2.343 10 10 CECE Cc1nc(/C=C\C(=O)NCc2ccc(N)cc2)cs1 701132660 RDAJPZGBHPGFSM-SREVYHEPSA-N 273.361 2.363 10 10 CECE COc1ccc(N(CC2CCC2)C2CNC2)c(OC)c1 2162631551 PLRSYQZJUPUQLK-UHFFFAOYSA-N 276.380 2.282 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H]4CNC[C@@H]4C3(C)C)ccc2O1 2162637173 NRWMVYSYMUWHBG-KYOSRNDESA-N 272.392 2.444 10 10 CECE Oc1ccccc1CNc1ncnc2c1ncn2C1CC1 292698423 JUIIIOCZVXFGFL-UHFFFAOYSA-N 281.319 2.479 10 10 CECE CCCOc1ccc(N2C[C@@H](OC)C[C@]2(C)CN)cc1 2162856853 NUKPCTGHIWMNBV-JKSUJKDBSA-N 278.396 2.418 10 10 CECE C[C@H]1CCCCN(c2cc3c(cc2F)[C@H](O)C(=O)N3)C1 703662365 PZMVKMNZDFUZQR-XPTSAGLGSA-N 278.327 2.438 10 10 CECE N[C@]1(c2ccc(N3CCCCC3)cc2)C[C@@H]2COC[C@H]21 2163108602 XXCRCQCBWOHKNK-XYPHTWIQSA-N 272.392 2.497 10 10 CECE CCN1CCc2cc([C@H](N)[C@]3(O)CCS[C@@H]3C)ccc21 2163137711 FYMVEIHMCSFJQM-RLCCDNCMSA-N 292.448 2.325 10 10 CECE CCN(CC)c1ccc([C@@H](NN)[C@H]2CSCCO2)cc1 2163144351 MIYYDCZEBNSTQY-HUUCEWRRSA-N 295.452 2.169 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCOCC[C@@H]1C 2165369474 RHKXDPYOONYBON-WCQYABFASA-N 284.360 2.025 10 10 CECE CO[C@H]1C[C@@H](OC)CN(c2ccc([C@H](C)N)cc2F)C1 2165505406 FACKDJRSJWLOQB-WCFLWFBJSA-N 282.359 2.086 10 10 CECE O=C(O)[C@H](O)c1cc(S)cc2c(O)csc12 396375734 MRZLHGQSYSZNJU-MRVPVSSYSA-N 256.304 2.014 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3OCC[C@H]3C2)c(F)c1 724796448 IUTSOTPIDGHTDS-GMXABZIVSA-N 264.344 2.461 10 10 CECE Nc1ccc(OCC(=O)OC2C[C@H]3[C@H](C2)C3(F)F)cc1 2163941087 JQALBEDTMNVGCN-RYUDHWBXSA-N 283.274 2.235 10 10 CECE CN1C[C@H]2CN(c3ccc4c(c3)CCCN4)C[C@]2(C)C1 702305169 ZXTMYLKOHUIZBA-YOEHRIQHSA-N 271.408 2.433 10 10 CECE C[C@@H](NC1[C@H]2CC3C[C@H]1CN(C3)C2)c1ccccc1O 2164452466 HYEYEJTVXKJPDH-GQEYFMCXSA-N 272.392 2.383 10 10 CECE Oc1cc(F)c(Cl)cc1CN1CCO[C@H]2C[C@@H]21 816616862 IBUICCYQBIZFMZ-JQWIXIFHSA-N 257.692 2.158 10 10 CECE CCCN[C@H](C)c1ccc(N(CCC)CC(N)=O)cc1 723167284 KVGQMLZNMKRBNE-CYBMUJFWSA-N 277.412 2.449 10 10 CECE Cc1cc([C@](C)(N)c2ccc(N(C)C)cc2)cnn1 2130270220 TWMXXNBRRDBQHQ-OAHLLOKOSA-N 256.353 2.073 10 10 CECE O=C(NCCc1ccccc1O)c1cc(O)cs1 732274535 QLGVQUMDKOUDDD-UHFFFAOYSA-N 263.318 2.132 10 10 CECE CN(C)c1ccc(/C=C\CN[C@H](C(=O)O)C2CC2)cc1 901476840 KSIYPTWLEFAHEN-JZIMQPMSSA-N 274.364 2.219 10 10 CECE CN(C)c1ccc(/C=C/CNC2(C(=O)O)CCC2)cc1 904007545 MLEWZVDDVBTGOP-HWKANZROSA-N 274.364 2.363 10 10 CECE C/C(=C\c1cccnc1)C(=O)N1CCCn2nccc21 846846834 YJHSTZICIVBVRP-ZRDIBKRKSA-N 268.320 2.118 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1C[C@]12CCCOC2 1894280063 SPFRDIRAMOYMHE-GVXVVHGQSA-N 264.329 2.104 10 10 CECE CC(C)(C(=O)O)C(F)(F)c1cc(O)c(O)c(O)c1 1952776411 UMBXMQNPOOQEQD-UHFFFAOYSA-N 262.208 2.006 10 10 CECE Cc1ccc(O)c([C@@]2(N)C[C@H]2C(=O)OC(C)(C)C)c1 1952767023 YYRXMBIUDTZZJB-NHYWBVRUSA-N 263.337 2.216 10 10 CECE C[C@@H]1CNC[C@H]1CN[C@H](C)c1ccc(N(C)C)cc1 925790562 ISWPUUKSPNCHEI-NFAWXSAZSA-N 261.413 2.259 10 10 CECE COC[C@H](CNCc1cc([N+](=O)[O-])ccc1O)C(C)C 922949718 QDDYTARPYJXLFV-LBPRGKRZSA-N 282.340 2.309 10 10 CECE CCN(CC)c1ccc(CNC[C@H](O)[C@@H]2CCCO2)cc1 858226748 PGIZVKAMCLKAGQ-IRXDYDNUSA-N 292.423 2.162 10 10 CECE C/C=C\CNCc1ccc(N2CCOCC2)c(F)c1 858290977 LCXBJXZEXVSRRA-IHWYPQMZSA-N 264.344 2.328 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1c(Cl)cnn1C 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CCCN(Cc1ccc(N)cc1)S(=O)(=O)C[C@@H](C)F 2121063398 BEVCHJMNRURFLJ-LLVKDONJSA-N 288.388 2.169 10 10 CECE CCN(C(=O)[C@H]1CCO[C@@H](C)C1)c1ccc(N)cc1 2126483019 QWCYDWBIJWUMLN-RYUDHWBXSA-N 262.353 2.437 10 10 CECE Cc1nc(OCCc2ccc(N)cc2)n2c1CCC2 2121549234 VOPLNRBNAXBDAB-UHFFFAOYSA-N 257.337 2.341 10 10 CECE CN(Cc1cc(F)cc(F)c1O)C[C@@H]1OCC[C@H]1F 2122537127 HPCGQELKWKVZLE-PWSUYJOCSA-N 275.270 2.229 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])C1(C(F)(F)F)CC1 2122718124 DPWLQTSLVRFLAW-ZETCQYMHSA-N 280.250 2.161 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C2C[C@H]3[C@H](C2)C3(F)F)CC1 2117727450 HXDBTCIYBSLJLV-IUCAKERBSA-N 270.283 2.484 10 10 CECE Oc1ccc(CNC[C@@H]2C[C@H]3C=C[C@H]2C3)c(O)c1O 2117772457 ZMKFTMJYUFIHQS-NHCYSSNCSA-N 261.321 2.105 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2C[C@@H]2C(=O)O)c1 2118312190 COVFGJCYNHBLQZ-BLFANLJRSA-N 263.337 2.460 10 10 CECE C[C@@H]1CCC=C[C@@]1(O)[C@@H](N)c1ccc(N(C)C)cc1 2119126434 MJLMPQSSFHHSJZ-KCXAZCMYSA-N 260.381 2.470 10 10 CECE CCCN1[C@@H](C)CN(c2ccc(CO)cc2)C[C@@H]1C 2130309518 WLBQZQVKZWUQPY-KBPBESRZSA-N 262.397 2.488 10 10 CECE OC[C@H]1CCCCN1c1ccc2c(c1)CCC[C@H]2O 2128270514 GPGQOKSXBAVLJO-GDBMZVCRSA-N 261.365 2.408 10 10 CECE CN(CC1(O)CCC1)c1ccc2c(c1)CCC[C@H]2O 2128280222 ZKYZTXSQCNHALN-OAHLLOKOSA-N 261.365 2.408 10 10 CECE O[C@@H]1CCc2cc(N3CCC4(CCO4)CC3)ccc21 2128322276 NRBVFYNUQFAVPM-OAHLLOKOSA-N 259.349 2.426 10 10 CECE C[C@@H]1CC[C@@H](CO)N(c2ccc3c(c2)CC[C@H]3O)C1 2128316698 ISGHKWBCQSEDEY-DIOULYMOSA-N 261.365 2.263 10 10 CECE CC=C=CCCNC(=O)CCOc1ccc(N)cc1 2130971896 WEPSGAYDCYXQAM-UHFFFAOYSA-N 260.337 2.275 10 10 CECE COC[C@H]1C[C@H]1CN(C)C(=O)Nc1ccc(N)cc1 2133421614 FVWUESBLGBKIND-WDEREUQCSA-N 263.341 2.015 10 10 CECE CC[C@H](C)S(=O)(=O)N1CCC(CN=[N+]=[N-])CC1 1912145178 DBOZCADJUMKPRL-VIFPVBQESA-N 260.363 2.137 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(O)c(Cl)c2)C1 1912172836 XEDSWTAHMNRPKR-UHFFFAOYSA-N 252.661 2.180 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)N2C[C@H]3C[C@H]3C2)C1 1912193100 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CSC1=N[C@@H](c2cc(C)ccc2O)C(C(=O)O)=C(C)N1 218329706 LYLDFHOJSXPTAM-LBPRGKRZSA-N 292.360 2.423 10 10 CECE C[C@H](Cc1ccco1)C(=O)NCc1c(O)cccc1O 1472063118 CZHNBZKMHCXITE-SNVBAGLBSA-N 275.304 2.186 10 10 CECE CC(C)C1CC(C(=O)NCCc2ccc(O)c(O)c2)C1 1921205544 PQRCNHYENKVBPL-UHFFFAOYSA-N 277.364 2.439 10 10 CECE C[C@@H](c1ccccc1O)N1CCN(CC(F)F)CC1 1923100895 BAROISDKTCHTJN-NSHDSACASA-N 270.323 2.336 10 10 CECE O=C(O)[C@H]1[C@H]2CC[C@@H](C2)N1Cc1cc(Cl)ccc1O 2136402695 KXWHJOIZADONFP-LJUAHTATSA-N 281.739 2.483 10 10 CECE CN1CCC[C@@H](CCN(C)c2ccc(CN)cc2)C1 260055432 MTBRDOTZSOAREO-HNNXBMFYSA-N 261.413 2.313 10 10 CECE Cc1sccc1CC(=O)NCc1cc(O)ccc1O 1637125835 DVLNNIAQBSRRNL-UHFFFAOYSA-N 277.345 2.327 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccc(F)cc1F 1630301910 MXLRMVOIGDSUNQ-UHFFFAOYSA-N 279.242 2.306 10 10 CECE C[C@@H](O)c1ccc(N2CC(=O)N(C)[C@H](C)C2)c(Cl)c1 1926022256 CZDYDQZQCVTZHA-NXEZZACHSA-N 282.771 2.060 10 10 CECE Cn1c(C=O)ccc1C(=O)NCc1cccc(Cl)c1O 1653567021 HXRBZINROCKCSR-UHFFFAOYSA-N 292.722 2.127 10 10 CECE COc1ccc([C@H](C)N[C@H](C)[C@@H](CO)SC)c(O)c1 230663132 LGRPAMOQTRURJQ-IMSIIYSGSA-N 285.409 2.164 10 10 CECE COc1ccc(N2C[C@@H](OC)C[C@@]2(C)CN)cc1Cl 2138254058 UYFRANNIEAZPDM-FZMZJTMJSA-N 284.787 2.291 10 10 CECE Oc1c(Cl)cc(Cl)cc1CNCCc1ncon1 231796323 LIQGYWSPCSMZMB-UHFFFAOYSA-N 288.134 2.414 10 10 CECE COc1c(C)cc2c(c1OC)C(=O)c1c(O)cccc1C2=O 14814128 LPMLREFNXDLTSN-UHFFFAOYSA-N 298.294 2.493 10 10 CECE biogenic,in-vitro CCNCc1ccc(N(C)CC2(O)CCOCC2)cc1C 161875751 HKOGEZFMVGDYLM-UHFFFAOYSA-N 292.423 2.082 10 10 CECE CNCc1ccc(N2CCCO[C@@H](C)C2)cc1OC 2139689062 UNOJJBPSYGJHQS-LBPRGKRZSA-N 264.369 2.030 10 10 CECE COc1cc(N(C)C[C@H]2CO[C@@H](C)C2)ccc1CN 2139704914 SEAGROLLPIKSEX-RYUDHWBXSA-N 264.369 2.015 10 10 CECE COc1ccc(N2CC[C@@](C)(C(=O)O)C2)cc1OC 259320789 IKOICSBJQBFUFD-CQSZACIVSA-N 265.309 2.005 10 10 CECE CNCc1ccc(N(C)C2CCOCC2)c(F)c1 36321987 FHPKDAPDIOVPSU-UHFFFAOYSA-N 252.333 2.160 10 10 CECE C[C@H]1C[C@@H](NCc2ccc(O)cc2O)CCS1 1940328702 PTWBROSLVIDKOR-ONGXEEELSA-N 253.367 2.472 10 10 CECE CO[C@H]1CCN(c2ccc(CNC3CC3)cc2F)C1 234853048 TXTYJIGIUBTKCN-ZDUSSCGKSA-N 264.344 2.303 10 10 CECE C[C@@H]1C[C@@H](N)CN(Cc2ccc(Cl)cc2O)C1 1942496711 BFGJMNDZLVZEQH-BXKDBHETSA-N 254.761 2.215 10 10 CECE CCN[C@H](CSc1nccs1)c1ccn(C)n1 1943201007 VUULLKLAOUYPAC-SNVBAGLBSA-N 268.411 2.320 10 10 CECE C[C@H](NCC12CCC(CC1)O2)c1c(O)cccc1O 1876698497 SHMRAPGLOVMBGD-NLTNOIMHSA-N 263.337 2.460 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)C23CCC(CC2)O3)C1 1876796576 DNIFCGSWYWRAOI-XSRFYTQQSA-N 264.329 2.247 10 10 CECE COc1cc2c(cc1OC)N1CCC3CC1(CN2)C3 1877354224 MLDROYZGNKNAAG-UHFFFAOYSA-N 260.337 2.488 10 10 CECE CC[C@](C)(C(=O)N(C)Cc1ccccc1O)C(N)=S 1877529043 MNVSVMGNYFTWJU-AWEZNQCLSA-N 280.393 2.053 10 10 CECE Cn1c(Cl)cnc1C=C1CCC[C@H]2CNC[C@@H]12 1944444366 AXWLOMFFDAAGFF-QWRGUYRKSA-N 251.761 2.476 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@H]2[C@H](C)O)c(F)c1 1880927680 LNEAVQRXIZIXSY-RVBZMBCESA-N 270.323 2.334 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H](CCO)C2)c(F)c1 1880926238 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2.337 10 10 CECE O=C(O)/C=C\c1ccc(N2CC[C@@H](N3CCC3)C2)cc1 702279690 HEBWOQITDUYNQY-IJVDHGTGSA-N 272.348 2.069 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@]3(C)C[C@@]3(CO)C2)c(F)c1 2165466015 YMSCUJRFXWLQSL-LYRGGWFBSA-N 278.371 2.315 10 10 CECE COc1ccc(CNC(=O)COc2ccsc2)c(O)c1 800559533 CZTABEMUSMEIKG-UHFFFAOYSA-N 293.344 2.158 10 10 CECE CCN(C)c1ccc(CN(CCOC)[C@H]2CCOC2)cc1 815104522 MTPJBEVTSVPZRL-KRWDZBQOSA-N 292.423 2.380 10 10 CECE Cc1cc(N2C(=O)[C@H]3CCC[C@H](C3)C2=O)ccc1N 718010106 DQFUGZVGJWPCTD-PHIMTYICSA-N 258.321 2.257 10 10 CECE O=C(NCc1ccccc1O)[C@@H]1CCc2cccc(O)c21 815833644 XPQMXVOPLXLZIG-CYBMUJFWSA-N 283.327 2.444 10 10 CECE CC[C@@H](c1cc(OC)ccc1O)N1CCOCC1 575279367 WAUSUBJUDKNUTE-ZDUSSCGKSA-N 251.326 2.184 10 10 CECE Cc1cn(C)nc1CN(C)c1ccc([C@H](C)N)cc1 723493640 SOCRQXPJDOFAES-LBPRGKRZSA-N 258.369 2.385 10 10 CECE COc1ccc(N2CCNC[C@H]2C(F)(F)F)c(F)c1 2130133089 PLQKDFPCIMSZFF-NSHDSACASA-N 278.249 2.175 10 10 CECE NCc1ccc(N2CC[C@H]3OCC[C@H]3C2)c(F)c1F 724832574 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COc1ccc(N(C)[C@@H](CN)CCSC)cc1 49968757 FUCFINDGIOQHGM-GFCCVEGCSA-N 254.399 2.212 10 10 CECE C[C@H]1CC[C@H](NC(=O)C(F)(F)F)CN1CCCN=[N+]=[N-] 1957244000 KVTAHFQHDAWZBI-IUCAKERBSA-N 293.293 2.218 10 10 CECE O=C(Cc1n[nH]c2c1CCCC2)N1Cc2cccc(O)c2C1 871205070 VFXXADLMXWVZLQ-UHFFFAOYSA-N 297.358 2.079 10 10 CECE O=C(CC[C@@H]1CCCO1)N1Cc2cccc(O)c2C1 871197951 AVXYDSVNKVWIOL-LBPRGKRZSA-N 261.321 2.194 10 10 CECE C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1O 779199677 GNAVBVNNGDFXOH-XHDPSFHLSA-N 266.360 2.094 10 10 CECE COc1cccc(O)c1CN1CCO[C@H](C)CC1 896586196 XEFYOSZBPCQRFL-LLVKDONJSA-N 251.326 2.012 10 10 CECE C[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CCO1 895540200 UPIDVMNYHSBOSH-QMMMGPOBSA-N 293.344 2.173 10 10 CECE CCN(CC)C(=O)CN1C[C@@H](C)Nc2cc(OC)ccc21 76927931 JWLZUKWOFYMGMD-GFCCVEGCSA-N 291.395 2.184 10 10 CECE CC[C@@](C)(N)C(=O)N(C)[C@@H](C)c1ccccc1O 94235701 SCUCGXQCOSYBRN-IINYFYTJSA-N 250.342 2.039 10 10 CECE N[C@H](c1nnc(C2CCCC2)o1)c1ccccc1O 83432239 ZXJZTABOBXIOND-LBPRGKRZSA-N 259.309 2.481 10 10 CECE OCCC1(CNCc2c(O)ccc(Cl)c2F)CC1 790987868 JCTUFIHUFJUSOJ-UHFFFAOYSA-N 273.735 2.437 10 10 CECE Cc1oc(Br)cc1C(=O)NCCN=[N+]=[N-] 396761481 IIWMZIQDRFCZCF-UHFFFAOYSA-N 273.090 2.391 10 10 CECE CC[C@H](O)c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)cc1 705608471 PCCYYIIVXJBIJV-LZWOXQAQSA-N 260.381 2.128 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H](C)CO)c(Cl)c1 688387614 LIBMVDACPPXYLD-ZJUUUORDSA-N 256.777 2.424 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1CC12CCOCC2 821907967 XZDMHYCPGUQFLJ-SNVBAGLBSA-N 252.318 2.010 10 10 CECE Oc1c(Cl)cccc1CNC[C@@]12COC[C@H]1C2 689246522 BBWCUTLLUNPXLN-MFKMUULPSA-N 253.729 2.172 10 10 CECE COC(C)(CCN[C@H](C)c1ccc(O)cc1O)OC 711033753 AATBUNVRAIJFKS-SNVBAGLBSA-N 269.341 2.148 10 10 CECE Nc1ccc(O)c(CNC(=O)C[C@@H]2CCCC2(F)F)c1 714016203 PGEVZHKNSGPCDA-JTQLQIEISA-N 284.306 2.416 10 10 CECE Nc1ccc(NC(=O)NC[C@@]23CCC[C@H]2OCC3)cc1 687491169 LQIOZVWTLQUZMF-HIFRSBDPSA-N 275.352 2.350 10 10 CECE CO[C@]1(CNCc2ccc(N(C)C)cc2)CCSC1 719265306 AOSSBFYTXZBQGU-HNNXBMFYSA-N 280.437 2.364 10 10 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CC(C)(C)[C@@H]1C[C@](O)([C@H](N)c2ccccc2O)CCO1 2148148323 OVWFBYRHQGPETG-LZWOXQAQSA-N 279.380 2.348 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)c1ccnc(C)c1 2148148166 NYQBLDABSPLDIJ-CVEARBPZSA-N 272.348 2.480 10 10 CECE C[C@@H](Cc1nccn1C)N[C@@H](C)c1cc(O)ccc1O 2148107703 MJZFDRCEILWWMW-QWRGUYRKSA-N 275.352 2.113 10 10 CECE COc1cccc(CN[C@H](C[S@](C)=O)C(C)(C)C)c1O 1964619952 XFXLYANOXRXTIG-XCLFUZPHSA-N 299.436 2.284 10 10 CECE COCCNCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 250166153 IGOJJZKVGBQGFZ-HOCLYGCPSA-N 260.381 2.411 10 10 CECE Nc1ccc(CCC(=O)Nc2ccc(CO)cc2)cc1 138966272 QDFJBPWPCADWFA-UHFFFAOYSA-N 270.332 2.332 10 10 CECE Oc1ccccc1CN1C[C@]23CCC[C@]2(COC3)C1 1967849396 HTKOQGYDDZBDMU-IYBDPMFKSA-N 259.349 2.395 10 10 CECE Cc1ccc(CN2CC[C@H](C(=O)O)C2(C)C)c(O)c1 1968221577 AMDCMHYNRAQENK-GFCCVEGCSA-N 263.337 2.386 10 10 CECE CC[C@@H](N[C@H]1C[C@H](CS(C)(=O)=O)C1)c1ccccc1O 1974471144 QRSNQHHVAXYBHN-YRGRVCCFSA-N 297.420 2.256 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C[C@H]1CCCC(=O)N1 2145934092 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CC[C@@H](N)c1ccc(N2CC[C@@H]3OCCO[C@@H]3C2)cc1 2151738743 NMKXDWWGQCJLON-OWCLPIDISA-N 276.380 2.091 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@](C)(F)C3)ccc21 2152236752 FTOBUZQPEHRWKX-ZFWWWQNUSA-N 277.343 2.228 10 10 CECE CN(C[C@H]1CCCCCO1)C(=O)c1ccc(O)c(O)c1 2152630736 ALFTUPTWEGWJEL-GFCCVEGCSA-N 279.336 2.129 10 10 CECE Cc1cc(N2CC[C@H]([C@H]3CCOC3)C2)ccc1CCN 2153026766 YUIROZGGPCULFJ-HOTGVXAUSA-N 274.408 2.359 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CCS[C@H]1CCOC1 2009446552 YDCCTKMDEJRDJS-MNOVXSKESA-N 256.375 2.283 10 10 CECE Cc1cc(CNC2CC2)ccc1OCO[C@@H]1CCOC1 2155012796 JYAPMZZQOVKGCX-OAHLLOKOSA-N 277.364 2.389 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3COC[C@@H]32)cc1Br 2013472374 AKGTYVQYNIFDLL-RVBZMBCESA-N 297.196 2.304 10 10 CECE Oc1ccc(CCNC[C@@H]2CCCS2)cc1O 2016779668 LIYVPWRMYFSYHT-NSHDSACASA-N 253.367 2.126 10 10 CECE C[C@@H](O)[C@H]1CCCN1c1ccc(CN)c(Cl)c1 2018120029 VOIOQPYXFBHZTD-NOZJJQNGSA-N 254.761 2.148 10 10 CECE CC[C@@H](N)Cc1cnc(Sc2ccnnc2)s1 2022119861 OTNOVPIATYUSLG-MRVPVSSYSA-N 266.395 2.364 10 10 CECE COC[C@@](C)(NCc1ccc(O)c(O)c1)C1CC1 2028617373 SIOAMJDLMSTCIH-CQSZACIVSA-N 251.326 2.003 10 10 CECE CO[C@H]1CN(c2ccc3c(c2)CCCN3)C[C@@H]1F 2029818927 RJWVNQXHUCPPQH-JSGCOSHPSA-N 250.317 2.218 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@H]1CC[C@@H](F)C1 2032985390 STKCHTNMVWQMGY-NWDGAFQWSA-N 250.317 2.365 10 10 CECE C[C@H](NC[C@@H]1OCC[C@@H]1C)c1ccc(O)cc1O 2034984834 MCLMYCPILGMSTJ-BHDSKKPTSA-N 251.326 2.173 10 10 CECE Cc1cnc(C)c(NCc2ccc(O)c(O)c2O)c1 404589912 WTQJRLOWWRNIAH-UHFFFAOYSA-N 260.293 2.427 10 10 CECE C[C@H](NC1CC(n2cncn2)C1)c1cc(F)ccc1O 2159855679 TWBNECIJWYEKKQ-GCVQQVDUSA-N 276.315 2.177 10 10 CECE CN(C)c1ccc(CN2CCCC[C@@H](CN)C2)cc1 312095389 DVJCFRFPKYQOTP-HNNXBMFYSA-N 261.413 2.313 10 10 CECE CN(C)c1ccc(CN2CC[C@H]3CNC[C@@H]3CC2)cc1 312890800 WRKJCUKUTUENPU-HOTGVXAUSA-N 273.424 2.184 10 10 CECE NCc1ccc(N2C[C@@H]3CN4CCCC[C@@H]4[C@H]3C2)cc1 2170529665 PZBVKNGZRZXFIT-BHYGNILZSA-N 271.408 2.066 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@@H]2CCCC2(F)F)c1 327897288 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C[C@@H](c1ccccc1O)N1C[C@H]2CC[C@@H](C1)C2C(=O)O 708455454 AXNGMBFKEGJROU-NUKBIBLZSA-N 275.348 2.496 10 10 CECE Fc1cc(CNC2CC2)ccc1N1C[C@H]2CCO[C@H]2C1 2172043051 ALZBGDWLUZXHAW-WBMJQRKESA-N 276.355 2.303 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3CCO[C@H]3C2)cc1O 2172036618 WEVKCSOCVOUAAZ-WQGACYEGSA-N 276.380 2.288 10 10 CECE NCc1ccc(N2CC(N3CCCCC3)C2)cc1Cl 698025794 JSNGTJFOHNIJGB-UHFFFAOYSA-N 279.815 2.473 10 10 CECE Oc1c(F)cccc1CNCCO[C@@H]1CC1(F)F 690727423 RAAYSZDCIOCYFI-SNVBAGLBSA-N 261.243 2.045 10 10 CECE CC[C@H](c1ccccc1O)N(C)CCN(C)C(=O)OC 690817306 SBQGHCHMGTVHAC-CYBMUJFWSA-N 280.368 2.473 10 10 CECE CCc1cccc(CN2CC[C@@H](N(C)C)[C@@H]2C)c1O 692129384 LARPFSCJDSTKLM-SWLSCSKDSA-N 262.397 2.479 10 10 CECE CCNCc1ccc(OCc2cnn(CC)n2)c(C)c1 2172440113 AIJRIMXNTDUWQC-UHFFFAOYSA-N 274.368 2.295 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@@H](CO)[C@@H](F)C2)cc1 2177144312 QTVPNZXFZILJSA-ZFWWWQNUSA-N 280.387 2.341 10 10 CECE COc1ccc(N2CCN(c3nc(O)cs3)CC2)cc1 383490159 WRJCYXLWBUYPPH-UHFFFAOYSA-N 291.376 2.184 10 10 CECE C[C@H]1CN(C(=O)CCc2ccc(N)cc2)CC[C@@H](C)O1 694890088 XCAQXBVPQFCYGX-OLZOCXBDSA-N 276.380 2.227 10 10 CECE CNCc1ccc(N2C[C@@H](O)C(C)(C)C2)cc1Cl 388199704 DEBCLTNAJLVEMY-CYBMUJFWSA-N 268.788 2.267 10 10 CECE Cc1nnc([C@H](C)NCc2cccc(O)c2O)s1 391777656 KXQZWXVKBIYPES-ZETCQYMHSA-N 265.338 2.109 10 10 CECE CC(C)(NC(=O)c1ccc(O)c(O)c1)C(F)(F)F 393854794 JKBDANCMQPXCFK-UHFFFAOYSA-N 263.215 2.169 10 10 CECE C[C@@H](N[C@H](CO)C(C)(C)C)c1ccc(O)cc1O 393977894 YTBUAHKOEVXTQD-NOZJJQNGSA-N 253.342 2.155 10 10 CECE CCCNCc1ccc(N2CC(=O)N[C@H](C)C2)c(Cl)c1 395690345 FYEODWHZVLEJPA-LLVKDONJSA-N 295.814 2.164 10 10 CECE Cc1cc(C)n(Cc2noc(-c3sccc3O)n2)n1 395986988 HERBNXJWMQQXCO-UHFFFAOYSA-N 276.321 2.365 10 10 CECE CC[C@]12C[C@H]1CN(c1cc3c(cc1N)NC(=O)CC3)C2 2167536360 STAWGIOZOKJWLS-MEDUHNTESA-N 271.364 2.390 10 10 CECE CC(F)(F)c1ccnc(NCc2cc(N)ccc2O)n1 2174451707 IHCYERQLKKVXLL-UHFFFAOYSA-N 280.278 2.488 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H]1C[C@H]2CC[C@H]1O2 2168069262 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CC[C@H]1[C@@H](O)CCN1c1c(F)cc([C@H](C)O)cc1F 2273212208 CDNLDRCYWJKMSG-HJIKLVIJSA-N 271.307 2.368 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)Cc1cnccn1 2232034677 ARJYPZHBSOQDAD-GFCCVEGCSA-N 256.353 2.441 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC[C@@H]1c1ncon1 2232100607 OPHCGFYSSJQDIX-ZWNOBZJWSA-N 259.309 2.383 10 10 CECE Cc1ccc(CN(C)C[C@@]2(F)CCOC2)c(O)c1 2222368284 DHLNPXZVGVPEGH-AWEZNQCLSA-N 253.317 2.261 10 10 CECE Oc1ccccc1CN[C@@H](C(F)F)[C@H]1CCOC1 2223240669 CZLRQWJLFQDRKE-CMPLNLGQSA-N 257.280 2.152 10 10 CECE COc1ncc([C@@H](N)c2ccc(N(C)C)cc2)cc1F 2233885087 HBCPERFCCGLCCM-AWEZNQCLSA-N 275.327 2.343 10 10 CECE CC(=O)NCCCCCC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2234171976 QCLICFOKSYOBJI-RYUDHWBXSA-N 281.360 2.031 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@@H](F)C2)c(F)c1 2234659792 JGPFDMRRXYCSHE-OLZOCXBDSA-N 284.350 2.234 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cccn(C)c1=O 2224988880 ADNPDUWXGYFIIR-LLVKDONJSA-N 258.321 2.288 10 10 CECE CCCOc1ccc(N2C[C@H](CO)OC(C)(C)C2)cc1 2235113262 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Cc1cc(N(CCOCCO)C(C)C)ccc1[C@H](C)O 2285175322 KNVVOPYFLBKVLA-AWEZNQCLSA-N 281.396 2.272 10 10 CECE Nc1ccc(C[C@H](O)c2cnc3ccccc3n2)cc1 2285264979 ZJQLULCYOSCTPT-INIZCTEOSA-N 265.316 2.488 10 10 CECE CCN1CCc2cc([C@]3(O)CCC[C@]3(C)CN)ccc21 2286855224 FUHRVIWMQJDKEZ-IAGOWNOFSA-N 274.408 2.406 10 10 CECE COc1cccc(CNC[C@@H]2C[C@@H]3CC[C@H]2O3)c1O 2296775711 MXVIGSXDMYBSSH-RWMBFGLXSA-N 263.337 2.058 10 10 CECE OC[C@H]1C[C@@H](NCc2cccc(Cl)c2O)[C@@H]2C[C@H]12 2309229775 ZXVWMIHYOOMYEP-PRULPYPASA-N 267.756 2.152 10 10 CECE CSc1ncc(CNC[C@@H]2OC(=O)CC23CC3)s1 2321739849 UKIBLCQVNPRKNC-VIFPVBQESA-N 284.406 2.050 10 10 CECE CCN1N=C(C)C(=Cc2cc(OC)ccc2OC)C1=O 2332114828 UQHZPPOCZRSHDG-UHFFFAOYSA-N 274.320 2.325 10 10 CECE C[C@@H]1C[C@@H]1[C@](CO)(CSc1nccs1)NC1CC1 2328005443 MCFDVAQECHKCHC-CDMKHQONSA-N 284.450 2.374 10 10 CECE C[C@@H](NC[C@@H]1C[C@H](O)C1(C)C)c1ccc(O)cc1O 2328928744 QHBWQAPGLLEWHW-BFVZDQMLSA-N 265.353 2.155 10 10 CECE Nc1ccc(CCC(=O)N2C[C@@H]3C[C@H]2[C@H]2C[C@@H]23)cc1 2329275180 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233541985 STQQTPLVZFEHEA-NSHDSACASA-N 299.212 2.130 10 10 CECE COc1cccc([C@@H](NN)c2ccc(N(C)C)cc2)c1F 97774309 HSNBTJDUTUBLKB-INIZCTEOSA-N 289.354 2.453 10 10 CECE CCOC(=O)[C@H](NCC(C)C)c1cc(F)ccc1O 233705634 PTXOHQBUGQIUAW-CYBMUJFWSA-N 269.316 2.381 10 10 CECE N[C@@H](c1cccc(Br)c1O)C(F)F 238641991 SCMFYCYETCGQSU-LURJTMIESA-N 252.058 2.420 10 10 CECE CC(C)[C@H](O)[C@H](N)c1c(Br)ccc(F)c1O 95805060 BQLOMHMKDHPSLT-ZJUUUORDSA-N 292.148 2.311 10 10 CECE C[C@@H](CCCO)NC(=O)/C=C/c1ccc(N(C)C)cc1 94945789 LWBYVOBKMDSRDH-YKWSONSWSA-N 276.380 2.043 10 10 CECE C[C@@H](CN)c1c(F)cc(O)c(O)c1Br 258327197 CCRSSHLJDLBHBK-BYPYZUCNSA-N 264.094 2.062 10 10 CECE NCc1ccc(N(CCO)Cc2ccccc2)c(F)c1 50513794 PSBBHBAXHBGAEH-UHFFFAOYSA-N 274.339 2.283 10 10 CECE O=C(O)[C@H]1CC[C@H](CNCc2ccc(O)c(O)c2)CC1 253106372 BLAGDMOYDHENCR-UMSPYCQHSA-N 279.336 2.078 10 10 CECE CCC[C@H](N)C(=O)c1ccc(OC)c2c1ccn2C 606596074 IKBXHFMFFZTGEH-LBPRGKRZSA-N 260.337 2.497 10 10 CECE CC[C@H]1CCN1C(=O)NCc1ccc(N(C)C)cc1 291555622 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C[C@](N)(CC(=O)O)c1cccc(C(F)(F)F)c1O 725391251 BYHRZAYEZMSSRE-JTQLQIEISA-N 263.215 2.060 10 10 CECE Nc1ccc2c(ccn2C[C@@H]2C[C@@H]3COC[C@@H]3O2)c1 724593945 IZLDMFUXCPUROT-ZLDLUXBVSA-N 258.321 2.027 10 10 CECE CC[C@H](C)[C@@H](c1c(O)cccc1OC)N1CCNCC1 575289373 VMQXVEXRRRMOEJ-LRDDRELGSA-N 278.396 2.393 10 10 CECE Cc1cccc(CN[C@@H]2C[C@H](C)n3ncnc32)c1O 826889206 RTFXOTZRKOAFJS-CMPLNLGQSA-N 258.325 2.088 10 10 CECE CNC(=O)[C@@H]1CCCN1c1ccc([C@@H](C)N)cc1Cl 723185979 YRYCWZXOTWYRFY-RNCFNFMXSA-N 281.787 2.075 10 10 CECE CC1(C)CO[C@H](CCC(=O)NCc2ccc(O)c(O)c2)C1 901133863 ZEHUCSZCPITOSI-GFCCVEGCSA-N 293.363 2.309 10 10 CECE CCOC(=O)CN(C)C/C=C/c1ccc(N(C)C)cc1 835026190 RTCVCFIILHSZQP-VOTSOKGWSA-N 276.380 2.261 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCC[C@@H]2C[C@H]21 830559627 QNDWFXSDOJLBKU-IJLUTSLNSA-N 261.321 2.150 10 10 CECE O=C(N[C@H]1CCCC1(F)F)c1c(F)ccc(O)c1O 832067272 QSLXFCODBZAVLL-QMMMGPOBSA-N 275.226 2.155 10 10 CECE CCN(C/C=C\c1ccc(N(C)C)cc1)[C@@H](C)CO 835055613 LQIMVVCTEDLFGQ-AFNCTOJWSA-N 262.397 2.469 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 910956649 MOHODFQBIADDTG-RGCYKPLRSA-N 273.332 2.006 10 10 CECE CCOCc1cc(CN[C@H]2CCNC[C@H]2C)ccc1OC 841063156 FDICYUWIMJMJQR-CJNGLKHVSA-N 292.423 2.319 10 10 CECE CCN1C(=O)C(C)(C)N[C@@H]1c1ccc2c(c1)CCCN2C 840834680 ZUGKVBPJDZTFGO-HNNXBMFYSA-N 287.407 2.298 10 10 CECE O=C1CC[C@@H](c2cc(Br)c(F)c(F)c2O)N1 687771662 SVUPYXDPAYTPJH-LURJTMIESA-N 292.079 2.384 10 10 CECE C[C@@H](NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 926943292 BYZOAHDTZCXODE-WNOSKKOXSA-N 290.407 2.207 10 10 CECE CCCn1cc(C(=O)NCc2c(O)cccc2F)cn1 928709060 WYZYZZKRCIAUSL-UHFFFAOYSA-N 277.299 2.068 10 10 CECE C[C@H](CC(=O)NCCc1ccc(N)cc1)[C@H]1CCCO1 851632960 ZKNAIMLRUDRNRF-IUODEOHRSA-N 276.380 2.133 10 10 CECE Cc1ccc([C@H](C)N[C@@H](C)Cn2cncn2)c(O)c1 756489036 OJJUOUMMLJBICW-RYUDHWBXSA-N 260.341 2.031 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@@H]4COC[C@@H]43)ccc21 1899113901 WHXCSPIROGLAAC-UHOFOFEASA-N 259.349 2.281 10 10 CECE CCCNC(=O)c1ccc(N2Cc3cccc(O)c3C2)nc1 866120193 XMSVZYGKQCEDHY-UHFFFAOYSA-N 297.358 2.447 10 10 CECE Cc1cc(Cl)cc([C@@H](C)NCCOCCCN)c1O 863544987 GIMOHTHKFCGRLN-LLVKDONJSA-N 286.803 2.370 10 10 CECE COCC[C@H](C)NC(=O)N[C@@H](C)c1ccccc1O 868192414 KYCLJNXQFGFYCX-QWRGUYRKSA-N 266.341 2.177 10 10 CECE C[C@@H](NCc1cc(C(N)=O)co1)c1cc(F)cc(F)c1O 779069756 ZKYJHDHTSRKMJW-SSDOTTSWSA-N 296.273 2.213 10 10 CECE CCOC(=O)C1=NN(c2cccc3ncccc23)C(=O)[C@@H]1C 871945405 OOWCESIRBXTJST-SNVBAGLBSA-N 297.314 2.137 10 10 CECE CC1(N2CCC2)CCN(Cc2ccccc2O)CC1 895671055 MQFPKHFXMSJPEU-UHFFFAOYSA-N 260.381 2.452 10 10 CECE [N-]=[N+]=NCCNC(=O)CSCc1ccccc1 706100277 BPGZBOCYBGFMGZ-UHFFFAOYSA-N 250.327 2.346 10 10 CECE CN[C@H](C)c1ccc(N2CCNC(=O)C[C@@H]2C)c(Cl)c1 707639110 AXOAFAAHENZFCX-WDEREUQCSA-N 295.814 2.335 10 10 CECE Cc1ccc([C@H](C)N(C)C[C@H]2CN(C)CCO2)c(O)c1 709413399 CRLPKXOQYBFQPS-UONOGXRCSA-N 278.396 2.024 10 10 CECE CC[C@H]1C[C@H](NCc2cccc(OC)c2O)CO1 688486391 LFPHPKDPSXMYLM-RYUDHWBXSA-N 251.326 2.058 10 10 CECE Cc1cc(N2CC[C@H](N(C)C)[C@H](C)C2)ccc1CN 693662642 SFVMLFHNLVXEBL-CJNGLKHVSA-N 261.413 2.230 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CCC[C@@H]1N 85369487 VUTHNHLWBJPGIR-WXHSDQCUSA-N 262.353 2.039 10 10 CECE CC(C)Oc1cc(N(C)Cc2ccc(N)cc2)ncn1 90786254 LCIYYBQODWODHR-UHFFFAOYSA-N 272.352 2.482 10 10 CECE CC[C@H]1CN(Cc2ccc(OC)cc2O)C[C@H](C)O1 92487659 RDAVDHZNJQTDTK-AAEUAGOBSA-N 265.353 2.400 10 10 CECE C[C@@H]1OCC[C@@H]1C(=O)N(Cc1ccc(N)cc1)C1CC1 94173821 GIBVBPPVWWDYGJ-NHYWBVRUSA-N 274.364 2.185 10 10 CECE CSC[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1159308799 LDINXHRONKXUFQ-GFCCVEGCSA-N 295.404 2.242 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)C1C[C@@H]2CC[C@H](C1)O2 2124926789 NMIHIYKYGBEMCU-RDFFEMEHSA-N 264.329 2.245 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CCCC[C@H]1CF 2115226646 VNPBTLAXOLNHJZ-NSHDSACASA-N 268.288 2.416 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NC1C[C@H]2[C@@H](C1)C2(F)F 1328781393 UFWFXUUSUFHDOX-OBLLXGLHSA-N 295.285 2.271 10 10 CECE CC(C)NCc1ccc(N(C)[C@H]2C[C@H](O)C2)c(F)c1 2122886152 KJGSOWVCVKHBKV-JOCQHMNTSA-N 266.360 2.283 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2C=C[C@H](OC)C2)c1 2119389848 HDLYPGWABGPSTG-SRVKXCTJSA-N 263.337 2.395 10 10 CECE CCCN(C(=O)[C@@H]1[C@@H]2CCO[C@@H]21)c1ccc(N)cc1 2119958888 OISJVRJIHQYYPF-MJBXVCDLSA-N 260.337 2.047 10 10 CECE CN[C@H]1CCCc2cc(N3CCC34COC4)ccc21 2128273243 JZZHMOBJVUXJRQ-HNNXBMFYSA-N 258.365 2.263 10 10 CECE N[C@H]1CCCc2cc(N3CC4(C=CCO4)C3)ccc21 2128279881 VBPNGYUWOVJSKP-HNNXBMFYSA-N 256.349 2.168 10 10 CECE C[C@H]1C[C@H](CO)CN(c2ccc3c(c2)CC[C@@H]3O)C1 2128316762 JLURSVJBBVQHNU-MKBNYLNASA-N 261.365 2.121 10 10 CECE CN(Cc1ccnn1C)c1ccc2c(c1)CC[C@H]2O 2128316743 JHPMNVDNDKQVHQ-OAHLLOKOSA-N 257.337 2.036 10 10 CECE CC(C)CCN(CCO)c1ccc2c(c1)CC[C@@H]2N 2128320873 GSVRLFVSQFAXRU-INIZCTEOSA-N 262.397 2.477 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc2c(c1)CCC[C@H]2N 2128351527 NNZAJJQPSKIKLX-HWWQOWPSSA-N 260.381 2.230 10 10 CECE OCCC[C@@H]1CCCN1c1ccc2c(c1)CC[C@H]2O 2128322176 POLOOVQANAJOAH-XJKSGUPXSA-N 261.365 2.408 10 10 CECE Nc1ccc(CCC(=O)N[C@@H](CF)C(F)(F)F)cc1 2128681961 ISVBSGYPTIVOEY-JTQLQIEISA-N 278.249 2.218 10 10 CECE NCc1ccc2c(c1)CCN2CC[C@@H]1CCCCO1 2133396557 ZHOCMTKCORIECQ-HNNXBMFYSA-N 260.381 2.467 10 10 CECE NCc1ccc2c(c1)CCN2CC[C@H]1CCCCO1 2133396561 ZHOCMTKCORIECQ-OAHLLOKOSA-N 260.381 2.467 10 10 CECE [N-]=[N+]=NCCNC(=O)C=Cc1ccc2c(c1)CCO2 1912049081 LNADVQOALZANOO-UHFFFAOYSA-N 258.281 2.061 10 10 CECE COC[C@H](C)CC(=O)N1CCC(CN=[N+]=[N-])CC1 1912168680 WAQLXUHMFPRVBU-SNVBAGLBSA-N 254.334 2.208 10 10 CECE C[C@]12CCCC[C@@H]1C[C@@](NCCN=[N+]=[N-])(C(N)=O)C2 1912179102 RLVQKCKSFIDCTN-RTXFEEFZSA-N 265.361 2.101 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)c2cc(Cl)ncn2)CC1 1912191739 VQMXWNJOEWCVIF-UHFFFAOYSA-N 280.719 2.293 10 10 CECE CC(C)C[C@H](C)C(=O)NCc1cccc(O)c1O 1350299790 IZCHPOMSSDHGDK-JTQLQIEISA-N 251.326 2.396 10 10 CECE C[C@@H](O)c1ccc(N2[C@H]3CC[C@H]2[C@@H](F)[C@H](O)C3)cc1 2134140348 ZBKNRTPMBCFLIL-FDHZTJNISA-N 265.328 2.180 10 10 CECE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](F)[C@H](O)C3)cc1Cl 2134132104 CZEGBDNNROZKRU-SCUASFONSA-N 285.746 2.272 10 10 CECE Nc1ccc(OCC(=O)O[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 1913694844 MUKKMVATGFFZFM-COPLHBTASA-N 259.305 2.155 10 10 CECE Oc1ccc([C@H]2N[C@H](C(F)(F)F)CCO2)cc1O 1918587887 AFGYVOAINOSWAT-UWVGGRQHSA-N 263.215 2.037 10 10 CECE COc1ccc(CNC2CC2)cc1CO[C@H]1CCOC1 110526984 OURQPJIMHPHNIW-HNNXBMFYSA-N 277.364 2.253 10 10 CECE CCn1cccc1C(=O)NCc1cc(C)ccc1O 1528627170 IYDWBAHGWBRYSL-UHFFFAOYSA-N 258.321 2.452 10 10 CECE CCNCc1ccc(N2CCN(C)[C@H](C)C2)c(C)c1 110730109 GLLSZFWWHYTRFF-CQSZACIVSA-N 261.413 2.245 10 10 CECE O=[N+]([O-])Cc1cc(Br)cc(F)c1O 1536074245 PTMHBEJVUBLABR-UHFFFAOYSA-N 250.023 2.071 10 10 CECE OCc1cccc(CNCc2cccc(F)c2O)c1 226606624 FMXSLPOPZXQAHA-UHFFFAOYSA-N 261.296 2.313 10 10 CECE C[C@H](NC(=O)CCN1CC[C@H](F)C1)c1ccccc1O 1635804043 NTPJSPISLVSADB-RYUDHWBXSA-N 280.343 2.003 10 10 CECE CCOC(=O)[C@H](CC)[C@@H](N)c1ccc2c(c1)CCN2C 1927418465 KIYBJWQKNLFYQY-HIFRSBDPSA-N 276.380 2.268 10 10 CECE CN(C(=O)c1cc(O)cs1)[C@H](CO)c1ccccc1 1569508466 BEWLBDCKCHDLLH-GFCCVEGCSA-N 277.345 2.259 10 10 CECE CCN(CC(=O)NC)c1ccc2c(c1)CC[C@H](C)N2 122958086 ZVGDSCDFEBADOL-NSHDSACASA-N 261.369 2.006 10 10 CECE Cc1cc(O)ccc1C(=O)NCCc1ccc(N)cc1 232364576 BDDRKFBFQXIQRQ-UHFFFAOYSA-N 270.332 2.255 10 10 CECE CC(C)[C@H](C)[S@](=O)[C@@H](C)C(=O)Nc1ccc(N)cc1 232840924 UASYHPKTXFETSF-ADWYPQAOSA-N 282.409 2.389 10 10 CECE C[C@@H](O)[C@@H]1CCN(c2ccc(CN)cc2Cl)C1 161570944 DZTPKNDJRPWMMN-MWLCHTKSSA-N 254.761 2.006 10 10 CECE Nc1ccc(C[S@@](=O)c2ccc3c(c2)OCCO3)cc1 124111998 NWEQKPIWDJRQDO-FQEVSTJZSA-N 289.356 2.348 10 10 CECE Oc1ccc(CNC[C@H]2CCCCS2)cc1O 158006867 KZDWZASXFNCRDK-LLVKDONJSA-N 253.367 2.473 10 10 CECE CC[C@H](NC1CCS(=O)CC1)c1ccccc1O 158010850 OPSORJFYZSVRQV-HLZQHVJHSA-N 267.394 2.344 10 10 CECE CCC[C@H]1COCCN1c1ccc(CN)c(OC)c1 2139703263 WJNLVAFFMZXJHJ-AWEZNQCLSA-N 264.369 2.159 10 10 CECE Cc1ccc(CNC[C@@]2(O)C[C@H]3CC[C@H]2C3)c(O)c1 2139771971 IQFMCUMAIYUCJH-NOLJZWGESA-N 261.365 2.341 10 10 CECE Oc1cc(F)ccc1CN1CC[C@@H]2NCCC[C@H]2C1 2139766770 BILRUIUGDNYQNU-FZMZJTMJSA-N 264.344 2.105 10 10 CECE CCN1C[C@@H](C(C)C)NC[C@H]1c1ccc(OC)cc1O 250267434 KQOASXSAWIBTMK-GJZGRUSLSA-N 278.396 2.392 10 10 CECE COc1ccc(N(C)C[C@@H](CO)C(C)C)cc1OC 258963481 KPWLDMVEAYQVIC-LBPRGKRZSA-N 267.369 2.405 10 10 CECE COc1ccc([C@H](CN)N2CCCC[C@@H]2C)c(O)c1 32026727 VRLBPAHLDLWTLS-FZMZJTMJSA-N 264.369 2.275 10 10 CECE CNCc1cc(N(C)Cc2ccccc2O)ccn1 2140705713 AHTDSXAXQOPOES-UHFFFAOYSA-N 257.337 2.143 10 10 CECE CCOC[C@@H](C)OCCCC(=O)Nc1ccc(N)cc1 233725329 GGYBFSKJJLESTN-GFCCVEGCSA-N 280.368 2.429 10 10 CECE CS[C@H]1CCC[C@@H]1NC(=O)CCOc1ccc(N)cc1 235097965 YHOGDTRMNNLSJR-KBPBESRZSA-N 294.420 2.438 10 10 CECE CN[C@@H]1[C@H](Sc2nccs2)COCC12CCC2 1945560198 SBWDJPQRCHZYGW-NXEZZACHSA-N 270.423 2.392 10 10 CECE CN(C)CC1(NCc2cc(Cl)ccc2O)CC1 1942732718 VQRVIXAIOKGGLT-UHFFFAOYSA-N 254.761 2.229 10 10 CECE Oc1ccccc1CN(C[C@@H]1CCCO1)[C@@H]1CCOC1 2143373252 DLRPRSVPFIMWPZ-CABCVRRESA-N 277.364 2.162 10 10 CECE Cc1ccc(CNC[C@@H]2C[C@@H](O)C23CCC3)c(O)c1 1875443915 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CCC[C@H]1CN(c2ccc(CN)cc2F)C[C@@H]1CO 2140885136 RQHJZURXJNCSOU-QWHCGFSZSA-N 266.360 2.129 10 10 CECE CO[C@H](C)c1nsc(NCCc2ccc(O)c(O)c2)n1 800857017 CXWBZNHOOYCUEL-MRVPVSSYSA-N 295.364 2.311 10 10 CECE CNCc1ccc(N2CCOC[C@@H]2C)c(Br)c1 234451686 KZCMUMSXFSLDAC-JTQLQIEISA-N 299.212 2.394 10 10 CECE Cc1cncc(CCNCc2ccc(N(C)C)cc2)n1 850390026 ASGQVVLDYNULAK-UHFFFAOYSA-N 270.380 2.183 10 10 CECE C[C@@H](Cn1ccnc1)N[C@@H](C)c1c(O)cccc1O 235152566 HDFJQVXXVIBPJS-QWRGUYRKSA-N 261.325 2.034 10 10 CECE C[C@H](C(=O)O)[C@@H](C)C(=O)N(C)[C@@H](C)c1ccccc1O 235261092 NVCWBNFGEWYPAW-VWYCJHECSA-N 279.336 2.268 10 10 CECE COc1cc(C(=O)N[C@H](C)c2ccccc2O)sn1 1151885856 KQRDXWTWFGIRHL-MRVPVSSYSA-N 278.333 2.348 10 10 CECE C[C@@]12C[C@@H](CO1)N(Cc1ccc(Cl)cc1O)C2 1942498048 UBQQLDFFVZCYAB-AAEUAGOBSA-N 253.729 2.409 10 10 CECE CCN1CCc2cc([C@H](NN)[C@H]3C[C@@H]3CF)ccc21 1875727469 FMCXWZDRJNHXFK-IPYPFGDCSA-N 263.360 2.179 10 10 CECE Nc1ccc(NC(=O)c2cc(N)cn2C2CC2)cc1 1876511970 XNDLAHYBEONZBI-UHFFFAOYSA-N 256.309 2.240 10 10 CECE O=C(C=Cc1ccco1)NCCc1ccc(O)c(O)c1 1879401891 YMFOUAOFYFZNSH-UHFFFAOYSA-N 273.288 2.063 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H]3C[C@H]2CO3)c(F)c1 1880448476 GXPMSRMNPGUFNV-LSJOCFKGSA-N 269.291 2.386 10 10 CECE C[C@H](O)c1cc(F)c(N2CCCC[C@H]2CO)c(F)c1 1880482292 NQEOXWQJJFMFQX-ONGXEEELSA-N 271.307 2.369 10 10 CECE C[C@H](O)[C@H](N[C@@H]1CCc2cccc(O)c21)C(F)(F)F 1882704147 FVVGMNMAYSZBHS-VMAXQDLPSA-N 275.270 2.281 10 10 CECE CCc1conc1C(=O)N[C@@H](C)c1ccccc1O 1883130361 VDFHWZZFFUGKHM-VIFPVBQESA-N 260.293 2.434 10 10 CECE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N1CC(N=[N+]=[N-])C1 1885556611 DBYTXVSHBMTHIY-VIFPVBQESA-N 297.359 2.153 10 10 CECE CCN(CC(=O)N1CC[C@H](N=[N+]=[N-])C1)C(=O)OC(C)(C)C 1885562608 IBJJBCOWIMSAPM-JTQLQIEISA-N 297.359 2.155 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H](C)N(C)C(=O)OC(C)(C)C 1887716618 AORCPQABOZZEGC-JTQLQIEISA-N 299.375 2.401 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3CCC[C@@]32CN)c1 1889532568 UNSRHUMBJTYFNG-GDBMZVCRSA-N 260.381 2.404 10 10 CECE Cc1cc(NC(=O)Cc2ccc(O)c(O)c2)ccc1N 2144027626 XEFITLHSCLCNIR-UHFFFAOYSA-N 272.304 2.170 10 10 CECE Cn1cc(CCNCc2ccc(Cl)cc2O)cn1 1964036240 RMVGVQXIHCMJPZ-UHFFFAOYSA-N 265.744 2.111 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc(CN)c(Cl)c1 1950535014 JCTRUGUPTCOJFN-VHSXEESVSA-N 254.761 2.006 10 10 CECE C[C@@H](CNCc1ccc(F)cc1O)N1CCCCC1 1964554835 JNNHCIUHUWWTSF-LBPRGKRZSA-N 266.360 2.495 10 10 CECE Oc1ccc(CN[C@H]2CCC[C@@]34C[C@@H](CO3)[C@H]24)cc1O 2144354199 CUYAAROXYXMLEV-RKLWJJNISA-N 275.348 2.145 10 10 CECE COc1ccc(O)c([C@H](C)NC2C[C@@H]3COC[C@H]3C2)c1 1965892939 KFVGCZBRJMQORN-QJPTWQEYSA-N 277.364 2.476 10 10 CECE C[C@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCS1 1966808316 VNGNZIRBIQEFIX-CMPLNLGQSA-N 264.394 2.417 10 10 CECE N[C@@H]1CC[C@@H]2CN(Cc3cc(F)ccc3O)C[C@@H]2C1 1969034593 NVGYLPIKDFIFQM-UHIISALHSA-N 264.344 2.091 10 10 CECE O=C1Nc2cc(N3CC[C@H]3C3CCC3)c(F)cc2[C@H]1O 2144899724 VTPKDLXEBWGGOM-GXTWGEPZSA-N 276.311 2.190 10 10 CECE C[C@H]1[C@@H]2CNC[C@H]2CN1[C@H](C)c1cc(F)ccc1O 252651364 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CCN[C@@H](CC1CC1)[C@H](O)c1ccc2c(c1)CCN2C 2147410618 CZOAKEBWCSHXRD-DOTOQJQBSA-N 274.408 2.491 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H](N)Cc3cccs3)ccc21 2147531899 QOTFFXMFIPXVLP-GOEBONIOSA-N 288.416 2.344 10 10 CECE C[C@H](CNCc1c(O)cccc1Cl)N1CCC1 1997056729 IHJSVYOMMZOYCX-SNVBAGLBSA-N 254.761 2.229 10 10 CECE CC1(C)[C@H]2C[C@H](NC(=O)Cc3ccc(O)c(O)c3)C[C@H]21 2149729212 ALLKQHDYYGWUNO-CNDDSTCGSA-N 275.348 2.191 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC(CC(C)C)C3)ccc21 2151457304 TYHFKECCYUQNTF-OAHLLOKOSA-N 273.380 2.382 10 10 CECE Cc1cc(N2C(=O)[C@H]3CC(C)C[C@@H]3C2=O)ccc1N 164080909 XNDCCRYIZPSTSE-RYUDHWBXSA-N 258.321 2.113 10 10 CECE CN[C@@H](CC1OCCO1)c1ccc(N2CCCC2)cc1 1999522086 VHZVEIGOVMSSIQ-HNNXBMFYSA-N 276.380 2.310 10 10 CECE C[C@@H]1CN2CCC[C@@H]2CN1c1ccc2c(c1)COCC2 2152798434 YJADNDFLHGITCV-CXAGYDPISA-N 272.392 2.432 10 10 CECE CC[C@H](O)CN(C)c1cc(Cl)c(CN)cc1F 2008206884 PVYBIHLEFGOGFF-VIFPVBQESA-N 260.740 2.145 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CCC(=O)N[C@H]2C)c1 282196794 GPWAAHUYEQOKRO-GVXVVHGQSA-N 262.353 2.018 10 10 CECE C[C@@H](NC[C@H]1CCCN(C)C1)c1cc(O)ccc1O 44534901 PGWPTMDHJCQNDH-VXGBXAGGSA-N 264.369 2.090 10 10 CECE C[C@@](O)(CN(c1ccc(CN)cc1)C1CC1)C(F)(F)F 2155592820 HXQXSFCPBZJBRP-CYBMUJFWSA-N 288.313 2.427 10 10 CECE CNCc1ccc(N2CCN(CC3CC3)CC2)c(F)c1 48995536 LOUOSVDLOJDCRF-UHFFFAOYSA-N 277.387 2.077 10 10 CECE C[C@@H](c1cncn1C)N(C)CCOc1ccc(N)cc1 2155703658 GRSYLJIWDLXOSF-LBPRGKRZSA-N 274.368 2.074 10 10 CECE NCc1ccc(N2C[C@@H]3COCC[C@H]32)c(Cl)c1 2017877798 NANKICWHEBESGP-ZYHUDNBSSA-N 252.745 2.024 10 10 CECE CCN(CC)CCOc1ccc(CNC)cc1C 2027042132 LLHZQEAUJMJTMD-UHFFFAOYSA-N 250.386 2.435 10 10 CECE CCc1cccc(CN[C@H](CC)CN(C)C)c1O 2029866051 GKWNYDLXGRFLKO-CQSZACIVSA-N 250.386 2.384 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@H](CCO)C2)cc1O 300313142 KRKASETWVJAOLY-QWHCGFSZSA-N 278.396 2.271 10 10 CECE COc1ccc(N(C)C[C@@H](N)c2cscn2)cc1 2038280070 SACQJKHLFCYUHA-GFCCVEGCSA-N 263.366 2.288 10 10 CECE CNCc1ccc(N2CCC(F)(F)[C@@H](CO)C2)cc1C 404004661 MSEVJCNYCFUCGO-CYBMUJFWSA-N 284.350 2.168 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@@H]1CO[C@@H]2COC[C@@H]21 2157984143 LKQGVOADYSYOPR-IXPVHAAZSA-N 297.782 2.139 10 10 CECE CCN=c1[nH]nc(C2=S=Nc3ccccc32)c(C)c1C 2159958991 RRZIXSOLUNJTPE-UHFFFAOYSA-N 284.388 2.427 10 10 CECE COCCO[C@@H]1CCN([C@@H]2CCc3cccc(O)c32)C1 2158831643 ZELIAHJLCIWSMO-ZIAGYGMSSA-N 277.364 2.117 10 10 CECE Cc1[nH]ncc1C(=O)N(Cc1ccc(N)cc1)C(C)C 80039277 ZTSCRZCQSGWEIK-UHFFFAOYSA-N 272.352 2.351 10 10 CECE C[C@@]1([C@@H](NCCCN=[N+]=[N-])C(=O)O)CCCS1 327522649 SUSKTWZIGVFGQU-WPRPVWTQSA-N 258.347 2.015 10 10 CECE CC[C@H]1CCN(Cc2c(O)cccc2OC)[C@H](CN)C1 2160721654 BTVYQTQTGAUPBI-STQMWFEESA-N 278.396 2.350 10 10 CECE COc1ccc(N(C)[C@]2(CN)CC[C@]23CCCO3)cc1 2160707706 HFPDYEABADKHIN-JKSUJKDBSA-N 276.380 2.172 10 10 CECE Cc1cccc(O)c1CN(C)[C@@H]1CCCS(=O)(=O)CC1 2160770679 QFKDJTBDGYRDFR-CYBMUJFWSA-N 297.420 2.100 10 10 CECE COc1cccc(CN[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c1O 527803579 HAYLNOGZHKUYEA-RMIALFOJSA-N 265.353 2.302 10 10 CECE CCC(CC)CNC(=O)[C@@H](N)c1cccc(F)c1O 83510006 KMIMNSHDBMDCDO-LBPRGKRZSA-N 268.332 2.084 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1CN(C)C(=O)CCOc1ccc(N)cc1 2161532005 HUNMVLVONFOQFG-JYAVWHMHSA-N 276.380 2.398 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1C[C@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2161719201 FHUPINMMYKPFOP-KIBDGTGWSA-N 274.408 2.332 10 10 CECE CCOc1ccccc1[C@H](NCCN=[N+]=[N-])C(=O)OC 90257024 RTBHYCHQNCVIKY-LBPRGKRZSA-N 278.312 2.199 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])c1nc(C)cs1 702018873 MZXBTJFVGYQSJR-LLVKDONJSA-N 283.357 2.130 10 10 CECE CN1C[C@@H]2CN(CCCc3ccc(N)cc3)C[C@]2(C)C1 702346024 GLZKUUBYVMMUTC-WBVHZDCISA-N 273.424 2.085 10 10 CECE CC(C)N(CCN(C)C)Cc1ccc(F)c(F)c1O 703528733 GLGUQFKDKUEOQA-UHFFFAOYSA-N 272.339 2.442 10 10 CECE NCc1ccc(N2CCO[C@@H](CF)C2)c2ccccc12 2172050495 LTYNWECQPFFPQR-ZDUSSCGKSA-N 274.339 2.473 10 10 CECE CCCNCc1ccc(N(C)[C@H]2COC[C@H]2OC)cc1 2177269765 DYFUYXRMBWQDPR-JKSUJKDBSA-N 278.396 2.036 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](CN(C)C)C2)cc1 708453320 XPFXFIYKDVJZRI-ZIAGYGMSSA-N 261.413 2.355 10 10 CECE Nc1ccc(O)c(CNc2cc(C3CC3)ncn2)c1 710153714 FZROJJVIUSHJSF-UHFFFAOYSA-N 256.309 2.254 10 10 CECE CCCN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@H]4C3)ccc21 379536880 JAKGEJDTEBEBCY-PGUXBMHVSA-N 271.364 2.136 10 10 CECE C[C@@H]1CCN(c2cc3c(cc2N)NC(=O)CC3)CCS1 379524447 KSYBNJYNBZBJHD-SNVBAGLBSA-N 291.420 2.485 10 10 CECE CN1CCCc2cc([C@]3(O)C[C@H]4OCCC[C@@H]43)ccc21 2163107548 OWLAULOXKJIQJH-USXIJHARSA-N 273.376 2.456 10 10 CECE [N-]=[N+]=NCCN[C@H](C(N)=O)C1CCC(C(F)(F)F)CC1 713031307 WGNDWPIVFOBQRL-HACHORDNSA-N 293.293 2.109 10 10 CECE C[C@@H]1SCC[C@@H]1NC(=O)CCOc1ccc(N)cc1 389238442 BBEYWIXILKFAQM-GWCFXTLKSA-N 280.393 2.048 10 10 CECE CCn1ccnc1NC(=O)CCc1ccc(N)cc1 382407025 NLRQSERFLCPCLE-UHFFFAOYSA-N 258.325 2.057 10 10 CECE CCCOCCNCc1cccc(OCC)c1O 715000160 JZZDJKNBPWICKO-UHFFFAOYSA-N 253.342 2.307 10 10 CECE CCN(C[C@H](C)OC)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 383326731 MAWVFFSVQYAYGI-SDBXPKJASA-N 297.786 2.153 10 10 CECE Cc1nn(C)cc1CN(C)c1ccc([C@@H](C)N)c(O)c1 716402964 KPAMQCYTFSXIOJ-SNVBAGLBSA-N 274.368 2.090 10 10 CECE C[C@@H](N)c1ccc(N2CCC(C(C)(C)O)CC2)cc1O 716417027 XQJKLBIADUZYGN-LLVKDONJSA-N 278.396 2.399 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H]2[C@H](N3CCCC3)[C@H]2C1 384519270 HNTWTIZVJNYGPF-MKVSYHDVSA-N 272.392 2.479 10 10 CECE CC(C)NCc1ccc(N2CC(=O)N[C@H](C)C2)cc1Cl 386851962 AWWOVRUVJBDWND-LLVKDONJSA-N 295.814 2.163 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@@H]3CNC[C@]3(C)C2)cc1 2172948039 MIEOSQRPOKLJAS-INMHGKMJSA-N 273.424 2.230 10 10 CECE Cc1nc(CN(C)C(=O)c2ccc(O)c(O)c2)sc1C 697527379 FAGZUYASDCEFCN-UHFFFAOYSA-N 292.360 2.443 10 10 CECE CC[C@@H](NCCc1cc(O)n[nH]1)c1ccccc1O 391387392 VNBZIKBJJOJBCT-GFCCVEGCSA-N 261.325 2.104 10 10 CECE C[C@H](NCc1ccc(O)c(O)c1O)[C@H]1CC1(C)C 397699038 PEOKVHSICUNRLS-WCBMZHEXSA-N 251.326 2.328 10 10 CECE CCNCc1ccc(N2CC[C@@H](OCCO)C2)cc1Cl 2165422134 VWRRSMKJLNZWBL-CQSZACIVSA-N 298.814 2.037 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(C)CC(C)(C)F)ccc21 2165891873 DVPLZZQIPBTNDP-CYBMUJFWSA-N 279.359 2.474 10 10 CECE NC(=O)[C@@H]1CCCC[C@H]1N[C@H]1CCc2cccc(O)c21 2174116951 RSFRTCOYDLHUFI-UPJWGTAASA-N 274.364 2.013 10 10 CECE C[C@H]1C[C@H]1N(CCO)c1ccc(CO)c(C(F)(F)F)c1 2167109062 KDROHACOMGUMKN-TVQRCGJNSA-N 289.297 2.405 10 10 CECE CC(C)NC(=O)C1CN(c2ccc([C@H](C)O)cc2Cl)C1 2168051201 JRLLMMKGBRBZPV-JTQLQIEISA-N 296.798 2.354 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H](F)CC3CNC3)ccc21 2178560127 ZBUZEHRKHRXJQZ-HOCLYGCPSA-N 278.371 2.050 10 10 CECE CCOc1ccc(N2CCN[C@H]3CC[C@@H]32)cc1OCC 2168391560 DFPBPXPEMFSMDV-KBPBESRZSA-N 276.380 2.425 10 10 CECE CCOC(=O)c1cn(Cc2cccc(F)c2O)nc1C 2070247168 SWGAEFIOWIZYGV-UHFFFAOYSA-N 278.283 2.261 10 10 CECE CN(c1cc2c(cc1F)[C@H](O)C(=O)N2)[C@@H]1CCC[C@@H]1F 2175583052 ZYQVFAAKWCDUDV-KDDOJWQBSA-N 282.290 2.138 10 10 CECE CCc1ncncc1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2178806965 WNGPARXICOETFX-JTQLQIEISA-N 274.328 2.202 10 10 CECE NCc1ccc(N2CC[C@@H]3OCCC[C@@H]3C2)c(F)c1F 2170256062 HHHNCPSXXWUUPN-YPMHNXCESA-N 282.334 2.429 10 10 CECE C[C@H](NCc1ccn2cnnc2c1)c1ccccc1O 2188170833 SHWCKROVUVTZSX-NSHDSACASA-N 268.320 2.286 10 10 CECE CC[C@@H](c1ccccc1O)N(C)[C@H]1CCN(C)C(=O)C1 2188465319 ZVTLBAYCIRQQKG-JSGCOSHPSA-N 276.380 2.396 10 10 CECE Cc1cc(CN(C)c2ccc(CO)c([N+](=O)[O-])c2)sn1 2188572160 NQZUGBQKLOEUBI-UHFFFAOYSA-N 293.348 2.488 10 10 CECE C[C@H](N[C@@H]1CCN(C)[C@@H](C)[C@@H]1C)c1ccc(O)cc1O 2193643882 RDPAOMJDJXAWHL-JUFZMCDQSA-N 278.396 2.477 10 10 CECE Cc1cc(N(CC2CC2)C2COC2)ccc1C[C@@H](C)N 2193736957 XCVBHLRPBJFQIG-CYBMUJFWSA-N 274.408 2.500 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[Si](C)(C)CC3)ccc21 2184642710 DKMOZWPJFYXCEM-CQSZACIVSA-N 289.455 2.428 10 10 CECE CCn1cncc1CN(C)c1ccc2c(c1)CC[C@@H]2N 2184741164 FVXZPVSFFMXHQL-INIZCTEOSA-N 270.380 2.485 10 10 CECE COC[C@@]12C[C@@H]1CN(c1ccc3c(c1)CCC[C@H]3N)C2 2184757358 MWSFTLCTHWPTJC-XYPHTWIQSA-N 272.392 2.495 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN([C@H]2CCC(F)(F)[C@H]2O)CC1 2042029793 HXHBSISOPIWVET-UTLUCORTSA-N 260.288 2.310 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H]3CC[C@@H](N3)[C@@H]2F)cc1 2190647923 YATZZDNEBHLSCF-MIGQKNRLSA-N 277.387 2.073 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@H](CO)[C@@H](C)C2)c(F)c1 2194527546 YHJCFDOAPRCPGS-HBNTYKKESA-N 285.334 2.473 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3C[C@H](O)C[C@H]3C2)c(F)c1 2194515176 YUEUTWZKASPQJC-OHBODLIOSA-N 283.318 2.225 10 10 CECE Cc1nnc(CN(C)c2ccc(CN)c(Cl)c2)o1 2051781359 FKCRNDRGMQZBMV-UHFFFAOYSA-N 266.732 2.127 10 10 CECE C[C@H](N)c1cc(F)c(N(C)C[C@H]2CCN(C)C2)c(F)c1 2194700219 PSRHSMVREONJSG-QWRGUYRKSA-N 283.366 2.372 10 10 CECE C[C@H](N)c1cc(F)c(N2CCN(C)C[C@@H](C)C2)c(F)c1 2194701583 FOEKKYRZHSZWFT-MNOVXSKESA-N 283.366 2.372 10 10 CECE CC1(C)C[C@@H](OCCOc2ccc(N)cc2)CO1 2052240747 IPAIWZCDZZDPPK-CYBMUJFWSA-N 251.326 2.232 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC3(CCCN3C)C2)c(F)c1 2194709634 NLKWWRLQXJFWFT-SNVBAGLBSA-N 281.350 2.269 10 10 CECE COc1ccc(N(C)C2(CN)CC(CF)C2)cc1 2054570577 JCHOOSORIIWEKE-UHFFFAOYSA-N 252.333 2.208 10 10 CECE CCON(C1CNC1)[C@H](CC)c1ccccc1O 2054535547 INXBQQWPHYBOCV-CYBMUJFWSA-N 250.342 2.069 10 10 CECE CN(CCCN=[N+]=[N-])Cc1cnn(C(F)(F)F)c1 2054708550 YGSSCZSFIQBFFW-UHFFFAOYSA-N 262.239 2.492 10 10 CECE O=S(=O)(Nc1ccc(O)cc1F)[C@H]1CCC[C@H]1F 2055308813 NTXVCRSFLKXEMG-KCJUWKMLSA-N 277.292 2.164 10 10 CECE COc1cccc(O)c1CN(CCN)C1CCCCC1 2186647772 LSYXRIHFCKQRQT-UHFFFAOYSA-N 278.396 2.494 10 10 CECE NCc1cc(F)c(N2C[C@H](F)C[C@@H](F)C2)c(F)c1 2062397285 SXBMOUSZISOYTD-RKDXNWHRSA-N 262.250 2.310 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H]4CC[C@@]4(CO)C3)ccc21 2198878446 ORMUPEAZKJSBIE-COXVUDFISA-N 272.392 2.231 10 10 CECE C[C@H](COC(F)F)NCc1ccc(N(C)C)cc1 2067262741 JHUWLXDNYNLHMA-SNVBAGLBSA-N 258.312 2.470 10 10 CECE COC(=O)NC[C@H]1CCN1c1ccc([C@H](C)O)cc1Cl 2187289337 QLINIBCOIOILFM-GXSJLCMTSA-N 298.770 2.328 10 10 CECE CO[C@H]1C[C@@H]1CN(C)Cc1ccc(F)c(F)c1O 2067875366 XFYJFIRBQHANBI-KOLCDFICSA-N 257.280 2.137 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@H]1C1CC1 2071805312 LUENRZIYSSGVEO-JQWIXIFHSA-N 252.318 2.008 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)[C@H](C)CCO)c(F)c1 2074084883 XMPCAAJKQXLVLI-RKDXNWHRSA-N 259.296 2.225 10 10 CECE C[C@@H]1OCC[C@H]1CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2075527800 BBAZFDFOFLPCFO-GARJFASQSA-N 252.318 2.103 10 10 CECE C[C@H]1CCO[C@H]1CC(=O)N1CCC(CN=[N+]=[N-])CC1 2101083081 FQMXXBXHGJABMI-JQWIXIFHSA-N 266.345 2.350 10 10 CECE C[C@@H](N)c1ccc(N(C)CC[C@H]2CCCO2)cc1O 2101045452 RBWZVSDETUJLFN-DGCLKSJQSA-N 264.369 2.417 10 10 CECE CCCN(c1ccc(N)cc1)[C@@H]1CCCN(C)C1=O 2101131791 QVEPYVJOPHGQHK-CQSZACIVSA-N 261.369 2.106 10 10 CECE Cc1nsc(CN2CCc3cc([C@@H](C)N)ccc32)n1 2102682797 GHFFYPIIYFHXIW-SECBINFHSA-N 274.393 2.429 10 10 CECE Cc1cc(CO)ccc1N1CC(F)(F)C[C@@]1(C)CO 2102790120 MTZLDFWLGNYSKN-ZDUSSCGKSA-N 271.307 2.084 10 10 CECE CCCc1ocnc1CNCc1ccc(O)c(O)c1 2104107938 JMUNMIBRBHRGGO-UHFFFAOYSA-N 262.309 2.328 10 10 CECE COc1cc(N2CC3(C2)CC3(F)F)ccc1CO 2084012604 SFFIDJZCOJZQGO-UHFFFAOYSA-N 255.264 2.033 10 10 CECE Cc1cccc(CN=c2nc(C3CC3)[nH]s2)c1O 2084055838 ARABTGXMLGMLIW-UHFFFAOYSA-N 261.350 2.464 10 10 CECE CNCC[C@@H]1CCCCN1Cc1c(O)cccc1F 2104510440 HPWVLNTVVQRJAN-LBPRGKRZSA-N 266.360 2.495 10 10 CECE Cc1cc(N2C[C@@H](N(C)C)CC2(C)C)ccc1CN 2105446183 BCYDAWDVCNVIDI-HNNXBMFYSA-N 261.413 2.373 10 10 CECE c1cc2c(cc1N1CCCCC13CNC3)CCCO2 2106379642 IQRBNUKMMLEGGT-UHFFFAOYSA-N 258.365 2.344 10 10 CECE C[C@@H]1C[C@H]([C@H](N)c2ccc3c(c2)CCN3C)CCO1 2106798426 KWQQJEBNQWSGLA-DJSGYFEHSA-N 260.381 2.494 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)c1nccs1 2106851425 TVFUCLNGFAUGON-OLZOCXBDSA-N 277.393 2.203 10 10 CECE CN(C)c1ccc([C@@H](NN)c2cncc(Cl)c2)cc1 2106823590 QIHVACOATHYIJC-CQSZACIVSA-N 276.771 2.354 10 10 CECE CC[C@H](O)CN(c1ccc(CNC)c(C)c1)C1CC1 2107422093 HDGKZAPNJUKZMN-INIZCTEOSA-N 262.397 2.454 10 10 CECE C[C@@H](CS(=O)(=O)N(C)Cc1ccc(N)cc1)C1CC1 2087899063 ZJEPMGJWNQLTRP-NSHDSACASA-N 282.409 2.077 10 10 CECE CO[C@H]1C[C@@H](OC)CN(c2ccc(CN)c(Cl)c2)C1 2109199274 HDEJIYTWHTXRRX-BETUJISGSA-N 284.787 2.039 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1CC[C@H]2C[C@H]21 2109226874 AYFCYCLEKKOMPB-NWANDNLSSA-N 258.365 2.458 10 10 CECE C[C@H](N[C@H]1CC[C@@H](S(C)(=O)=O)C1)c1ccccc1O 2089148999 KKQIJXDFXWGJQQ-SDDRHHMPSA-N 283.393 2.009 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@H]3C[C@]3(CO)C2)cc1 2090118608 IMLHUVFDYDQIEM-VNQPRFMTSA-N 260.381 2.176 10 10 CECE CC[C@H]1[C@H](CO)CCN1CCCc1ccc(N)cc1 2090609958 MLNZWTYHYPKBLK-HOCLYGCPSA-N 262.397 2.294 10 10 CECE CN(CCCc1ccc(N)cc1)C[C@@H]1CCC[C@H]1O 2090613291 RCYQPYYGGBOYRM-GOEBONIOSA-N 262.397 2.294 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1 2090736267 FVIULJNUKGEFEU-FXUDXRNXSA-N 260.381 2.032 10 10 CECE C[C@H](NCCc1ccc(O)c(O)c1)[C@H]1CCCOC1 2112057276 HLRQJCVCELKURF-AAEUAGOBSA-N 265.353 2.045 10 10 CECE CC(C)N(C)CCN1CCc2cc(N(C)C)ccc21 2092386696 NSBAUEFJINYYLO-UHFFFAOYSA-N 261.413 2.455 10 10 CECE C[C@H]1COCC[C@H]1N(C)c1c(F)cc(CO)cc1F 2092818028 TYIMOZAIBODUOT-TVQRCGJNSA-N 271.307 2.318 10 10 CECE CCNCc1ccc(N2C[C@H](C)[C@H](O)C[C@H]2C)cc1 2093115714 STFRRIPPGFAZDA-WOSRLPQWSA-N 262.397 2.392 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2cncn2C)cc1 2093346295 NXNYTIVLOZGZFB-LBPRGKRZSA-N 258.369 2.337 10 10 CECE CO[C@@H](c1noc(-c2sccc2O)n1)[C@@H]1CCOC1 2093890590 JHWAYOQLETVQQQ-VXNVDRBHSA-N 282.321 2.228 10 10 CECE CC(C)(NC(=O)Nc1ccc(N)cc1)[C@H]1CCCO1 2094157882 FWIGYSKWQACEHN-GFCCVEGCSA-N 263.341 2.348 10 10 CECE COCCNCc1ccc(N2CC3CC2C3)c(C)c1 2095414450 BSCXYNYXWPIVAH-UHFFFAOYSA-N 260.381 2.330 10 10 CECE CC[C@@H]1CCN(c2ccc3c(c2)COCC3)CCN1 2096492278 WKHWFPKMZGEMNC-OAHLLOKOSA-N 260.381 2.338 10 10 CECE CCn1cncc1CN(C)c1ccc(CO)c(C)c1 2096696428 NUEFWGLZRQHLHA-UHFFFAOYSA-N 259.353 2.340 10 10 CECE COc1cccc(CN2CCC[C@H](OC)[C@H]2C)c1O 2099127473 BDHZQAGBBRSMKW-YPMHNXCESA-N 265.353 2.400 10 10 CECE CC[C@](O)(CN(C)c1ccc(CN)cc1)C(F)(F)F 2099363548 PZGBDKYSIDLOPJ-LBPRGKRZSA-N 276.302 2.285 10 10 CECE CN(c1ccc(CO)cc1F)[C@H]1C[C@@H]2COC[C@@H]2C1 2099934075 OLTFUFXPBBLKLA-ITGUQSILSA-N 265.328 2.179 10 10 CECE CO[C@@H]1CCN(c2ccc([C@H](C)N)cc2)C[C@@]1(C)OC 2201499848 JTMWKUOXTNKVCB-APHBMKBZSA-N 278.396 2.337 10 10 CECE CC[C@@H](C)N1CC(N[C@@H](C)c2ccc(O)cc2O)C1 2113006151 PRSWYGXPBRIPLD-MNOVXSKESA-N 264.369 2.231 10 10 CECE C[C@H](N)c1csc(NC(=O)CCc2ccc(N)cc2)n1 2203126838 UIMLJSRABMJYLD-VIFPVBQESA-N 290.392 2.316 10 10 CECE C[C@H](c1ccc(Cl)cc1O)N1CCOC[C@H]1CN(C)C 2203346878 MVMFIWQALXWIEZ-DGCLKSJQSA-N 298.814 2.369 10 10 CECE COc1cc(N2CC(COC(F)(F)F)C2)ccc1CO 2204550109 MIDYFUUJEXRZMV-UHFFFAOYSA-N 291.269 2.160 10 10 CECE CCNCc1ccc(N2CC[C@@H](CCO)C2)cc1OC 2204548129 JEIHNRBPHMVSCU-ZDUSSCGKSA-N 278.396 2.013 10 10 CECE CCC[C@@]1(O)CCCN(c2ccc(CN)c(OC)c2)C1 2204547203 DZBKOTQIDSPELY-MRXNPFEDSA-N 278.396 2.285 10 10 CECE CCNCc1ccc(N2CCOC(F)(F)C2)cc1OC 2204541194 JEABQPRSSALBIM-UHFFFAOYSA-N 286.322 2.234 10 10 CECE O=C(O)[C@]12CCC[C@@H]1N(Cc1ccc(F)cc1O)CC2 2204631548 ARSFDHDNKWSIFP-ZFWWWQNUSA-N 279.311 2.361 10 10 CECE Cc1cccc(CN=c2ccc(C(C)(C)O)c[nH]2)c1O 2204621298 HRUCYTXMVPXNHI-UHFFFAOYSA-N 272.348 2.357 10 10 CECE Cc1cccc(CN=c2[nH]nc([C@H]3CCOC3)s2)c1O 2204773584 TYGHRGHGEWLBEF-NSHDSACASA-N 291.376 2.090 10 10 CECE OCc1cc(F)c(N2[C@H](CO)CCC23CCC3)c(F)c1 2205759523 MSEOVVFSNAMEFR-NSHDSACASA-N 283.318 2.341 10 10 CECE COc1ccc(N2CCN[C@H](C)[C@@H]2C)c2c1CCC2 2269168439 NTWHZPAKHNTBMD-NEPJUHHUSA-N 260.381 2.371 10 10 CECE O=C(NCc1ccccc1O)C1C[C@H]2COC[C@H](C1)C2 2206756864 YUCMWZJKOOKWBV-RYUDHWBXSA-N 275.348 2.071 10 10 CECE CN[C@H](C)c1ccc(N2CC(OCCCO)C2)c(Cl)c1 2206952682 DJACIOYLTSUPFS-LLVKDONJSA-N 298.814 2.208 10 10 CECE CCN[C@@H](C)c1ccc(N2CC([C@H](C)O)C2)cc1C 2269667572 YHSYHJUFZROUSO-STQMWFEESA-N 262.397 2.483 10 10 CECE NCc1ccc(N2CC(CCCO)C2)cc1Cl 2216741276 UISGDFVBFKKSAO-UHFFFAOYSA-N 254.761 2.007 10 10 CECE CCOc1ccc(N2C[C@H](O)[C@@H]2C)cc1OCC 2219383115 ONDDTNHRWSGSOZ-JQWIXIFHSA-N 251.326 2.053 10 10 CECE COc1cc(C)c(N2CCS[C@@H](CO)C2)cc1C 2219592942 ONNKWRBBYRBKAI-GFCCVEGCSA-N 267.394 2.226 10 10 CECE Cc1ccc(CN2CCC=C[C@@]2(C)C(=O)O)c(O)c1 2230942579 APFUWYXMFFOTJK-HNNXBMFYSA-N 261.321 2.306 10 10 CECE Cc1noc(CN(C)c2ccc([C@@H](C)N)cc2C)n1 2232028583 PHVJZAMZJAFNGB-SNVBAGLBSA-N 260.341 2.343 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC2(C1)CC(C)(O)C2 2232029451 VKPYBBXTDXLXOA-GFCCVEGCSA-N 260.381 2.366 10 10 CECE C[C@@H]1C[C@H](C(=O)O)[C@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2234171957 QALYLTLCDYFPGS-MMWGEVLESA-N 280.328 2.035 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1cn2c(n1)CCCC2 2234173657 YSMCOZULZYPBDU-ZJUUUORDSA-N 274.328 2.181 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)C1 2234170753 GMPNSYWAFBSOFX-HBNTYKKESA-N 280.328 2.036 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)C[C@H]1CN2CCC1CC2 2234171209 KEMWQCGTTOCIEC-RWMBFGLXSA-N 277.372 2.066 10 10 CECE CCN(c1ccc(CNC)c(C)c1)[C@H]1CCC[C@H]1O 2224401260 BTDGICNUIHNYNR-JKSUJKDBSA-N 262.397 2.454 10 10 CECE COc1ncc(Cl)cc1[C@@H](NN)c1ccccc1O 2224749553 KMDXEYHTFTYVTC-LBPRGKRZSA-N 279.727 2.002 10 10 CECE CCN1CCc2cc(N3CC[C@H](C4(O)CC4)C3)ccc21 2235036605 CNSABOHSPJQKHR-AWEZNQCLSA-N 272.392 2.420 10 10 CECE COc1cc(C)c(N2C[C@@H](CO)OCC2(C)C)cc1C 2235102046 UKFYGQKPGXVJAF-ZDUSSCGKSA-N 279.380 2.288 10 10 CECE CC(C)n1nccc1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2225792251 LKHCUCCJPBUOHN-ZJUUUORDSA-N 262.317 2.425 10 10 CECE CNCc1ccc(N2C[C@H](C)C[C@@H](O)[C@@H]2C)cc1OC 2235874843 BHYDSCHMNUIJIZ-TYNCELHUSA-N 278.396 2.010 10 10 CECE CC[C@H]1CCOCCN1c1ccc(OC)cc1CNC 2235964175 ROFAGRSUBOQFQH-AWEZNQCLSA-N 278.396 2.420 10 10 CECE COc1ccc(N(C)[C@@H]2[C@@H]3C[C@H]3[C@H]3C[C@H]32)c(C(=O)O)c1 2235958254 RYXPMOXOMHZUJA-IXRFVVGDSA-N 273.332 2.484 10 10 CECE COc1ccc(N(C)[C@@H]2[C@H]3[C@@H]4C[C@@H]5[C@H]([C@H]34)[C@@H]52)c(CO)c1 2235969084 ZOOZJRKXQYDGQM-CHNABZMASA-N 271.360 2.134 10 10 CECE COc1ccc(N2C[C@H]3CC[C@]3(C)C2)c(CCN)c1 2227685902 MIOWHDYIMNKAMX-CZUORRHYSA-N 260.381 2.433 10 10 CECE COC[C@@]1(C)CCCN1c1ccc(OC)cc1CO 2227679805 OEZIFNCRNIRLQC-OAHLLOKOSA-N 265.353 2.193 10 10 CECE COc1ccc(N2CC[C@@H](OC)C[C@H]2C)c(CO)c1 2227708469 IPUTUARCAQQXJH-BXUZGUMPSA-N 265.353 2.191 10 10 CECE COc1ccc(N(C)[C@@H]2CCOC[C@H]2F)c(C=O)c1 2227702703 NIWIKSNJQQSHLS-TZMCWYRMSA-N 267.300 2.071 10 10 CECE C[C@H]1CN(C)[C@H](C)CN1c1ccc2c(c1)CC[C@@H]2O 2229729407 VGGXDKPHLAORLW-WQGACYEGSA-N 260.381 2.195 10 10 CECE COC[C@@H]1CCOCCN1c1ccc([C@H](C)N)cc1C 2240750648 AAPUYFGJKGFNFH-ZFWWWQNUSA-N 278.396 2.256 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCO[C@]2(CCOC2)C1 2240839305 DMMZDTQIZSBIOS-XJKSGUPXSA-N 276.380 2.010 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1c(C)cc(O)cc1C 2283025984 WGTHIKVFTBWNCG-LBPRGKRZSA-N 278.312 2.123 10 10 CECE CN(C)CCCCCNCc1cc(F)ccc1O 2260318503 XUFOLFDHUHTHNE-UHFFFAOYSA-N 254.349 2.353 10 10 CECE COC[C@@]1(C)C[C@@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2269196047 VGJQIGGGFAHLTM-DGCLKSJQSA-N 266.345 2.208 10 10 CECE Nc1ccc(OCCCn2cccc(F)c2=O)cc1 2269591985 IOKZXGFCTKQZMM-UHFFFAOYSA-N 262.284 2.039 10 10 CECE Cc1cc(N(C)CC(=O)NCC(C)C)ccc1[C@H](C)N 2285141320 UEHJFYSVYACPJK-ZDUSSCGKSA-N 277.412 2.223 10 10 CECE CC[C@@H](Nc1c(N)cccc1C(=O)O)[C@H](C)CN(C)C 2288711741 XUPXQMWTKNHSIV-ZWNOBZJWSA-N 279.384 2.355 10 10 CECE Cc1ccc(CO)cc1NC(=O)Cc1ccc(N)cc1 1218812714 XGTYIAZIKSDGGP-UHFFFAOYSA-N 270.332 2.251 10 10 CECE COCCC1(CNC(=O)C=Cc2ccc(O)c(O)c2)CC1 2308001969 IKAPJTNGJQCQMB-UHFFFAOYSA-N 291.347 2.044 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1ncc(C(F)F)s1 2320451975 LSAZVJCTJFBICM-YFKPBYRVSA-N 277.256 2.106 10 10 CECE N[C@H]1C[C@H]2CC[C@H]1C[C@@]2(Sc1nccs1)C(=O)O 2327016168 WBBCAHLXVUBZOW-NHRVJRKFSA-N 284.406 2.206 10 10 CECE N[C@@]1(c2ccc(N3CCCC3)cc2)C[C@@H]2COC[C@@H]21 2329486702 JLUJFKSKUXJCQD-UHOFOFEASA-N 258.365 2.107 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2C[C@@H]3CCC[C@@H]3N2)cc1 2329617517 WFNIMYOETCQNFY-HNKHHVNMSA-N 260.381 2.317 10 10 CECE Cc1cc(CN)ccc1N(C)C[C@@H]1C[C@@H]2CC[C@H]1O2 2329974801 UADZZJJLRAFCAX-OFQRWUPVSA-N 260.381 2.457 10 10 CECE Cc1cccc(CN[C@@H]2C[C@@H]3[C@H]4CC[C@H](O4)[C@H]32)c1O 2331831792 HJLPJNKXYIAJRL-ARILJUKYSA-N 259.349 2.356 10 10 CECE CC12CC(C1)[C@H](CNCCc1ccc(N)cc1)CO2 2337647025 XFSFDFGUDYIYQU-NPCAHTBFSA-N 260.381 2.216 10 10 CECE FC(F)(F)Cn1ccnc1C=C1CCNCC1(F)F 2338786420 FTYZCBXUTCRIBQ-UHFFFAOYSA-N 281.228 2.457 10 10 CECE CC1(C)[C@H](O)CCN1c1ccc(CN)c(C2CC2)c1 2339145247 HPMGWIIMTIAWPZ-OAHLLOKOSA-N 260.381 2.372 10 10 CECE CN(CC1CC(O)C1)c1ccc(CO)c(C2CC2)c1 2339146411 QKSNIOIPVSZNTN-UHFFFAOYSA-N 261.365 2.263 10 10 CECE CC(C)[C@@H](O)C(C)(C)C(=O)N1CCC(N=[N+]=[N-])CC1 2340240675 DPLVIIKFVWKMPD-LLVKDONJSA-N 268.361 2.331 10 10 CECE C[C@]1(CN)CN(Cc2c(O)cccc2Cl)CC1(F)F 2351602939 UZPIZBNHFNOPKL-LBPRGKRZSA-N 290.741 2.462 10 10 CECE CSc1cc(N2CC[C@H](N(C)C)[C@H]2C)ccc1CN 2353858091 FKZUPQSDMWNSCM-RISCZKNCSA-N 279.453 2.396 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3[C@@H]4CC[C@H]3NC4)ccc21 2354643338 AIHRSYXJHDOFRA-MUIFIZLQSA-N 272.392 2.100 10 10 CECE Nc1ccc(CCCN2CC[C@@H]3CC[C@@H](O)[C@H]2C3)cc1 2355744486 IYWBFGVZVVHITE-USXIJHARSA-N 274.408 2.437 10 10 CECE COc1ccc(Br)c(C(=O)C(C)=O)c1 1951322553 LVFIOVDYDMRBLP-UHFFFAOYSA-N 257.083 2.229 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])C[C@H]2[C@H]3CC[C@H](C3)[C@@H]21 2357248981 AMTVGEWQULFHAD-ZUDIRPEPSA-N 278.356 2.254 10 10 CECE C[C@@H]1CCN(Cc2c(O)cccc2Cl)C[C@@H]1N 128330286 ZVXJCMNBDTYSGZ-SKDRFNHKSA-N 254.761 2.215 10 10 CECE C[C@H](N)c1ccc(N2CC[C@](C)(O)C2)cc1Cl 300035141 XHZWFYRYACFASC-ZANVPECISA-N 254.761 2.321 10 10 CECE CCOC(=O)C1CCN(C(=O)Nc2ccc(N)cc2)CC1 217313550 OARKIWOUUUODOJ-UHFFFAOYSA-N 291.351 2.076 10 10 CECE COc1c(F)cc(C2(N)CC2)c(O)c1Br 218689257 XDZAPDGWNANAPQ-UHFFFAOYSA-N 276.105 2.250 10 10 CECE COc1ccc(N(C)Cc2nc(C3CC3)n[nH]2)cc1F 182461793 XRSKTWLBZWOGBV-UHFFFAOYSA-N 276.315 2.466 10 10 CECE CC[C@@H](C)N(C)C(=O)CCOc1ccc(N)cc1 42269063 TXPJJGGUZSUXRD-LLVKDONJSA-N 250.342 2.295 10 10 CECE COc1ccc(CN(CC(C)(C)O)C2CC2)c(O)c1 189944785 WFGBCCLBLIGSMU-UHFFFAOYSA-N 265.353 2.136 10 10 CECE CCNC(=O)c1ccc(NCc2cccc(O)c2O)cc1 41117360 ZZUAPKYUXVQAMO-UHFFFAOYSA-N 286.331 2.460 10 10 CECE COc1ccc(O)c(CNC(=O)c2[nH]c(C)cc2C)c1 133457482 MTVUFSZGPHQPTO-UHFFFAOYSA-N 274.320 2.276 10 10 CECE COc1cc(OC)c(C(=O)NCCCN=[N+]=[N-])cc1OC 42013119 KQWZRJZQOHXXMW-UHFFFAOYSA-N 294.311 2.143 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC(=O)N1CCCC1 228799467 NVNBOKGJCJRKHY-STQMWFEESA-N 288.391 2.461 10 10 CECE CCCc1cccc([C@@H]2N[C@@H](C(=O)O)CS2)c1O 83236660 WRKKUBLCRUVIRJ-ZYHUDNBSSA-N 267.350 2.133 10 10 CECE O=C(N[C@@H]1CC[C@@H](O)C(=S)C1)OCc1ccccc1 514278337 ZZPMBBVJXVKARQ-VXGBXAGGSA-N 279.361 2.196 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@@](C)(C(=O)O)C1 86780171 JYIBYBIQYSIYJQ-YMTOWFKASA-N 267.300 2.389 10 10 CECE CCN(Cc1cc(C)ccc1O)C[C@H](C)C(=O)O 86761743 BZLDWBHJLYTPCP-NSHDSACASA-N 251.326 2.243 10 10 CECE CCN1C(=O)C(=Cc2cccn2C)SC1=S 2313676797 HTIGOUCPJNBZNX-UHFFFAOYSA-N 252.364 2.246 10 10 CECE [N-]=[N+]=NC1CN(Cc2nc(Br)cs2)C1 1891822622 AEPAAZMZFGXWQS-UHFFFAOYSA-N 274.147 2.400 10 10 CECE Cc1ccc(O)c(CNCC2(O)Cc3ccccc3C2)c1 377776475 VSMJCIISKJAXNK-UHFFFAOYSA-N 283.371 2.320 10 10 CECE C[C@@H]1CCN([C@H](C)C(=O)Nc2ccc(N)cc2)[C@@H]1C 380613869 LGVPLJZGARGIQM-IJLUTSLNSA-N 261.369 2.326 10 10 CECE FC1(F)Oc2ccc(N3CCCC4(CNC4)C3)cc2O1 2162669155 XZILYNGTIAPJQQ-UHFFFAOYSA-N 282.290 2.198 10 10 CECE Oc1cc(F)c(Cl)cc1CN1C[C@@H]2CCCN[C@@H]2C1 295451726 VGWZRMRQNRYETP-TVQRCGJNSA-N 284.762 2.369 10 10 CECE CCN1CCc2cc([C@@H](N)Cc3cnn(C)c3)ccc21 2163061465 GNUULIPWTSNLIK-HNNXBMFYSA-N 270.380 2.045 10 10 CECE Cc1nn(C)c(C)c1C[C@H](O)c1ccc(N(C)C)cc1 2163074558 UBJLNYQMRHLRGL-INIZCTEOSA-N 273.380 2.379 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H]3[C@@H]4CCOC[C@H]43)ccc21 2163106795 LNGIJVBZQPWSRB-SRABZTEZSA-N 272.392 2.351 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)c3ccccc3)ccc21 2163145978 SFYZYBVCCXVBRZ-DLBZAZTESA-N 268.360 2.412 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@]2(O)CCCOC2)cc1 2163155732 ZWHWREBHWDDWHP-HOTGVXAUSA-N 278.396 2.074 10 10 CECE C[C@H]1CN(C)CCN(c2ccc(/C=C/C(=O)O)cc2)C1 707599417 QZZPFJPCMOIAJK-LJLILKBBSA-N 274.364 2.172 10 10 CECE Cc1ccc([C@H](C)NC[C@H]2C[C@@H]3COC[C@@H]3O2)c(O)c1 724604305 OBEDGZXCYNKNIH-VLXAULBPSA-N 277.364 2.155 10 10 CECE CCCN1C(=O)NC[C@H]1c1ccc2c(c1)CCN2C 721752369 OPPYVGQZFQSEME-AWEZNQCLSA-N 259.353 2.155 10 10 CECE 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C[C@H](C(=O)Nc1ccc(N)cc1)N1CCC[C@](C)(F)C1 2152238347 YRBNKVMEMKKJIZ-ABAIWWIYSA-N 279.359 2.420 10 10 CECE CN(Cc1cnco1)c1ccc(CO)c(Cl)c1 1998715211 PWUAUASPJCXQIU-UHFFFAOYSA-N 252.701 2.457 10 10 CECE CC(C)c1nc(N(C)Cc2ccc(N)cc2)cc(=O)[nH]1 164552615 RAHPVSLDSFKXTI-UHFFFAOYSA-N 272.352 2.112 10 10 CECE CCCN(CCOC)[C@@H](CN)c1ccc(N(C)C)cc1 2154246327 CNKBFCZNYKJQGN-INIZCTEOSA-N 279.428 2.111 10 10 CECE C[C@@H](c1nccs1)N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 2155708918 MBBDJCBFKHONCI-QPUJVOFHSA-N 289.360 2.326 10 10 CECE CCCN(CCO)c1ccc(CN)c(C(F)(F)F)c1 48917616 HBTSMMDRUONAQI-UHFFFAOYSA-N 276.302 2.373 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1cc(OC)ccn1 2159150963 WOYAWMFFWMYMBM-MRXNPFEDSA-N 271.364 2.465 10 10 CECE CP(C)(=O)[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 2159319031 WZHKOULUILPQFC-AWEZNQCLSA-N 294.335 2.425 10 10 CECE CCCNCc1ccc(OCCN(C)C)c(C)c1 2027042569 FHTHMRJIWDEGLH-UHFFFAOYSA-N 250.386 2.435 10 10 CECE Oc1ccc(F)cc1CNC[C@@H]1CCCOCC1 2028637969 WHCWNGJVHCOJLA-LLVKDONJSA-N 253.317 2.438 10 10 CECE 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10 10 CECE CC(C)[C@H]1CNCCCN1Cc1c(O)cccc1F 2104506688 BHNAOOXNHPVTQC-CQSZACIVSA-N 266.360 2.351 10 10 CECE OC[C@@]12CC[C@@H](C[C@@H]1NCc1c(O)cccc1F)C2 2104735668 AHDIKAVTLGBMNV-LKTVYLICSA-N 265.328 2.172 10 10 CECE Oc1ccc(CNC2C[C@@H]3CSC[C@H]3C2)c(O)c1O 2104751617 JZNCINQYCMTCOO-NXEZZACHSA-N 281.377 2.035 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@]2(C)CCO)c(F)c1 2084699112 DBZBDAJZPKFPNT-HZMBPMFUSA-N 253.317 2.230 10 10 CECE c1cc2c(cc1N1CCC3(CC1)CNC3)CCCO2 2106394189 JGHZUZLOLFPXPC-UHFFFAOYSA-N 258.365 2.201 10 10 CECE COc1ccc(N2CC[C@@H](C)C[C@@H]2CN)cc1OC 2106332023 PVXFCCXTIDCWMB-DGCLKSJQSA-N 264.369 2.267 10 10 CECE CCN1CCc2cc([C@H](O)C[C@H](N)C(C)C)ccc21 2106793993 SCXMSZBCAOSGCA-GOEBONIOSA-N 262.397 2.476 10 10 CECE CN1CCc2cc([C@H](O)CNC3CCCC3)ccc21 2106795263 FTJJCBROCFKOAD-MRXNPFEDSA-N 260.381 2.245 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H](C)CCCN)ccc21 2106800695 KDKKXMAVYJALEN-WBMJQRKESA-N 262.397 2.477 10 10 CECE CN(C)c1ccc([C@@H](O)[C@]2(C)CC(F)(F)CN2)cc1 2106802934 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2.342 10 10 CECE CSc1ncc(CNCC[C@H]2N[C@H]3CC[C@H]2C3)s1 2257130068 CLNCDPCLXMVKGU-JBLDHEPKSA-N 283.466 2.485 10 10 CECE COc1cc(OC)c(N2CC[C@@](C)(O)C2)cc1Cl 2258051323 VZMCMLDDKINDOJ-CYBMUJFWSA-N 271.744 2.318 10 10 CECE COc1cc(OC)c(N2C[C@H](C)[C@H](O)C2)cc1Cl 2258078150 FDVJPERZNDZUTM-GZMMTYOYSA-N 271.744 2.174 10 10 CECE CC[C@H]1[C@H](O)CCN1c1c(F)cc([C@@H](C)N)cc1F 2273212119 BDVNILUDJHWYOD-OXHMUOHRSA-N 270.323 2.334 10 10 CECE C[C@H](N)c1ccc(N2CCC=C[C@@]2(C)CO)c(F)c1 2264390384 BHJMBSLLCZPFOH-NHYWBVRUSA-N 264.344 2.363 10 10 CECE CC[C@H](C)[C@@H](CN)NCc1ccc2c(c1)CCCO2 2278763646 LDCFTITZUFLEED-SWLSCSKDSA-N 262.397 2.475 10 10 CECE COc1ccc(CN[C@@]23CC[C@@](CF)(C2)OC3)c(O)c1 2290457162 BLFHSFUNPNZUIV-GJZGRUSLSA-N 281.327 2.152 10 10 CECE CNCc1cc(OC)ccc1N1CC(C)(C)OC[C@H]1C 2284122259 LSZRMSPGLVHGBN-GFCCVEGCSA-N 278.396 2.418 10 10 CECE CCN(c1ccc([C@H](C)N)c(C)c1)[C@H]1CCCNC1=O 2285129674 JUJXVKYEDUTQNS-WFASDCNBSA-N 275.396 2.120 10 10 CECE Cc1cc(N(C)C[C@H]2COCCCO2)ccc1[C@@H](C)O 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CECE COc1cccc(CN2C[C@H]3C[C@H]2C[C@@H]3OC)c1O 2340775207 SGEOUUQGHVWHOI-DYEKYZERSA-N 263.337 2.010 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@@H](F)[C@@H](CO)C2)c1C 2341069242 GYHDOGKJOJNCEI-YRGRVCCFSA-N 266.360 2.090 10 10 CECE Cc1ncccc1N1CCc2cc(O)c(O)cc2C1 2341216953 SCUKNMBIZGYEQO-UHFFFAOYSA-N 256.305 2.364 10 10 CECE c1cc2c(cc1N1CCN[C@@H]3CCC[C@H]31)CCCO2 2341873890 UWLINRYALGCLTQ-HUUCEWRRSA-N 258.365 2.342 10 10 CECE CCN(CC12CC(F)(CO1)C2)c1ccc(CN)cc1 2352977663 YZRKFLGCCLBCQW-UHFFFAOYSA-N 264.344 2.243 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H]2C[C@@H]3C[C@@H]3CO2)cc1O 2355826703 KZRAHSCMGFOBAW-CZXHOFHRSA-N 276.380 2.273 10 10 CECE CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1O 178856924 ZCKFNNBEBKQVRB-UHFFFAOYSA-N 280.368 2.349 10 10 CECE Cc1ccc2nc(/N=N/NC(N)=S)sc2c1 27586803 CNZHVSHJVCMFDZ-UHFFFAOYSA-N 251.340 2.437 10 10 CECE CN(Cc1cc(Cl)ccc1O)[C@@H]1CCCNC1 110926506 ABVHRPSTRBRTJA-GFCCVEGCSA-N 254.761 2.229 10 10 CECE COc1ccc([C@@H](C)N2CC[C@@H](OC)C2)c(O)c1 300102666 VBBKHNAAFNECDA-ZYHUDNBSSA-N 251.326 2.183 10 10 CECE CCOc1cccc(CN[C@@H](CCO)C2CC2)c1O 304302346 GCHGQFAQNUEMJJ-ZDUSSCGKSA-N 265.353 2.042 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H]2CCC[C@@](CO)(C2)C1 2357623363 YQTYHNTYSULEIN-NVXWUHKLSA-N 275.392 2.476 10 10 CECE COc1ccc(O)c(CN2CC[C@H](c3cnn(C)c3)C2)c1 180331124 AWTIZAHLYZJMRK-LBPRGKRZSA-N 287.363 2.124 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1NCc1ccc2c(c1)CCCN2C 122930890 FSYSTPSABLCAPX-PBHICJAKSA-N 287.451 2.499 10 10 CECE ONCc1ccc(Br)c(Cl)c1O 217719549 HSFREJKWZDQVHC-UHFFFAOYSA-N 252.495 2.287 10 10 CECE CO[C@@H]1CC[C@@H]2OCCN(Cc3cc(F)ccc3O)[C@@H]2C1 180287422 ZHQBDFUDNPYIQU-FMKPAKJESA-N 295.354 2.300 10 10 CECE CCN(CCOc1ccc(N)cc1)[C@@H](C)COC 42737941 NUSFDSOQAJJYGP-LBPRGKRZSA-N 252.358 2.004 10 10 CECE CCOC(=O)[C@@H](CC[C@@H](N=[N+]=[N-])C(=O)OCC)N=[N+]=[N-] 504808252 YQLKWVWPZCLUGV-HTQZYQBOSA-N 284.276 2.251 10 10 CECE Nc1ccc(CCC(=O)NC[C@H]2CCCC[C@@H]2CO)cc1 89502636 CKVOMFPYVHJQNH-HUUCEWRRSA-N 290.407 2.116 10 10 CECE COC[C@@H](NCc1ccc(OC)cc1O)C(C)C 86695210 PNSIMTYEFOJARS-CYBMUJFWSA-N 253.342 2.161 10 10 CECE CCN(CCOC)c1ccc(CN)c(Br)c1 228149620 JMAWIDOLFHFHIG-UHFFFAOYSA-N 287.201 2.381 10 10 CECE CC[C@@H](C)CN(C)C(=O)COc1ccc(N)cc1 40302848 YPICXDLMFFCERH-LLVKDONJSA-N 250.342 2.152 10 10 CECE COc1ccc(O)c([C@H](N)CC(=O)OC(C)(C)C)c1 1951376375 KEYVZKLNMDDPKH-LLVKDONJSA-N 267.325 2.132 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CCC[C@@H](C(=O)O)C2)c1 86787551 QUNOZOBWVGYXPU-DGCLKSJQSA-N 263.337 2.434 10 10 CECE CCOc1ccc(O)c(CN[C@](C)(CC)CCO)c1 134471253 BIEPIEZOTZWFGF-OAHLLOKOSA-N 267.369 2.432 10 10 CECE Cc1cc(Br)cc(CN[C@@H](C)[C@@H](C)O)c1O 381648798 CNIRLGUXNXDWKP-DTWKUNHWSA-N 288.185 2.322 10 10 CECE CC[C@H](N)c1c(C(=O)O)ccc(Br)c1O 95714873 JQCSQQGEXIZJOS-ZETCQYMHSA-N 274.114 2.263 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1ccc(F)cc1C 90256897 ZYZSYGFVWTXMDZ-NSHDSACASA-N 266.276 2.248 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])C1CCC(C)CC1 90256731 HLHCWJSVOMEDGO-ILDUYXDCSA-N 254.334 2.254 10 10 CECE COC(=O)CC[C@H](N)c1ccc(Br)cc1O 95682987 BPWKLDDEWWNSHO-VIFPVBQESA-N 288.141 2.108 10 10 CECE CCc1ccc([C@H](NCCCN=[N+]=[N-])C(N)=O)s1 90260418 ORJDAAUFRSYVMH-JTQLQIEISA-N 267.358 2.127 10 10 CECE CCCN1CCC2=NN[C@H](c3ccc(N(C)C)cc3)[C@H]2C1 244147583 USYCQSMUPILNOP-DOTOQJQBSA-N 286.423 2.485 10 10 CECE N[C@@H](CO)c1ccc(N2CCCC2)c(Br)c1 258630989 SWVVFFVPNUAKES-NSHDSACASA-N 285.185 2.041 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CC[C@@H]2C[C@@H]2C1 700102363 AFYJGNJJSTVALJ-DDHJBXDOSA-N 266.345 2.254 10 10 CECE c1cc2c(cc1N1CCC[C@H]1[C@H]1CCCN1)COCC2 2162638557 VVCLOQUEDLCROK-SJORKVTESA-N 272.392 2.480 10 10 CECE OC[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(Cl)c1O 290855672 JIBISKBOSUGPAQ-NQBHXWOUSA-N 267.756 2.391 10 10 CECE COc1nscc1CN(C)Cc1cc(N)ccc1O 723211530 SVNVGEDSYYMAQB-UHFFFAOYSA-N 279.365 2.072 10 10 CECE CN1CCCc2cc([C@@](C)(O)[C@H]3CCCNC3)ccc21 2163092115 OCMMCHKBFDCCPH-DOTOQJQBSA-N 274.408 2.276 10 10 CECE CCN(CC(=O)OC)Cc1ccc(N(C)C)c(C)c1 293256620 XGYINTFAISTLMO-UHFFFAOYSA-N 264.369 2.056 10 10 CECE Cc1ccc(O)c(CN(C)C[C@@H]2C[C@@H]3OCC[C@H]3O2)c1 2163197341 BWLRRGRMODDOGF-IMJJTQAJSA-N 277.364 2.079 10 10 CECE CO[C@H](C)CCN(C)c1ccc(OCCN(C)C)cc1 2165542702 NERKXYRLGCAFMS-CQSZACIVSA-N 280.412 2.488 10 10 CECE CC1(C)CN(Cc2c(O)cccc2Cl)[C@@H](C(=O)O)CO1 2165800196 OPYXFVXRFKZZCB-LLVKDONJSA-N 299.754 2.110 10 10 CECE COC1(C(F)(F)F)CN(CCc2ccc(N)cc2)C1 724221940 JTYUQQDPKYGSSH-UHFFFAOYSA-N 274.286 2.074 10 10 CECE CC[C@@H]1CCNC[C@@H]1N(C)Cc1cc(OC)ccc1O 2163614224 RRELNDNTOQOKMY-DOMZBBRYSA-N 278.396 2.221 10 10 CECE COc1cc(Cl)cc(CN[C@]2(C)CCN(C)C2)c1O 716566089 XDBGFOHTMRHPOP-CQSZACIVSA-N 284.787 2.238 10 10 CECE CN1C[C@@H]2CCN(Cc3ccc(N(C)C)c(F)c3)[C@H]2C1 814173538 MRFYJYZRANIRLK-BBRMVZONSA-N 277.387 2.028 10 10 CECE Oc1c(CNCCCn2ccnn2)ccc2ccccc12 816567882 OLTPTEWCVMEFHI-UHFFFAOYSA-N 282.347 2.317 10 10 CECE CCCCN(CC(N)=O)c1ccc([C@@H](CC)NC)cc1 723195003 GZGAPRFNSIYHIW-OAHLLOKOSA-N 277.412 2.449 10 10 CECE CCNCc1ccc(N(C)Cc2ccn(C)n2)cc1 723519545 QAMSCZBGXXQMCB-UHFFFAOYSA-N 258.369 2.166 10 10 CECE CCCn1cc([C@@H](C)NCc2ccc3c(c2)CCO3)nn1 902784087 NTPPWSFQWPMULA-GFCCVEGCSA-N 286.379 2.474 10 10 CECE C[C@@H]1C[C@H](O)CN(C/C=C/c2ccc(N(C)C)cc2)C1 835054038 GVSMSNYHIYLSNI-ROHVMALMSA-N 274.408 2.469 10 10 CECE COc1cccc([C@@H](C)NCCc2cn(C)cn2)c1O 846169748 SNYJHPNKZSXDIF-LLVKDONJSA-N 275.352 2.028 10 10 CECE COC(=O)COc1ccc(N(C)C[C@H](N)CC(C)C)cc1 841019855 GAXYPSIMUBBMPM-CYBMUJFWSA-N 294.395 2.048 10 10 CECE Cc1cc(Cl)cc(CN(C)[C@@H]2CCNC2)c1O 843049936 ZBVJWTLLVNIKPZ-GFCCVEGCSA-N 254.761 2.148 10 10 CECE Cc1cc(Cl)cc(CNCC(F)(F)CN)c1O 841060190 SMSSCPVVOJZZMO-UHFFFAOYSA-N 264.703 2.038 10 10 CECE COc1ccc(N2CC[C@H](NC3CCOCC3)C2)cc1 850347696 WCXBAUBDUUPYOF-AWEZNQCLSA-N 276.380 2.043 10 10 CECE COc1ccc(CN[C@@H]2C[C@@H](C)n3ncnc32)cc1C 850352232 PISUGQBTZLNENK-DGCLKSJQSA-N 272.352 2.391 10 10 CECE C[C@H](NCc1ccc2c(c1)CCCN2C)[C@H]1[C@H]2CN[C@H]1C2 925530101 BPEBOTFCLOQZJE-AWOKKLPBSA-N 285.435 2.155 10 10 CECE CCN(Cc1c(O)cccc1Br)C[C@@H](C)N 1976231527 UZSGBGYXSFOXBH-SECBINFHSA-N 287.201 2.324 10 10 CECE Cc1ccc([C@H](C)NC[C@@H]2CN(C)C[C@@H](C)O2)c(O)c1 697319313 FFSKUTCABIONIM-HZSPNIEDSA-N 278.396 2.070 10 10 CECE COC(=O)[C@@H]1CCN[C@H](c2c(O)cccc2Cl)C1 1952527380 BITMQGFHTDIWCJ-SCZZXKLOSA-N 269.728 2.259 10 10 CECE COc1ccc(N2CC[C@@H](NC[C@@H]3CCCOC3)C2)cc1 850346268 DLNTYRRGFKDSOW-LSDHHAIUSA-N 290.407 2.290 10 10 CECE CC(C)(C)OC(=O)N1CCN(CCCN=[N+]=[N-])[C@H]2C[C@H]21 1954208222 KEXQTGMDUYJUJX-WDEREUQCSA-N 281.360 2.380 10 10 CECE CN(CCN=[N+]=[N-])[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 1954207583 XUSKTMIGXCGJFT-JGPRNRPPSA-N 281.360 2.094 10 10 CECE Cc1cc(Cl)cc(CNCCN2CCC2)c1O 776252986 KFUZSRDMPKXBSM-UHFFFAOYSA-N 254.761 2.149 10 10 CECE COc1cccc(CN[C@@H]2CCNCC(C)(C)C2)c1O 872253010 YHOWWHNGLLJLPI-CYBMUJFWSA-N 278.396 2.269 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)CC(=O)N2CCCC2)c1 132706936 XXEURPIKSFSTMF-CYBMUJFWSA-N 276.380 2.316 10 10 CECE C[C@H](NC(=O)[C@@H]1[C@@H]2CCCO[C@@H]21)c1ccc(N(C)C)cc1 773017788 FPGVAUQQZALLOL-KSYCFECVSA-N 288.391 2.355 10 10 CECE C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)CC[C@@H]1O 779199525 CZLGFXCKJHLAOM-PELKAZGASA-N 273.735 2.387 10 10 CECE OCCc1ccccc1NCc1ccc(O)c(O)c1 83431837 FCLYZCKHLYYDBU-UHFFFAOYSA-N 259.305 2.245 10 10 CECE COc1ccc(CN2C[C@H](C(C)C)NC[C@@H]2C)c(O)c1 83586669 FNFXZMZGOGISPD-SWLSCSKDSA-N 278.396 2.219 10 10 CECE Oc1cccc2c1CCN[C@@H]2c1cccc(F)c1O 83619856 HUXMPVUVVFKZEN-AWEZNQCLSA-N 259.280 2.472 10 10 CECE Oc1cc(F)ccc1[C@H]1NCCc2c(O)cccc21 83703252 APFHTUUSRYMZCK-HNNXBMFYSA-N 259.280 2.472 10 10 CECE COc1ccc(CN(C)[C@H]2CCO[C@H]2C)c(O)c1 211540636 VPJAYMZHYGTELS-GWCFXTLKSA-N 251.326 2.010 10 10 CECE CCCCOc1ccc(N2CC[C@@H](CNCCO)C2)cc1 76438029 DKNMNHYPAUTOGU-HNNXBMFYSA-N 292.423 2.274 10 10 CECE CN(C)c1ccc(Cn2ncc3c2CCC[C@H]3CN)cc1 82827976 QFSNEOXSHRQEJS-AWEZNQCLSA-N 284.407 2.376 10 10 CECE CC[C@H](c1ccccc1O)N(C)C[C@@H](COC)OC 701115017 WPDBGRQSDHJFNJ-GXTWGEPZSA-N 267.369 2.437 10 10 CECE C[C@@H](O)C1CN(c2ccc(CNC3CC3)c(Cl)c2)C1 719854053 YLPMSHQQYYHMOA-SNVBAGLBSA-N 280.799 2.409 10 10 CECE Cc1cc(CO)ccc1N(C)Cc1cnc(C)n1C 689493525 MCSJUINTLKEAAF-UHFFFAOYSA-N 259.353 2.166 10 10 CECE COc1ccc([C@H](C)NCCOC(C)C)c(O)c1 168878170 GTBDIPGGZNDECR-NSHDSACASA-N 253.342 2.476 10 10 CECE COc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C)c1O 720468543 ZKNDLWMIAACNHK-ZIAGYGMSSA-N 276.380 2.069 10 10 CECE COc1cccc(CNC(=O)c2cocc2C)c1O 1137473362 GZOFSHYGNBULSG-UHFFFAOYSA-N 261.277 2.232 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CCCC[C@H]43)ccc2[C@@H]1O 706822947 MGBOOVVUGCWONR-FZZIBODNSA-N 258.321 2.051 10 10 CECE Nc1ccc(OCC(=O)N2CCC[C@@H]2C2CCC2)cc1 688207994 XBDOXUCYCYAAAL-OAHLLOKOSA-N 274.364 2.439 10 10 CECE CCN1CC[C@@H](N(C)c2ccc(CNC)cc2C)C1 688445570 AXPYUTWXJJMJCL-OAHLLOKOSA-N 261.413 2.245 10 10 CECE CN1Cc2ccc(N3[C@H]4CCC[C@H]3CC(N)C4)cc2C1 709769545 SIHGBDBEJRTRMX-HOTGVXAUSA-N 271.408 2.481 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1csnc1OC 712894368 MBXSDLFGKAAXIE-VIFPVBQESA-N 299.356 2.046 10 10 CECE Cc1cc(N2C[C@H](F)[C@H](F)C2)ccc1C[C@@H](C)N 714565066 UHIAVQNXSYGLOQ-HONMWMINSA-N 254.324 2.381 10 10 CECE OCc1cc(F)c(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)c(F)c1 718320551 JJVGBWRAMYBGSY-DUBDDPSESA-N 281.302 2.071 10 10 CECE CN[C@H](C)c1ccc(N(C[C@@H](C)O)C2CC2)c(F)c1 691415907 MSAHFCPZZQDTAD-GHMZBOCLSA-N 266.360 2.456 10 10 CECE Oc1cccc(CNC[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)c1O 693351839 MULMIEGQSBOZGS-GUDFOSOFSA-N 269.291 2.479 10 10 CECE O=C(NC[C@@]12CCCC[C@H]1C2)c1cccc(O)c1O 693583762 YDGQBUJJLFFYKV-BONVTDFDSA-N 261.321 2.408 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@@H]1CCC1(C)C 694310141 MPLSETDCUSLJEN-CYBMUJFWSA-N 262.353 2.295 10 10 CECE CC1(C)CN(c2ccc3c(c2)OCCCO3)CCCN1 86269376 SIAKTOUALXAOOC-UHFFFAOYSA-N 276.380 2.426 10 10 CECE CC[C@H]1CN(Cc2ccc(O)cc2O)[C@@H](CC)CN1 86445293 WGCCKUYZLWYCTH-STQMWFEESA-N 264.369 2.060 10 10 CECE [N-]=[N+]=NC1CN(C(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)C1 2253832583 NXGRDDLGONDNRY-RNFRBKRXSA-N 262.235 2.486 10 10 CECE CCOC(=O)[C@](C)(Cc1ccccc1)NCCN=[N+]=[N-] 90257662 KSVCFCCWSXCXGG-AWEZNQCLSA-N 276.340 2.451 10 10 CECE Cc1ccn2nc(NCCc3ccc(N)cc3)nc2c1 94607866 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CCN(CC)c1ccc([C@H](O)[C@]23CNC[C@@H]2C3)cc1 1902265526 YXBJYPDQYJLMSJ-CWRNSKLLSA-N 260.381 2.176 10 10 CECE OCCN(CC(F)F)c1ccc2c(c1)CCC[C@@H]2O 2128273217 VHMWHWWNOCIMEM-ZDUSSCGKSA-N 271.307 2.120 10 10 CECE C[C@@]12C[C@@H](CO1)N(c1ccc3c(c1)CCC[C@@H]3N)C2 2128279146 LXLDWIPWYPGGOL-BPUTZDHNSA-N 258.365 2.390 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)CC[C@@H]1O 2128273511 WVDPICKEEITMQW-RLCCDNCMSA-N 261.365 2.263 10 10 CECE CN[C@H]1CCCc2cc(N3CC(N(C)C)C3)ccc21 2128270366 DZPYPKANNAXZHI-INIZCTEOSA-N 259.397 2.034 10 10 CECE C[C@H](O)CN(c1ccc2c(c1)CCC[C@@H]2O)C1CC1 2128275315 UKMGCXKKVZBFNO-ZBEGNZNMSA-N 261.365 2.406 10 10 CECE CN(C[C@@H]1CCCOC1)c1ccc2c(c1)CC[C@H]2N 2128311532 WFLJZJYYPLYKKW-BLLLJJGKSA-N 260.381 2.495 10 10 CECE C[C@H]1CC[C@@H](CO)N(c2ccc3c(c2)CC[C@@H]3N)C1 2128322135 PGMJMFUTGOQTDW-PJODQICGSA-N 260.381 2.230 10 10 CECE CC[C@H]1C[C@@H](C)CN1C(=O)c1cc(O)c(O)c(O)c1 2132351538 YAVHFQOISXCPJM-SCZZXKLOSA-N 265.309 2.064 10 10 CECE CC(C)N1C[C@@H]2C[C@@H]1CN2c1ccc([C@@H](C)N)cc1 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LSVMHELYVDHGCF-MRXNPFEDSA-N 268.364 2.216 10 10 CECE Nc1ccc(NC(=O)NC2CC3(CSC3)C2)cc1 717918149 QBPVBGMGEHNAHS-UHFFFAOYSA-N 263.366 2.286 10 10 CECE NN[C@H](C[C@@H]1CCOC1)c1ccc(N2CCCC2)cc1 2163104116 BCJKUCAWFZRRDM-XJKSGUPXSA-N 275.396 2.218 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CC23CCCC3)cc1 387221075 ZOLRDBJCUCPNTE-ZDUSSCGKSA-N 260.337 2.097 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@H](S(=O)(=O)CC)C2)cc1 2179893921 OEHDHNHTHPHQMY-GJZGRUSLSA-N 296.436 2.110 10 10 CECE O=C(NCc1c(O)cccc1O)C1CCC(F)CC1 2062796801 MKFUPQFOTQDPFP-UHFFFAOYSA-N 267.300 2.242 10 10 CECE C[C@@H]1Cc2cc(N3CCN[C@H](CC(F)F)C3)ccc2O1 2177314674 KECQTEYPAZRYGW-ZYHUDNBSSA-N 282.334 2.443 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2CCCCC23CC3)cc1 2173568192 VJBUAMCOYGOTJX-CQSZACIVSA-N 294.420 2.411 10 10 CECE CNCc1cc(C)nn1[C@H](C)c1c(O)cccc1F 2070154757 AIPWHBLJJFKNII-SNVBAGLBSA-N 263.316 2.365 10 10 CECE O=C(O)C[C@@H]1CCCN(Cc2ccccc2O)CC1 883518485 SVUYQMXJKQVUEV-GFCCVEGCSA-N 263.337 2.469 10 10 CECE CNC(=O)c1cc(C)nn1[C@@H](C)c1ccc(C)cc1O 2070174702 FTFXMWORBIOLBA-NSHDSACASA-N 273.336 2.174 10 10 CECE C[C@@H](O)c1ccc(N2CCn3ncc(O)c3C2)cc1Cl 2168340488 YKCDPEIBCCOVLO-SECBINFHSA-N 293.754 2.316 10 10 CECE COc1cccc(CN[C@@H]2C[C@H]3C[C@H]2C[C@@]3(C)O)c1O 2178196250 GBRLZTGXGBKOCM-VPWBDBDCSA-N 277.364 2.040 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H](C)CC3CNC3)ccc21 2178437434 MGYFEQOBRPIJQN-PXAZEXFGSA-N 274.408 2.348 10 10 CECE O=C(NC1CC1)[C@@H]1CCCN1c1ccc(CO)cc1Cl 2169554140 MOJUFNKZWNZCCY-AWEZNQCLSA-N 294.782 2.080 10 10 CECE CN(Cc1ccco1)C(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2179612823 MWVZWTVZJJTSMD-NSHDSACASA-N 277.328 2.013 10 10 CECE CC[C@H](c1ccc(C)cc1O)n1nc(C)c(CO)c1N 2079114836 AQQNDVYCICGKHY-CYBMUJFWSA-N 275.352 2.279 10 10 CECE CN[C@@H](CC1COCCOC1)c1ccc(N(C)C)cc1 2187987111 ZUJCXXJDOCOTKQ-INIZCTEOSA-N 278.396 2.066 10 10 CECE CCN[C@H](C)c1ccc(N2CC(=O)NC[C@@H]2C)c(Cl)c1 2181167942 OYJUUZQRVYLQHM-WDEREUQCSA-N 295.814 2.335 10 10 CECE C[C@H](NC(=O)CNCCC(F)(F)F)c1ccccc1O 2192626968 JTEACZYEYPQPDR-VIFPVBQESA-N 290.285 2.111 10 10 CECE CC[C@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)C[C@@H](C)O1 2188576512 HVLPQMSEZOKCTG-MFKMUULPSA-N 280.324 2.091 10 10 CECE Cc1cc(CN(C)c2ccc(CO)c([N+](=O)[O-])c2)on1 2188578623 YMBNZKRGYNDUCP-UHFFFAOYSA-N 277.280 2.020 10 10 CECE C[C@H](O)[C@@H](C)N(Cc1ccccc1O)C[C@H]1CCCO1 2195782995 OOXCWJBAPBCWGG-VNHYZAJKSA-N 279.380 2.143 10 10 CECE Nc1cc2c(cc1N1C[C@@H](F)C[C@@H](F)C1)CCC(=O)N2 2182596475 BVLMMZARXXEGJU-AOOOYVTPSA-N 281.306 2.040 10 10 CECE OCc1ccc(N2CC[C@@H]3COC[C@H]32)cc1Br 1910359138 ZKDXSLOITXDIGS-ZWNOBZJWSA-N 298.180 2.167 10 10 CECE COc1ccc([C@H](C)NCc2cc(C)n(C)n2)c(O)c1 2183140226 NLMVFJHCNVZIGS-NSHDSACASA-N 275.352 2.294 10 10 CECE CCC[C@H](C(=O)O)N(C)Cc1c(C)cccc1O 2042628534 REMMSMGOMZBERU-GFCCVEGCSA-N 251.326 2.386 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)[C@@H](O)C(C)C 2044749493 FEKRZKVEZHAZKW-GJZGRUSLSA-N 250.386 2.420 10 10 CECE CCN(CC)c1ccc([C@H](N)c2csnn2)cc1 2044750315 NOQXFLSBCNCJNU-ZDUSSCGKSA-N 262.382 2.432 10 10 CECE N[C@@H](c1ccccc1O)[C@@H](O)c1ncccc1Cl 2044930809 FBJRXAVLGLOZBH-WCQYABFASA-N 264.712 2.174 10 10 CECE CN(CCn1ccnc1)c1ccc2c(c1)CCC[C@@H]2O 2184688987 JRWMXBBBBCWLBQ-INIZCTEOSA-N 271.364 2.389 10 10 CECE CCN[C@H]1CCc2cc(N3CC([C@@H](F)CO)C3)ccc21 2184727282 OKSGQIUSJCTNCI-HOTGVXAUSA-N 278.371 2.050 10 10 CECE CN[C@@H]1CCc2cc(N3CCOC[C@@H]3C(F)F)ccc21 2184724923 AAGADMXZVZNDPI-ZIAGYGMSSA-N 282.334 2.364 10 10 CECE CN[C@@H]1CCc2cc(N(C)C[C@H]3OCC[C@H]3F)ccc21 2184724193 WLUURGZAGNMUBC-BZUAXINKSA-N 278.371 2.457 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2COCC2(F)F)cc1O 2197019753 ZCFAJRJCUSRTHD-RNCFNFMXSA-N 286.322 2.143 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)[C@H]1[C@H]2CCCC[C@H]21 2048526738 BLYDUSNIBNTNLB-VLEAKVRGSA-N 252.318 2.166 10 10 CECE Nc1ccc(NC(=O)COC[C@@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)cc1 2191067239 WXIZCHJRIZEAJO-JCILWVLBSA-N 272.348 2.126 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H]1CCCc2nccn21 2185978789 OQJCNOODOKRKRC-GHMZBOCLSA-N 274.328 2.062 10 10 CECE CO[C@@H](CN(C)c1ccc(CN)cc1F)C(C)C 2068258913 HLXSRENERPMCFT-AWEZNQCLSA-N 254.349 2.392 10 10 CECE C[C@H](N)c1cc(F)c(N(C)C(C)(C)CO)c(F)c1 2074220340 DERZRPZQRAIOGH-QMMMGPOBSA-N 258.312 2.192 10 10 CECE CO[C@@]1(C)CCN(c2ccc(CN)cc2)C[C@@]1(C)OC 2199617314 GCLMBECSUOZGNR-JKSUJKDBSA-N 278.396 2.166 10 10 CECE Oc1ccc2ccccc2c1CN1CC2(CCN2)C1 2101235683 JAGYNMIGNVPHSI-UHFFFAOYSA-N 254.333 2.093 10 10 CECE COc1cccc(CN(C)C[C@H]2CO[C@@H](C)C2)c1O 2101810096 FGAOLMWBRKOYBU-RYUDHWBXSA-N 265.353 2.258 10 10 CECE COc1ccc(N2CCCNC[C@H]2C)c(F)c1F 2081865325 SABBWUKHHODKHB-SECBINFHSA-N 256.296 2.162 10 10 CECE CCCC(=O)NCCCNCc1cc(Cl)ccc1O 2102493585 CPJPNHQJZGKXAT-UHFFFAOYSA-N 284.787 2.442 10 10 CECE CN(CCOC(F)F)Cc1ccc(F)c(F)c1O 2082821299 CJYZBUDUZYWBLZ-UHFFFAOYSA-N 267.222 2.341 10 10 CECE O=c1[nH]cnc2cc(C3=S=Nc4ccccc43)sc12 2103682787 GIEQLJHJVMEUKI-UHFFFAOYSA-N 285.353 2.465 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CC[C@@H](O)CC2)cc1O 2103868933 XBHDZSQTVOQXEJ-GMXVVIOVSA-N 264.369 2.152 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@@H]2CC=CC[C@@H]2C1 2104207442 GVJMOQPYLIRFEI-PTEHBNRSSA-N 264.329 2.174 10 10 CECE COc1cccc(O)c1CN[C@@H](C)[C@@H](OC)C1CC1 2104439740 STLYQIOQPBTYIM-ZUZCIYMTSA-N 265.353 2.304 10 10 CECE CCNCCN(CC)c1ccc2c(c1)OC(F)(F)O2 2106375428 DCVFRHLMZSEANT-UHFFFAOYSA-N 272.295 2.444 10 10 CECE CNC[C@H]1CCN(c2ccc3c(c2)C(C)(C)CO3)C1 2106340069 GHLRRNMNUFYNCD-GFCCVEGCSA-N 260.381 2.402 10 10 CECE CCN(CC)c1ccc([C@]2(N)C[C@@H]3COC[C@H]32)cc1 2106828747 PZSUOFFRBRPIDJ-DAXOMENPSA-N 260.381 2.353 10 10 CECE CCN[C@@H]1CCCN(c2ccc3c(c2)CCN3C)C1 2106802704 WNCQOBUPCFZBCX-CQSZACIVSA-N 259.397 2.257 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)CC(C)(C)C)ccc21 2106847875 AKUKUQBLCHEDDI-GJZGRUSLSA-N 262.397 2.476 10 10 CECE CCN1CCc2cc([C@H](O)C3CCNCC3)ccc21 2106800285 FZXVTVIGIJIEJK-MRXNPFEDSA-N 260.381 2.102 10 10 CECE CN1CCCc2cc([C@@]3(N)COCC3(C)C)ccc21 2106819794 DBCVONDSAJYMNQ-INIZCTEOSA-N 260.381 2.279 10 10 CECE CCN1CCc2cc([C@@H](NC)c3cnc[nH]3)ccc21 2106800546 IWLKFLCLQNXVNU-OAHLLOKOSA-N 256.353 2.101 10 10 CECE CNCc1ccc(OCCOCCCOC)c(C)c1 2087240746 VDLXBZATYCUGEP-UHFFFAOYSA-N 267.369 2.146 10 10 CECE COc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]32)c(N)c1 2087665664 XFOWPKVQUKDKPU-UHIISALHSA-N 262.353 2.017 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2CC)[C@@H](N)CC 2107861929 HPIMSLMYMNGMHO-HOCLYGCPSA-N 261.413 2.457 10 10 CECE CC[C@](C)(C(=O)OC)[C@@H](O)c1ccc(N(C)C)cc1 2108444899 WCIGYPYPASFZRU-ZFWWWQNUSA-N 265.353 2.375 10 10 CECE Nc1ccc(NC(=O)NC[C@H]2CCCOCC2)cc1 2089054728 SOSHDTHCBINLBW-NSHDSACASA-N 263.341 2.207 10 10 CECE CC(C)OC(=O)CN1CCc2cc([C@H](C)N)ccc21 2089578796 AKKDDQUUTFHPPH-NSHDSACASA-N 262.353 2.020 10 10 CECE CN(Cc1cnn(C)c1Cl)c1ccc(CN)c(F)c1 2109843357 NBHWREYAKOVLCK-UHFFFAOYSA-N 282.750 2.308 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3C=C[C@H]2C3)c([N+](=O)[O-])c1 2089871185 YMPDFBAHTMXSOH-SCVCMEIPSA-N 260.293 2.413 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](C)[C@@H]2C(N)=O)cc1Cl 2090254847 YJEYSIBUGFABFF-MWODSPESSA-N 281.787 2.060 10 10 CECE Nc1ccc(CCCN2C[C@H]3C[C@H](O)C[C@H]2C3)cc1 2090615638 VFHLMJCBRDYFNN-BMFZPTHFSA-N 260.381 2.047 10 10 CECE C[C@H](N[C@H](C)[C@H]1CCC[C@@H]1O)c1ccc(O)cc1O 2111559205 WEMVXRSMZMLJBE-JCRCQARHSA-N 265.353 2.298 10 10 CECE Cc1cc(CCNCc2ccc(O)c(O)c2)ccn1 2091820712 VQSYFBKTNKHFOD-UHFFFAOYSA-N 258.321 2.134 10 10 CECE CN[C@H]([C@@H](O)c1ccc2c(c1)CCN2C)C(C)(C)C 2092187223 DPUVRWURDLCXCC-LSDHHAIUSA-N 262.397 2.346 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)N1C[C@@H]2CC[C@H]2C1 2092818712 BYBZLZROQAWODW-STQMWFEESA-N 259.353 2.162 10 10 CECE Cc1cccc(CN[C@@H]2CC[C@H]3CN(C)C[C@H]32)c1O 2093300987 KCJXVUIPUIYMCA-RRFJBIMHSA-N 260.381 2.130 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1C(=O)[C@H](O)c1ccc2c(c1)CCN2C 2094521601 VWFHMZGPDFREFG-KTJYFRGRSA-N 259.349 2.183 10 10 CECE Nc1ccc(CCNC2CC([C@@H]3CCOC3)C2)cc1 2094859548 OUNSGCSOHWJWIC-VQCLRJIVSA-N 260.381 2.216 10 10 CECE C[C@H](N(C)c1ccc2c(c1)NC(=O)[C@H]2O)C(F)(F)F 2095363816 ULWIUEKFZGNCNZ-WKEGUHRASA-N 274.242 2.059 10 10 CECE C[C@@H]1CCN(c2ccc(CO)cc2[N+](=O)[O-])C[C@@H]1F 2095934137 OCGGYJVNXWJPBD-KOLCDFICSA-N 268.288 2.271 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2CCOC2(C)C)c1 2097519934 FOLCFSQARDFREZ-CQSZACIVSA-N 265.353 2.400 10 10 CECE Cc1cnn(C2CN(c3ccc(CO)cc3C)C2)c1 2113928998 OQQBGDOMPVUYBD-UHFFFAOYSA-N 257.337 2.054 10 10 CECE CCNCc1ccc(N2CC[C@H]3C[C@@]3(O)C2)cc1C 2114562377 YSGZNMMSCWFSKY-GOEBONIOSA-N 260.381 2.066 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCOC[C@@H]2C)cc1OC 2204555425 SUUFALXCKSFPLL-SWLSCSKDSA-N 278.396 2.276 10 10 CECE CCCNCc1ccc(N2CC[C@H](O)[C@H]2C)cc1OC 2204559079 KWIXXLIQTYPPBC-DOMZBBRYSA-N 278.396 2.154 10 10 CECE Cc1cccc(CNC(=O)c2noc3c2CCC3)c1O 2204625985 PNCQUGSVFCTQJZ-UHFFFAOYSA-N 272.304 2.107 10 10 CECE CC[C@H](N[C@H]1CCC[C@@H]1S(C)(=O)=O)c1ccccc1O 2205996314 MPCQSHPOYZSIEK-YDHLFZDLSA-N 297.420 2.399 10 10 CECE COC[C@]1(C)C[C@@H]1C(=O)N(C)Cc1ccccc1O 2269274812 ZCJYVXHRUZFPMR-DOMZBBRYSA-N 263.337 2.023 10 10 CECE CCOc1ncc([C@@H](N)c2ccccc2O)s1 2217045690 JQKCGZUKHTYPMQ-NSHDSACASA-N 250.323 2.296 10 10 CECE CCN(C[C@@H](C)O)c1ccc2c(c1)OC(F)(F)O2 2219503942 IYTOOIWILTWPCN-MRVPVSSYSA-N 259.252 2.215 10 10 CECE COc1ccc(N(C)[C@H](C)CSC)c(CCN)c1 2220422313 XPVXOOWCOSSHPB-LLVKDONJSA-N 268.426 2.384 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]2CN(C)C)c(C)c1 2232022307 LCWGVFJHWSPCNB-UKRRQHHQSA-N 261.413 2.416 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)C[C@@H](C)C2)c(C)c1 2232023606 ZXHZYGGKCXLGKT-KYOSRNDESA-N 262.397 2.483 10 10 CECE CCN(c1c(F)cc(CN)cc1F)[C@@H]1CCC[C@@H]1O 2224410505 PCYSEZGIJKGHGY-OLZOCXBDSA-N 270.323 2.163 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@@H]2CO[C@H]3C[C@@H]2C3)c1 2234717243 ZZPLLROMUXKYQK-BYNQJWBRSA-N 277.364 2.476 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)OCCCO3)C[C@@H]1CO 2235116045 UGXHHHYDEOKQCO-CHWSQXEVSA-N 277.364 2.303 10 10 CECE CN1CCc2cc(N3CCC4(CC3)C[C@@H]4CO)ccc21 2235129351 MWNPDNZZAUQDJV-CQSZACIVSA-N 272.392 2.278 10 10 CECE CCC[C@H](COC)N(C)c1ccc(OC)cc1CCN 2235973275 GHYOLFXKKTVHRX-CQSZACIVSA-N 280.412 2.448 10 10 CECE CC[C@@H]1CO[C@@H](C)CN1c1ccc(OC)cc1CNC 2235968333 QMZNHIZWNPXWLO-GXTWGEPZSA-N 278.396 2.418 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@H]2CCO[C@@H]2C1 2235961142 FPQKTDKVGKGKMP-BLLLJJGKSA-N 276.380 2.030 10 10 CECE C[C@@H]1CCC[C@@H](COC(=O)Cc2ccc(N)cc2)O1 2226873407 WYINBMSRYFOFMF-RISCZKNCSA-N 263.337 2.312 10 10 CECE COc1ccc(N(C)C2CSC2)c(C=CC(=O)O)c1 2227675243 YLJMMBJLWZRRFK-UHFFFAOYSA-N 279.361 2.345 10 10 CECE COc1ccc(N2CCC3(CCO3)CC2)c(C=O)c1 2227688077 MHLXYDCTIIGJAW-UHFFFAOYSA-N 261.321 2.267 10 10 CECE COc1ccc(O)c(CNC[C@@H](F)C2CCOCC2)c1 2238293548 HCXYFNGVWYFHEO-CQSZACIVSA-N 283.343 2.255 10 10 CECE C[C@@H]1C[C@@H]1CCN(C)c1ccc2c(c1)NC(=O)[C@@H]2N 2228282464 RXXBPMUCZAHJCS-ISTVAULSSA-N 259.353 2.121 10 10 CECE CCN[C@@H](c1ccccc1O)c1nccnc1CC 2228423960 PBUMAOIGUUEGNH-AWEZNQCLSA-N 257.337 2.444 10 10 CECE C[C@H](NC[C@H](F)[C@H]1CCOC1)c1ccc(O)cc1O 2229985058 NPYMAEWWUKMXFA-KWBADKCTSA-N 269.316 2.123 10 10 CECE CSc1ncc(CNCC2C[C@H]3CNC[C@@H]3C2)s1 2257133842 VZHNUSPKJRBGQA-QWRGUYRKSA-N 283.466 2.200 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@]12CC[C@@](CF)(C1)OC2 2274708494 GUCGRCWHQYPDEZ-RYUDHWBXSA-N 270.308 2.102 10 10 CECE COCCNC[C@@H](C)[C@@H](C)N(C)c1ccc(OC)cc1 2279054635 ROMDUQQUURBXHV-ZIAGYGMSSA-N 280.412 2.392 10 10 CECE CSc1ncc(CNC(=O)C[C@H]2CCCC[C@H]2N)s1 2269199127 JRNASYNWYNTQEX-MWLCHTKSSA-N 299.465 2.389 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1C 2269658426 FFDHIXFUVHMKKH-IOASZLSFSA-N 260.381 2.094 10 10 CECE C[C@H](NC[C@H](C)Cc1cn[nH]c1)c1c(O)cccc1O 2290440194 QFWJJJQVJBNSDG-MNOVXSKESA-N 275.352 2.350 10 10 CECE COc1ccc(N(C)[C@H]2COC[C@@H]2O)c2ccccc12 2294602002 TWIRIPUOYHIXQR-GJZGRUSLSA-N 273.332 2.044 10 10 CECE CCN(c1ccc([C@H](C)O)c(C)c1)[C@@H]1CCCNC1=O 2285166170 JPQJYQAOSZBCFR-SWLSCSKDSA-N 276.380 2.153 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCOCCOC)cc1C 2285143746 KUVPIXVUWUSWQW-AWEZNQCLSA-N 280.412 2.375 10 10 CECE FCCCCCNCc1ccc(N2CCNCC2)cc1 2286074294 XKOSLSCYASEMSZ-UHFFFAOYSA-N 279.403 2.326 10 10 CECE C[C@@H](N)c1ccc(N(C)CC2(O)CC2)c(Cl)c1 2301882438 SNYCTXDOLIKPDK-SECBINFHSA-N 254.761 2.321 10 10 CECE CO[C@H]1C[C@@H]2[C@H]1CCN2c1ccc(CO)cc1Cl 2310066650 CUZVVBPONNNMOV-HONMWMINSA-N 267.756 2.446 10 10 CECE CC(C)[C@@H]1C[C@@H](O)CN1c1ccc(CO)c(Cl)c1 2321510283 FHXYFWCQUKMRSF-OCCSQVGLSA-N 269.772 2.428 10 10 CECE COc1ccc([C@@H](C)N2C[C@@H]3CCO[C@@H]3C2)c(O)c1 2330211391 WYVZRKCAJMAXKQ-JRPNMDOOSA-N 263.337 2.183 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@@H]2C[C@@H]3C[C@@H]3CO2)CC1 2331061474 ABHRWKOXYCDYFX-USZNOCQGSA-N 264.329 2.103 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H]4C[C@H]3CO4)ccc21 2331550541 FRTLJQOPSMDDLE-DZKIICNBSA-N 258.365 2.261 10 10 CECE C[C@H]1OC2(C)CC1(C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-])C2 2333612101 FJANGWGUJNJMPP-YKHSQBMTSA-N 264.329 2.292 10 10 CECE COc1ccc(CNC[C@@H]2C[C@@H]2CC(=O)O)cc1C 2335887323 MWFBJNGHEWVNAP-OLZOCXBDSA-N 263.337 2.204 10 10 CECE C[C@]12C[C@H](C1)[C@@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])CO2 2337660746 NONSHWOTLZNMKI-MRBYEJRBSA-N 264.329 2.103 10 10 CECE COC(=O)c1ccnc(NCc2cnc(SC)s2)n1 2341153656 CBRMQJQFJWNGQN-UHFFFAOYSA-N 296.377 2.054 10 10 CECE CC(F)(F)c1ccnc(CN2CC[C@H](N=[N+]=[N-])C2)n1 2341400572 DMZXUIMOKDIVLO-QMMMGPOBSA-N 268.271 2.473 10 10 CECE Oc1ccc(CN[C@@H]2CCCC[C@@H]3C[C@H]32)c(O)c1O 2341999727 YBWOXSFKEMOSDU-YUSALJHKSA-N 263.337 2.472 10 10 CECE CSc1cc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)ccc1CN 2353857179 OVAZFAMWNFGOQP-ZSOGYDGISA-N 278.421 2.196 10 10 CECE Oc1cccc2c1[C@@H](NC[C@]13COC[C@H]1C3(F)F)CC2 2354587322 IQUUIHYRDMDVJU-SUHUHFCYSA-N 281.302 2.251 10 10 CECE CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCCN2)cc1 50950063 QOCUYWRHAZSKTE-HNNXBMFYSA-N 289.423 2.291 10 10 CECE CCCCN(C)C(=O)[C@@]12CC[C@@](C)(C(=O)C1=O)C2(C)C 8472053 IQAHZBLUZSQFIN-JKSUJKDBSA-N 279.380 2.209 10 10 CECE CN(C)C(=O)CNc1ccccc1C(=O)c1ccccc1 175596927 OMCPDVUMTHBLAP-UHFFFAOYSA-N 282.343 2.418 10 10 CECE C[C@H]1CN(CCCC(=O)Nc2ccc(N)cc2)C[C@@H](C)O1 22153016 HUUPOEPUOLCQJV-BETUJISGSA-N 291.395 2.097 10 10 CECE Oc1ccc(Cl)cc1CN[C@@H]1C[C@@H]2CC[C@H]1O2 1950978092 HHYFRTAETOBUOW-DMDPSCGWSA-N 253.729 2.455 10 10 CECE CCCN[C@@H](CCN(C)c1ccc(OC)cc1)C(=O)OC 62528569 SIWARPLDVWEZGL-HNNXBMFYSA-N 294.395 2.063 10 10 CECE C[C@@H](N[C@H](C)c1nnc2n1CCC2)c1ccc(F)cc1O 62747579 WANIIIBLNBKOSZ-NXEZZACHSA-N 290.342 2.481 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)Cc2cccnc2)cc1 36771033 HRSGKWVOSGCHMA-QGZVFWFLSA-N 284.407 2.279 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)C[C@H]2[C@H]3CC[C@@H](C3)[C@H]21 2357248825 ZFPLLKSZORCADQ-OSOQYDHYSA-N 273.376 2.450 10 10 CECE CC[C@](C)(O)CN1CCCN(c2ccc(OC)cc2)CC1 123432541 XNUARHYLULHBDB-KRWDZBQOSA-N 292.423 2.368 10 10 CECE COCCNCc1ccc(N(CCOC)C(C)C)c(F)c1 123490042 TXVGZSMVQPMIFD-UHFFFAOYSA-N 298.402 2.423 10 10 CECE CCN(CC)c1ccc([C@H]2NCCc3[nH]cnc32)c(O)c1 65376495 LXSDNXQJRDQAFN-OAHLLOKOSA-N 286.379 2.197 10 10 CECE CNCc1ccc(N2CCOC(C)(C)C2)c(F)c1 36232898 BPOPVKUBDUSCPN-UHFFFAOYSA-N 252.333 2.160 10 10 CECE COc1cc(O)c(CN2CCCC[C@@H]2CCO)cc1OC 183502829 VCTCIFSXOVCQCR-CYBMUJFWSA-N 295.379 2.146 10 10 CECE CC(C)CCOCC(=O)N(C)c1ccc(N)cc1 37274698 SDQJIZIZRNWIMM-UHFFFAOYSA-N 250.342 2.294 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)c1cc([N+](=O)[O-])c[nH]1 37982888 KKKZASGAFSBHRK-SECBINFHSA-N 289.291 2.462 10 10 CECE N[C@H](CCO)c1c(O)cc(Cl)cc1Br 218849633 CALFVBHOOIOHKO-SSDOTTSWSA-N 280.549 2.190 10 10 CECE COC[C@@H]1CCN(c2ccc(CN)cc2Cl)C1 81041304 OHWIBPPTQVEABJ-LLVKDONJSA-N 254.761 2.271 10 10 CECE [N-]=[N+]=NCCNS(=O)(=O)c1ccccc1C(F)(F)F 42012805 RDIVBQGRNUIMQH-UHFFFAOYSA-N 294.258 2.294 10 10 CECE COc1cccc(CN(CCC(=O)O)C(C)(C)C)c1O 86749913 DNAZCOORLWMKGA-UHFFFAOYSA-N 281.352 2.476 10 10 CECE COC(=O)[C@](C)(N)C1(c2cccc3c2ccn3C)CC1 1951903514 VNKLWFGHTDZWIS-HNNXBMFYSA-N 272.348 2.100 10 10 CECE CN(C(=O)c1cccc(O)c1O)c1nc2ccccc2n1C 193164196 PCKUBZCKCCWXCV-UHFFFAOYSA-N 297.314 2.261 10 10 CECE Cc1ccc(C(=N)N)c(Sc2nccs2)n1 43401806 DDFXZXGJSCJPLU-UHFFFAOYSA-N 250.352 2.282 10 10 CECE CCC1(C(=O)O)CCN(Cc2ccc(OC)cc2O)CC1 86788326 KQQDARCUAYIRIR-UHFFFAOYSA-N 293.363 2.478 10 10 CECE C[C@@H](NCC[C@H]1CCOC1)c1cc(O)ccc1O 235197734 OAQSBCWAXVVGLV-MNOVXSKESA-N 251.326 2.175 10 10 CECE COc1ccc(F)c(NC(=O)COc2ccc(N)cc2)c1 94853985 DIMPVEYKMUNECS-UHFFFAOYSA-N 290.294 2.434 10 10 CECE CCOC(=O)[C@@](CC)(NCCCN=[N+]=[N-])C1CC1 90259745 LWYCTSGQQOOTAK-LBPRGKRZSA-N 254.334 2.398 10 10 CECE O=C(O)CCc1c(F)cc(O)c(O)c1Br 258477669 FLRPCNVRNFQKCX-UHFFFAOYSA-N 279.061 2.017 10 10 CECE COc1cc(Br)cc(C(C)(C)N)c1O 258326580 FFUWXBJWPPGNBB-UHFFFAOYSA-N 260.131 2.357 10 10 CECE Cc1ccc(-c2c(O)c(C(=O)O)nn2C(C)C)n1C 606601390 QMVODEBNIOUKQP-UHFFFAOYSA-N 263.297 2.182 10 10 CECE CN(C)c1ccc(CNC2(CO)Cc3ccccc3C2)cc1 369378076 PPNLGYJXKFWRHI-UHFFFAOYSA-N 296.414 2.372 10 10 CECE CC(=O)C(=O)COC(=O)CCCOc1ccc(C)cc1C 808528117 RPEWJRBUKULJOV-UHFFFAOYSA-N 292.331 2.164 10 10 CECE CN(Cc1ccc(N)cc1)c1nc(Cl)nc2[nH]cnc12 2162785912 WUFQYXOZULYMAA-UHFFFAOYSA-N 288.742 2.225 10 10 CECE CCN1CCc2cc([C@H](NC)[C@H]3CCN(C)C3)ccc21 2163066943 QSZXAGTZFIMQDK-RDJZCZTQSA-N 273.424 2.281 10 10 CECE CCN1CCc2cc([C@]3(O)CN[C@H]4CCC[C@H]43)ccc21 2163073636 KXPKMFMSXBWLJJ-HLLBOEOZSA-N 272.392 2.029 10 10 CECE CC[C@@](N)([C@H](O)c1ccc2c(c1)CCN2C)C(F)(F)F 2163075041 YOFHJCCYMGJKKV-CHWSQXEVSA-N 288.313 2.382 10 10 CECE COCCC[C@@H](N)[C@H](O)c1ccc(N2CCCC2)cc1 2163091852 LDQKACKOSLFQHY-HZPDHXFCSA-N 278.396 2.074 10 10 CECE CCOC[C@H](N)[C@@H](O)c1ccc(N2CCCCC2)cc1 2163095737 UBQMSEYSYUTORX-HOTGVXAUSA-N 278.396 2.074 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)c1cn(C)cn1 2163111652 UJMSXCLTBZAUCY-MRXNPFEDSA-N 270.380 2.329 10 10 CECE C[C@@H]1C[C@](O)(c2ccc(N3CCCC3)cc2)[C@H](C)CN1 2163113337 KJBOKZNGKDRCBF-CKEIUWERSA-N 274.408 2.492 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@H]2CCO[C@@H]2C)cc1 2163152456 TUPJNRXZAZMVNB-KCXAZCMYSA-N 277.412 2.462 10 10 CECE CCO[C@@H]1C[C@H]1[C@@H](NN)c1ccc(N(CC)CC)cc1 2163156881 WCYPJLCQYIMUBB-OAGGEKHMSA-N 277.412 2.462 10 10 CECE CO[C@H]1CCCC[C@@H]1C(=O)NCc1ccccc1O 293666676 JOKPKLQSZADHAK-JSGCOSHPSA-N 263.337 2.214 10 10 CECE Cn1c(Cl)cnc1CC(=O)CCc1ccc(N)cc1 700279520 UATAUJDBJYTWPL-UHFFFAOYSA-N 277.755 2.400 10 10 CECE CNCc1ccc(N2CC[C@H]3[C@H](C[C@H]3O)C2)c(Cl)c1 2224661756 RZAKGJAMMQANQL-TYNCELHUSA-N 280.799 2.267 10 10 CECE CCO[C@@H]1C[C@H](OC)CN(c2ccc(CNC)cc2)C1 2165458217 SHMFARKXHHNFLL-JKSUJKDBSA-N 278.396 2.036 10 10 CECE CCc1nccn1CCNCc1cccc(F)c1O 719693867 YWLSWQGEFZUEKV-UHFFFAOYSA-N 263.316 2.080 10 10 CECE COc1ccc(CNC(=O)[C@@]2(C)C[C@@H]3C[C@@H]3C2)c(O)c1 816550478 SBBWCAZMRJCEDC-DRXBFXEBSA-N 275.348 2.453 10 10 CECE CCOc1cccc([C@@H](C2CC2)N2CCNCC2)c1O 575273227 MLLWYZIECJJOMJ-OAHLLOKOSA-N 276.380 2.147 10 10 CECE Cc1cccc(CNCC[S@](=O)CC(F)(F)F)c1O 826868020 ONSJAPDTQBMGOP-IBGZPJMESA-N 295.326 2.101 10 10 CECE CCN1C[C@@H](NCc2cccc(OC)c2O)C(C)(C)C1 722260825 BZPCKIWZMPGGCZ-CQSZACIVSA-N 278.396 2.221 10 10 CECE CC1(C)CC(CS(=O)(=O)NCc2ccccc2O)C1 723782689 MGLXOTZGQGSAGW-UHFFFAOYSA-N 283.393 2.248 10 10 CECE CN(C)c1ccc(CNCc2cc(N)ccn2)cc1 903950405 NCIGVEOFXRWKNM-UHFFFAOYSA-N 256.353 2.020 10 10 CECE Oc1cc(OCc2ccccc2)ccc1[C@@H]1NCC[C@@H]1O 1952214200 POGMALRJVXUWHU-RDJZCZTQSA-N 285.343 2.367 10 10 CECE CCCn1nccc1NC(=O)c1cc(O)cs1 732270204 QUCKGIMTOIYXPB-UHFFFAOYSA-N 251.311 2.313 10 10 CECE Oc1c(F)cc(Cl)cc1CNCC[C@@H]1CCNC1 841034463 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2.069 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC[C@@H](C2CC2)C1 399993257 ABULYKQAJIIAQC-WCQYABFASA-N 273.380 2.328 10 10 CECE Oc1ccc(Br)cc1Cn1cccn1 2069952052 RWQVHKIOFHWOLS-UHFFFAOYSA-N 253.099 2.400 10 10 CECE O=C(O)[C@@H]1CCC[C@H]2[C@H]1CCN2Cc1ccccc1O 2173155821 OCIQNSSLHKIZFP-MJBXVCDLSA-N 275.348 2.467 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@]1(O)[C@H]2C[C@@H]2[C@H]2C[C@H]21 2166619926 ADGPERHDIFANMJ-NWHWRWDZSA-N 272.392 2.030 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C(=O)O)c1 2174233225 HOWXVINKCHLTJJ-QIWZIZFYSA-N 275.348 2.460 10 10 CECE CN1CC[C@@H](Nc2c(N)cccc2C(=O)O)CC12CC2 2167504848 QGIAXUIPPINGRQ-SNVBAGLBSA-N 275.352 2.006 10 10 CECE c1cc(N2CCCC2)ccc1CNC[C@@H]1[C@@H]2COC[C@@H]21 2174622414 SJPJGGWRDCYEFY-BJWYYQGGSA-N 272.392 2.269 10 10 CECE CN1CCCc2cc([C@H](O)[C@@](C)(N)CC(F)F)ccc21 2175095083 KZHVTRALKUKABV-GJZGRUSLSA-N 284.350 2.475 10 10 CECE CN1CCc2cc([C@@H]3N[C@H](c4cscn4)CO3)ccc21 2175644709 YZMCURWQBSOVIZ-SWLSCSKDSA-N 287.388 2.495 10 10 CECE 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[N-]=[N+]=NC[C@H]1CCCCN(C(=O)NC2CCOCC2)C1 2197928920 ROAQLFIZDQIZSL-LLVKDONJSA-N 281.360 2.287 10 10 CECE CC(C)C(F)(F)CNC(=O)c1cccc(O)c1O 2065510516 RNEIPAOGLUJTRF-UHFFFAOYSA-N 259.252 2.119 10 10 CECE CCN1[C@H](C)CN(c2ccc(CNC)cc2F)C[C@H]1C 2186956047 GFWMEMGFQKRWMD-CHWSQXEVSA-N 279.403 2.464 10 10 CECE Cc1cccc(CN(C)[C@H]2CCOC[C@H]2F)c1O 2066654638 AMBNESPUUFLVJZ-OLZOCXBDSA-N 253.317 2.259 10 10 CECE Nc1ccc(OCCCSC[C@H]2CCNC2)cc1 2073734869 XHNZICJJZRKQBD-LBPRGKRZSA-N 266.410 2.380 10 10 CECE Nc1ccc(CCN2C[C@H]3CCC[C@@](CO)(C3)C2)cc1 2199681146 QOPBMXINAUXFIJ-DOTOQJQBSA-N 274.408 2.296 10 10 CECE C[C@H](N)c1ccc(N(C)Cc2cn(C)cn2)c(F)c1 2104083760 CTVGNCKUUXAWJO-JTQLQIEISA-N 262.332 2.215 10 10 CECE Cc1cc(N2CC(C)(N(C)C)C2)ccc1C[C@@H](C)N 2104372513 LOZYKRAPBPJRLH-CYBMUJFWSA-N 261.413 2.025 10 10 CECE CN1CCC[C@H]2[C@@H]1CCN2Cc1c(O)cccc1F 2104479283 DWIQEXAGJVAHQI-KBPBESRZSA-N 264.344 2.200 10 10 CECE CNCc1ccc(N2CC[C@]2(C)CCO)cc1Cl 2084710768 XKISLWCIOXXJMO-CQSZACIVSA-N 268.788 2.411 10 10 CECE CN1CCc2cc([C@@H](O)CNCC(C)(C)C)ccc21 2106790216 GDTOQWHASULZPJ-HNNXBMFYSA-N 262.397 2.348 10 10 CECE C[C@@H]1C[C@H]([C@@H](O)c2ccc(N3CCCCC3)cc2)N1 2106834335 SUFHGFLFEJPKOP-WQVCFCJDSA-N 260.381 2.461 10 10 CECE CCNC1CCC(O)(c2ccc(N(C)C)cc2)CC1 2106805438 NTQNRLLRFLDGSJ-UHFFFAOYSA-N 262.397 2.492 10 10 CECE Cc1nscc1[C@H](O)[C@@H](N)c1ccc(N(C)C)cc1 2106853285 PDCNCMQMBWPGIF-KBPBESRZSA-N 277.393 2.251 10 10 CECE CCN(CC)c1ccc([C@]2(N)CCN(C)[C@H]2C)cc1 2106833247 IHAUAOSFIMXLQG-BBRMVZONSA-N 261.413 2.411 10 10 CECE O=C(O)c1ccoc1C(=O)c1cccc2c1NCC2 2107704550 WVLWZYGVQGCIGA-UHFFFAOYSA-N 257.245 2.177 10 10 CECE CN1CCc2cc([C@H](O)C(C)(C)CCCN)ccc21 2108613934 NFVZQOVMOPTNCV-HNNXBMFYSA-N 262.397 2.477 10 10 CECE CNCc1ccc(N2C[C@]3(CO)C[C@@]3(C)C2)c(Cl)c1 2109154622 OESNFVAEMGOSLL-GJZGRUSLSA-N 280.799 2.268 10 10 CECE CO[C@@H](C1CCCCC1)[C@@H](NN)c1ccccc1O 2090037161 KHFSJQBCPSSMAC-GJZGRUSLSA-N 264.369 2.492 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H](C3CC3)C2)cc1 2090682747 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CN1CCCc2cc([C@H](O)C[C@H]3C[C@H](N)C3)ccc21 2112535707 VCSLHYZJGNMKNC-DJSGYFEHSA-N 260.381 2.230 10 10 CECE CC[C@H](C)N1CC(N[C@H](C)c2ccc(O)cc2O)C1 2113006153 PRSWYGXPBRIPLD-WDEREUQCSA-N 264.369 2.231 10 10 CECE CC(C)[C@@H](CN)NCc1ccc(C(F)(F)F)cc1O 2113253395 BFQJJPJWMHBXTQ-LLVKDONJSA-N 276.302 2.484 10 10 CECE COc1ccc(N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(N)c1 2114006620 IYXBTDHHXQBPNS-NWDGAFQWSA-N 263.385 2.196 10 10 CECE CC1(C)SCCN(Cc2ccc(F)cc2O)[C@H]1C(=O)O 2204627376 QANHTXGSCYGVTD-LBPRGKRZSA-N 299.367 2.312 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)CCCCCC(=O)O 2218742586 GUHXVICXQKKXKB-UHFFFAOYSA-N 256.306 2.180 10 10 CECE Cc1cc(N2C[C@@H]3[C@@H](CO)C[C@H]3C2)ccc1[C@H](C)N 2269661754 PXAPAGDIKDWCLD-JFILPPLUSA-N 260.381 2.079 10 10 CECE [N-]=[N+]=NCCCN1CC[C@@H](OC(F)(F)CF)C1 2216765770 OVZUAHSTIMXQRE-MRVPVSSYSA-N 252.240 2.340 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@]3(C)O)cc1 2270743020 UEKWOCGFBLJEEV-MIFYACCESA-N 260.381 2.003 10 10 CECE C[C@H](CO)N(C)c1ccc(OCC(F)(F)F)cc1 2219566195 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2.341 10 10 CECE COc1ccc(N(C)[C@@H]2COCC[C@H]2C)c(CN)c1 2227679667 MLLCDIJUHBDHGD-IAQYHMDHSA-N 264.369 2.015 10 10 CECE Nc1ccc(OC[C@H](O)CO[C@H]2C[C@H]3CC[C@H]2C3)cc1 2240670045 DNVPYDGMUKOHPQ-DUPGQFARSA-N 277.364 2.214 10 10 CECE CSc1ncc(CN[C@H](C)[C@@]2(C)CCN2)s1 2243813217 XBSPLUZEVLPCEG-LDYMZIIASA-N 257.428 2.095 10 10 CECE CC(C)[C@H]1C[C@@H]1NCc1ccc(N2CCNCC2)cc1 2286069520 ZIRRFWKKWUWNBY-SJORKVTESA-N 273.424 2.230 10 10 CECE [N-]=[N+]=NCCNC1(C(=O)O)CCC2(CCS2)CC1 2260043422 LBRNYDKBNDDYAF-UHFFFAOYSA-N 270.358 2.159 10 10 CECE CNCc1ccc(N(C)Cc2ccnnc2C)cc1 2274303739 IBMYVYWIRFRFFD-UHFFFAOYSA-N 256.353 2.141 10 10 CECE CC1(C)CCC(C)(C)[C@](NCCN=[N+]=[N-])(C(N)=O)C1 2274486381 XTWNHWTULFTSEG-CYBMUJFWSA-N 267.377 2.347 10 10 CECE Cc1ccc(CN2CCC[C@@](F)(C(=O)O)C2)c(O)c1 2265807897 HZALBYLKZYCPCQ-AWEZNQCLSA-N 267.300 2.089 10 10 CECE COc1c(F)cc(N2CCN[C@@H](C(C)C)C2)cc1F 2268033854 AWNRDQCEUUFXMQ-CYBMUJFWSA-N 270.323 2.408 10 10 CECE Cc1cc(N(C)CC(=O)NC(C)C)ccc1[C@H](C)O 2269677732 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2.404 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)C(F)(F)[C@@H]1CCOC1 2333612956 GRAKVFJIZFFHAT-HLTSFMKQSA-N 274.271 2.006 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC[C@@H]3C[C@H]2CO3)c1 2334121742 AVVALRKQJHYKTP-IACUBPJLSA-N 263.337 2.058 10 10 CECE OC[C@]12C[C@H](CCN1c1ccc3c(c1)CC[C@@H]3O)C2 2336575445 UOQKKVCOTVASTL-KNXALSJPSA-N 259.349 2.017 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc(CNC)c(C)c1 2336753186 IGEJUJMWTXUQEU-HZPDHXFCSA-N 262.397 2.454 10 10 CECE CC(=CCNC(=O)COc1ccc(N)cc1)C1CC1 2336880154 RXRPSHGLVRFTTG-UHFFFAOYSA-N 260.337 2.120 10 10 CECE Cc1c([C@H](C)O)ccc(N2C[C@@H]3C[C@H](C2)[C@H]3O)c1C 2341067100 MNTXXJSCKZPDJE-JFILPPLUSA-N 261.365 2.174 10 10 CECE COc1cc(Cl)c(N2CCCC23CNC3)c(OC)c1 2342435515 YEYHMOHDKLQPGE-UHFFFAOYSA-N 282.771 2.299 10 10 CECE C[C@H](NC[C@]1(O)CCCSC1)c1ccc(O)cc1O 2343695440 XPQIIVDNTVDDRE-IINYFYTJSA-N 283.393 2.007 10 10 CECE C[C@@H](CN(C)C)N(C)c1c(F)cc([C@@H](C)N)cc1F 2351754100 ICUAFOPYMFRJLI-VHSXEESVSA-N 271.355 2.371 10 10 CECE Cc1cc(N(C)C[C@@H]2O[C@H]3CC[C@H]2C3)ccc1CO 2352644336 ZFZFCHKGURDJNI-RCBQFDQVSA-N 261.365 2.491 10 10 CECE CN1CCCc2cc([C@H](O)[C@@]3(N)CC[C@@H]4C[C@@H]43)ccc21 2354747734 WXXTYDHELKFADL-RNCIANSQSA-N 272.392 2.230 10 10 CECE O=[N+]([O-])c1ccc(O)c(CN2CC[C@H]3OCCC[C@@H]3C2)c1 178072592 OFFKAUHISNHAPA-IAQYHMDHSA-N 292.335 2.301 10 10 CECE COc1cccc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)c1 20237011 RSAMSDMLBHQSIX-PPDFBGJRSA-N 283.287 2.146 10 10 CECE CNCc1ccc(OC)c(CN(C)CC2CCOCC2)c1 111161497 IESUAHYFAFFOER-UHFFFAOYSA-N 292.423 2.273 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@H]1CC(C)=C[C@H](C)C1 300078424 KMKYOXIYXXVSKG-MVWJERBFSA-N 266.345 2.420 10 10 CECE Oc1c(Br)c(F)cc(F)c1[C@@H]1COCCN1 309398526 RRKYJWGFHMGTDW-ZETCQYMHSA-N 294.095 2.094 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC[C@H]2C=C[C@@H]1C2 2357579462 HYBWAEZHOTVZGN-YWPYICTPSA-N 271.364 2.246 10 10 CECE Cc1cc(Cl)cc(CN2CCO[C@@]3(CCOC3)C2)c1O 187536047 XWDKPWYKKCEYHZ-HNNXBMFYSA-N 297.782 2.345 10 10 CECE Cc1ccc(O)c([C@H](C)NCCc2cn(C)cn2)c1 313261424 AKKSTXTUCBUJSK-LBPRGKRZSA-N 259.353 2.327 10 10 CECE COc1ccc(N(C)C[C@@H](O)C(F)(F)F)cc1F 121476386 IYWUKPJYVODSKT-SNVBAGLBSA-N 267.222 2.194 10 10 CECE CCN(CC)c1ccc([C@@H](N)CCCC(=O)O)c(O)c1 1951650494 MKXCKKZJJMWZPY-ZDUSSCGKSA-N 280.368 2.493 10 10 CECE Cc1cccnc1/C=C/C(=O)NCCc1ccc(O)c(O)c1 183973289 XJTZSBQFJQFSIJ-FNORWQNLSA-N 298.342 2.173 10 10 CECE Cc1ccc([C@](C)(N)C(=O)OC(C)(C)C)c(O)c1 1951737238 GDFLHDZCQKGEDH-AWEZNQCLSA-N 251.326 2.216 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@]3(CC[C@@H]3O)C2)cc1 2129547417 BRNCLSQQTHJZCL-KCXAZCMYSA-N 260.381 2.448 10 10 CECE CCC(C)(C)NC(=O)CN(c1ccc(CN)cc1)C1CC1 49281675 GLBGOEWYEWDXDA-UHFFFAOYSA-N 289.423 2.419 10 10 CECE c1csc(SCCCNCc2csnn2)n1 133292182 YJLJSWVVYCQATB-UHFFFAOYSA-N 272.424 2.267 10 10 CECE C[C@@H](C(=O)O)N(C)[C@@H](C)c1ccc(N(C)C)cc1 86756491 FRRMLAULIMZQTL-QWRGUYRKSA-N 250.342 2.219 10 10 CECE Nc1ccc(-n2ccc(C(=O)N3C[C@H]4CC[C@@H]3C4)n2)cc1 49715799 ROECCRRQGOSWEY-SMDDNHRTSA-N 282.347 2.079 10 10 CECE CC(C)[C@@H]1CC[C@@H](C)C[C@@]1(NCCN=[N+]=[N-])C(N)=O 90257830 KBRFKAOYYPDULJ-MDZLAQPJSA-N 267.377 2.203 10 10 CECE CCCOc1cc(N2C[C@@H]3CNC[C@H]3C2)ccc1[N+](=O)[O-] 90322751 AHYBRQYUWNCQBP-RYUDHWBXSA-N 291.351 2.039 10 10 CECE CN(C[C@@H]1CCCN1C)c1ccc(/C=C/C(=O)O)cc1 92633311 AQNXHZSEEHKLGV-VSGCLNPGSA-N 274.364 2.315 10 10 CECE C[C@H](CNCc1cccc(Cl)c1O)CN(C)C 383743596 YJOXBWOZWSAVRY-SNVBAGLBSA-N 256.777 2.333 10 10 CECE CC[C@@H](O)[C@@H](N)c1cc(Cl)cc(Cl)c1O 95814974 WRGMYHVSOPVPGL-BDAKNGLRSA-N 250.125 2.470 10 10 CECE CCCCNC(=S)N(C(C)=O)c1ccc(N)cc1 243430776 MZBYJUKNYQVQDR-UHFFFAOYSA-N 265.382 2.296 10 10 CECE CC(=O)c1cccc(NC(=O)Cc2ccc(O)c(O)c2)c1 243311542 LHZKCTJWVOZSKS-UHFFFAOYSA-N 285.299 2.482 10 10 CECE CONCc1c(C)c(Br)cc(OC)c1O 258772452 XDEGHTCEOZSDIG-UHFFFAOYSA-N 276.130 2.123 10 10 CECE Cc1cc(N2C[C@H](CO)OC[C@H]2C)ccc1CNC(C)C 251047466 QOHKQCZCDNUSHZ-RHSMWYFYSA-N 292.423 2.079 10 10 CECE Nc1cc(-c2cc(Br)cc(O)c2O)on1 258488935 MEEWPBDWYUPLSD-UHFFFAOYSA-N 271.070 2.098 10 10 CECE CC(C)(C)OC(=O)N1CCc2cccc(O)c2[C@@H]1C(=O)O 259692796 JMTYMHSXZGFZFJ-GFCCVEGCSA-N 293.319 2.311 10 10 CECE C[C@H](NCc1cc(Br)ccc1O)[C@@H](C)O 389957031 UQVSPLJCGLDCLO-JGVFFNPUSA-N 274.158 2.014 10 10 CECE CC1(C)C[C@H]1CN1CCN(c2ccc(N)cc2)CC1 722608404 BYCZWUSNZRVECD-ZDUSSCGKSA-N 259.397 2.437 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2CC(CN)C3)c(OC)c1 2162629763 FXAVPHANXFXKTD-STQMWFEESA-N 276.380 2.410 10 10 CECE CN(c1ccc(CN)cc1)[C@H](C(=O)O)c1ccccc1 2162690462 LOXLIVSCMCOWNA-HNNXBMFYSA-N 270.332 2.407 10 10 CECE CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@H](O)C(F)F 294927516 BKGVJIQGWKBTEF-QWRKXWFKSA-N 289.322 2.456 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](CC(N)=O)C2)cc1Cl 723165417 XVKWWYDJVVSIJF-MNOVXSKESA-N 295.814 2.322 10 10 CECE CN1CCCc2cc([C@@H](C[C@@H]3CCCO3)NN)ccc21 2163102089 HPYOSYJQZJPVAV-LSDHHAIUSA-N 275.396 2.143 10 10 CECE NN[C@@H](c1ccc(N2CCCC2)cc1)C1CCOCC1 2163104010 AEKCLGFYVWFZSC-INIZCTEOSA-N 275.396 2.218 10 10 CECE CCN(CC)c1ccc([C@@](C)(N)c2nccn2C)cc1 2163114208 TZMADQVEYBWCLV-MRXNPFEDSA-N 272.396 2.489 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H]1C[C@]12CCOC2 2163129953 CIPTUYHFXJJJJZ-UAGQMJEPSA-N 272.392 2.366 10 10 CECE C[C@H]1CCN1c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 706818119 LIXCKLCAGIXPJZ-SGRBOOSSSA-N 262.265 2.291 10 10 CECE CN1CCCc2cc([C@H](O)[C@]34CNC[C@]3(C)C4)ccc21 2165500311 VLJBPUNARAITKG-ULQDDVLXSA-N 272.392 2.102 10 10 CECE CO[C@@H](C)CCN(C)c1ccc(OCCN(C)C)cc1 2165542700 NERKXYRLGCAFMS-AWEZNQCLSA-N 280.412 2.488 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@@H]3COC[C@H]32)cc1Cl 2129733234 XTESRNOVGCQPRH-ZWNOBZJWSA-N 279.723 2.273 10 10 CECE COc1ccc(N2CC[C@@H](CN[C@@H]3CCCOC3)C2)cc1 818345975 ZAINXKFDDBOAJX-LSDHHAIUSA-N 290.407 2.290 10 10 CECE OC[C@@H]1CCC[C@H](c2ccc(Br)cc2O)N1 713743592 PXJHKAGMPBJQNI-GXSJLCMTSA-N 286.169 2.330 10 10 CECE CC[C@@H]1COC[C@H]1N(C)c1ccc(CNC)cc1F 711202340 MDQRDBWARJPYHM-IUODEOHRSA-N 266.360 2.406 10 10 CECE COc1ccc(O)c(CN[C@H]2CC[C@H](C(=O)O)CC2)c1 710002424 ZKLHRVAEBHKJPE-UMSPYCQHSA-N 279.336 2.134 10 10 CECE CCOc1ccc(O)c(CN2CC[C@@H](CO)[C@H]2CC)c1 824636527 RPRDIJPATWRPTN-SWLSCSKDSA-N 279.380 2.384 10 10 CECE CCN(CC)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1 825327481 SMOQPZRQORXEKD-MRXNPFEDSA-N 290.407 2.310 10 10 CECE CCN(C(=O)C[C@H]1CC[C@@H]1OC)c1ccc(N)cc1 2130373743 AZRQDAIQWQAOIC-RISCZKNCSA-N 262.353 2.437 10 10 CECE CCNC(=O)CN(CC)c1ccc([C@H](C)N)c(Cl)c1 723189063 WOUVPGASWLFSFC-JTQLQIEISA-N 283.803 2.322 10 10 CECE Oc1cccc(F)c1CNCc1ccn(C2CC2)n1 2130301498 XBOICGJEQKWAAV-UHFFFAOYSA-N 261.300 2.353 10 10 CECE CN(C)c1ccc(/C=C/CNCCCN2CCC2)cc1 848543568 HEMUNGNKHVFUNW-ZZXKWVIFSA-N 273.424 2.451 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCCCNC1 841091387 WRRGZIGDHTZJGS-NSHDSACASA-N 254.761 2.277 10 10 CECE CC(C)(F)CCNC(=O)NCc1c(O)cccc1F 923271209 HNDMCCKOTFEGQS-UHFFFAOYSA-N 272.295 2.469 10 10 CECE COc1ccc(O)c([C@@H](C)N(C)[C@H]2C[C@@H](C(=O)O)C2)c1 693049710 BKZLGUQZBHBTMP-MXWKQRLJSA-N 279.336 2.257 10 10 CECE CCc1nn(C)c(C[C@@H](O)Cc2ccc(N)cc2)c1Cl 696581242 VTBIOIFYSIJTNC-LBPRGKRZSA-N 293.798 2.364 10 10 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Cn1c(Cl)cnc1CNCc1ccc(F)c(F)c1O 703257268 OBELYDRAEVWIOA-UHFFFAOYSA-N 287.697 2.347 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CCCC[C@@H]43)ccc2[C@@H]1O 706822948 MGBOOVVUGCWONR-HERUPUMHSA-N 258.321 2.051 10 10 CECE CC[C@]1(C)COCCN1c1c(F)cc(CN)cc1F 687982484 YVWGIZOPCIGYFV-CQSZACIVSA-N 270.323 2.429 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](C)c2cnn(C)c2)cc1O 710526880 VCNVSICZRGYGSO-GHMZBOCLSA-N 275.352 2.376 10 10 CECE CC(C)[C@H]1NC(=O)N(c2ccc(N)cc2)C(=O)C1(C)C 713045019 RYBMJWUOYPSDGJ-GFCCVEGCSA-N 275.352 2.376 10 10 CECE Nc1ccc(CC(=O)OC[C@@H]2CC[C@@H](C3CC3)O2)cc1 715412130 GGCKPCWVJAZJPS-GJZGRUSLSA-N 275.348 2.312 10 10 CECE C[C@H](NCC12CCN(CC1)C2)c1ccc(F)cc1O 715619903 JKDZMHQZHDKOFF-NSHDSACASA-N 264.344 2.278 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)NCCc1ccc(N)cc1 716478737 WJHMSZVSWODTTA-AQNFWKISSA-N 258.365 2.220 10 10 CECE COc1ccc([C@H](C)NCc2n[nH]cc2C)c(O)c1 716481730 HHMWUVGIGZPXPX-JTQLQIEISA-N 261.325 2.283 10 10 CECE CCN(c1ccc([C@H](C)N)cc1F)C(C)(C)CO 688445944 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OQNZQFYVBLSYLG-UHFFFAOYSA-N 267.332 2.336 10 10 CECE CCN(CCCCO)c1ccc(CO)cc1Cl 1996953225 JPRKSPSWVQQUJS-UHFFFAOYSA-N 257.761 2.431 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3CCC[C@@H](O)[C@H]3C2)c(F)c1 2150979994 YMLUICRPNXLAIF-QOFRNUMZSA-N 279.355 2.476 10 10 CECE CNCc1ccc(OC)c(COC[C@H]2OCC[C@H]2C)c1 2152442468 ZLHITRFKPGHUKC-MLGOLLRUSA-N 279.380 2.356 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@H]2CN(C)C)cc1Cl 2153251409 MDMGSYUVPXACQC-WCQYABFASA-N 297.830 2.127 10 10 CECE CC12CCC(CC1)N2c1cc2c(cc1F)[C@H](O)C(=O)N2 2153608502 XCHVYJIAFVLVQV-KYAFNEOASA-N 276.311 2.333 10 10 CECE Cc1ccc(-n2nc(-c3ccoc3C)cc2N)nn1 49961153 GMHPMADBJVHDNO-UHFFFAOYSA-N 255.281 2.121 10 10 CECE CCN(C)[C@H]1CCN([C@H](C)c2ccc(OC)cc2O)C1 2153955364 ITRFHTOJMJELBE-OLZOCXBDSA-N 278.396 2.488 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)C2(C)C)cc1Cl 2023138266 BIUGUVJTKSUSSC-PELKAZGASA-N 255.745 2.353 10 10 CECE COc1cc(N(C)CP(C)(C)=O)ccc1CN 2024764036 DIGQRWJOXWBQNC-UHFFFAOYSA-N 256.286 2.170 10 10 CECE C[C@@H]1[C@@H]2CNC[C@@H]2CN1Cc1ccc(Cl)cc1O 2029649012 RGHQZSCRSPJEAU-XWIASGKRSA-N 266.772 2.085 10 10 CECE CNCc1ccc(N2C[C@@H](F)[C@H](OC)C2)cc1Cl 2029810001 ACVIAKKQFBADRB-CHWSQXEVSA-N 272.751 2.233 10 10 CECE C[C@@H](CN1CCOCC1)CN1CCC[C@@H](N=[N+]=[N-])CC1 2155553270 DYPYWLHRIHMZHY-ZIAGYGMSSA-N 281.404 2.120 10 10 CECE Oc1ccc(CN[C@H]2CCC[C@H](F)C2)c(O)c1O 2034890012 BRHZYOOMORZLKF-UWVGGRQHSA-N 255.289 2.174 10 10 CECE CC[C@@H](CCNCc1cccc(O)c1O)COC 2034911854 VMIUZUXIJNDGQR-NSHDSACASA-N 253.342 2.250 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCCC[C@H]2OC)cc1 300267727 LAPXTZOKJXGENU-HZPDHXFCSA-N 278.396 2.418 10 10 CECE CC[C@@H]1CN(C)CCCN1c1ccc(CN)cc1F 300541386 QWLOMVIDWZIBJC-CYBMUJFWSA-N 265.376 2.205 10 10 CECE C[C@H]1C[C@@H](CCNCc2cccc(O)c2O)CO1 2041486843 OVCFKABFCBDISA-WDEREUQCSA-N 251.326 2.003 10 10 CECE N[C@@H]1CN(Cc2ccc(Cl)cc2O)[C@]2(CCCOC2)C1 2156306225 NGPLBVFXBQNZIY-DZGCQCFKSA-N 296.798 2.128 10 10 CECE C[C@H](N)c1ccc(N2CCC(CCO)CC2)c(F)c1 401145012 UTAALBDJSAHHEA-NSHDSACASA-N 266.360 2.444 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@H]1CCCOC1 401602973 FMJQXQOVPAPJCM-JTQLQIEISA-N 256.296 2.039 10 10 CECE CCN1CCC[C@H](N(C)c2ccc([C@@H](C)N)c(O)c2)C1 2158741498 OHETYBRJAUVXOY-OCCSQVGLSA-N 277.412 2.332 10 10 CECE CCCN(Cc1cc(OC)ccc1O)[C@@H]1CCOC1 312079275 SASVSHRXAAJPJO-CYBMUJFWSA-N 265.353 2.402 10 10 CECE CC(C)N(CCOCCO)c1ccc([C@@H](C)N)cc1F 312916250 VRBGJFZYWCJJLW-GFCCVEGCSA-N 284.375 2.069 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC1COCCOC1 313210654 PGPNWTCMLUUCJA-DGCLKSJQSA-N 277.364 2.254 10 10 CECE COCCOC[C@@H]1CCN(c2ccc(CO)c(Cl)c2)C1 2159089171 OQXZDBJSYGWEHH-GFCCVEGCSA-N 299.798 2.322 10 10 CECE O=[S@]1CCCN(Cc2c(O)cccc2Cl)CC1 321926188 ROAJYYKQMDWIGK-KRWDZBQOSA-N 273.785 2.000 10 10 CECE Oc1c(CNCC[C@H]2CCCO2)ccc(F)c1F 700764428 IYLVNCZAELLUAC-SNVBAGLBSA-N 257.280 2.329 10 10 CECE CCC[C@@H]1CN(c2ccc(OC)cc2OC)CCN1 86123898 QACODAZVFDJXEB-GFCCVEGCSA-N 264.369 2.282 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCS(=O)(=O)[C@H](C)[C@@H]2C)c1 2170446641 PRQWUAAMWCRYKJ-RWMBFGLXSA-N 297.420 2.269 10 10 CECE CC[C@@H]1CN([C@H](C)c2c(O)cccc2O)C[C@H]1N(C)C 2170466327 FUNRYARDCFXATD-JHJVBQTASA-N 278.396 2.431 10 10 CECE [N-]=[N+]=NCCN[C@@](C(N)=O)(c1ccc(Cl)cc1)C1CC1 90257855 QJGURUDFVSDGGT-CYBMUJFWSA-N 293.758 2.331 10 10 CECE C[C@@H]1O[C@H](C)[C@@H](CN(C)Cc2cc(N)ccc2O)[C@H]1C 701272742 AHNFYKWAIRGXGL-OHTBPHCPSA-N 278.396 2.466 10 10 CECE COc1cccc([N+](=O)[O-])c1C(=O)NCCCN=[N+]=[N-] 701319499 QODVXCJBVMYDDD-UHFFFAOYSA-N 279.256 2.034 10 10 CECE CC[C@@H](N)c1ccc(N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O)cc1 2170628862 AQVSPRCUNQGZKQ-YWPYICTPSA-N 298.452 2.354 10 10 CECE Cc1cn(C)nc1NCc1ccc(F)c(F)c1O 703326657 DPAGRWKRQRVQOZ-UHFFFAOYSA-N 253.252 2.324 10 10 CECE CC1(C)CC[C@@H](CO)N(CCc2ccc(N)cc2)C1 706178862 VHNGUSUXWLRYFQ-HNNXBMFYSA-N 262.397 2.294 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC34CCCC4)ccc21 707675914 JBCJCERVKFZFJV-ZDUSSCGKSA-N 257.337 2.161 10 10 CECE O=C1Nc2cc(N3CCCC[C@H]3C3CC3)ccc2[C@@H]1O 2171562613 SUQYFVBVNMXSQJ-GJZGRUSLSA-N 272.348 2.441 10 10 CECE CC[C@H](N[C@@H](C)c1cn(C)nn1)c1ccccc1O 720538153 AJQHNPDGHPQTHO-JQWIXIFHSA-N 260.341 2.323 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@H]2CCN(C)C[C@@H]2C1 383349435 ZKKHNYHXABDCFU-FRRDWIJNSA-N 276.380 2.042 10 10 CECE COc1cc(Cl)cc(CNCc2n[nH]cc2C)c1O 716491467 AYRLTBUZHHLKLK-UHFFFAOYSA-N 281.743 2.376 10 10 CECE CNCc1ccc(N2C[C@@H](O)C[C@H]2C)c(Br)c1 384788024 QYSUCNYKBHAQBU-KOLCDFICSA-N 299.212 2.128 10 10 CECE CC(C)C[C@@H]1C[C@@H]1NC(=O)COc1ccc(N)cc1 385317316 PRAIPQUSVBIZMC-RISCZKNCSA-N 262.353 2.198 10 10 CECE N[C@@H]1CC[C@@H]2CN(Cc3cc(Cl)ccc3O)C[C@H]21 386286050 GBVUBAHRDXMXSF-OASPWFOLSA-N 266.772 2.215 10 10 CECE Cc1cc(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)ccc1CO 718303011 CSTPKEOUQFPKGO-CAOSSQGBSA-N 259.349 2.101 10 10 CECE CN(C)c1ccc([C@@H](N)[C@]2(O)CCCOC2(C)C)cc1 2163134662 BLMLMMYXWFJTIB-GDBMZVCRSA-N 278.396 2.073 10 10 CECE CCN1CC[C@@H](NCc2cccc(Br)c2O)C1 389250563 MQPPCQFCQOYIMS-LLVKDONJSA-N 299.212 2.339 10 10 CECE Cc1ccc([C@H](C)N(C)[C@@H](C)C[S@@](C)=O)c(O)c1 399880469 SVLPSVXJPUCAFC-OAVHHTNSSA-N 269.410 2.460 10 10 CECE CN(C(=O)CN1CCC[C@H]1CN=[N+]=[N-])c1ccccc1 2179616849 QAJDKLUFWPNTDV-ZDUSSCGKSA-N 273.340 2.424 10 10 CECE Cc1ccc(O)c([C@H](C)n2ncc(CN(C)C)c2O)c1 2070566707 XZWGAKJKEMRFTE-NSHDSACASA-N 275.352 2.274 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](O)CCC23CCC3)cc1O 2174535052 LYUIODODGILJPF-WCQYABFASA-N 276.380 2.296 10 10 CECE CNCc1ccc(N2C[C@H](CCO)O[C@H](C)C2)c(Cl)c1 2179387165 MDUJZGFIUOBYFK-YPMHNXCESA-N 298.814 2.036 10 10 CECE CN1C[C@H](O)c2cccc(O)c2[C@@H]1c1cccc(O)c1 2080550472 RCAIMTUXFNJRGP-HOCLYGCPSA-N 271.316 2.166 10 10 CECE COc1ccc(N(Cc2ccnn2C)C(C)C)c(N)c1 2170036253 DXJXWFLNHYARBU-UHFFFAOYSA-N 274.368 2.426 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](O)[C@H]3CC[C@H]32)c(F)c1 2194697221 LPGLFWGVZDSKPF-HUJUBCJISA-N 282.334 2.334 10 10 CECE CC(C)O[C@@]1(CN(C)c2ccc(CO)cc2)CCOC1 2188195966 MVVIJJJRXYUSBO-MRXNPFEDSA-N 279.380 2.199 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2ccn3cnnc3c2)CC1 2188209772 KHTMPLDLEZFFQA-GFCCVEGCSA-N 271.328 2.394 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@H](O)c1ccccn1 2091876290 ZFTQBBGATCLQNX-GJZGRUSLSA-N 258.321 2.171 10 10 CECE CC[C@@](C)(CC(=O)N[C@H](C)c1ccccc1O)C(=O)O 2192617976 PGKZGHGDHZSTFD-BMIGLBTASA-N 279.336 2.460 10 10 CECE C[C@@H](NC(=O)[C@@H]1CCNC12CCC2)c1ccccc1O 2192623836 DCNXTTSXXRPGDU-YPMHNXCESA-N 274.364 2.102 10 10 CECE Nc1ccc(CCCN[C@@H]2C[C@H]3[C@@H]2[C@H]2CC[C@H]3O2)cc1 2188740225 PQXILNFGHVIQSS-HHARLNAUSA-N 272.392 2.357 10 10 CECE O=C(O)C=Cc1ccc(N2CCOC[C@H]2CF)c(F)c1 2182598958 LMUKUDVGMRMJTG-LLVKDONJSA-N 283.274 2.098 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC2(C1)CS(=N)(=O)C2 2182736996 BFDIRZRGZCZHFX-GFCCVEGCSA-N 293.436 2.176 10 10 CECE CCCNC(=O)[C@@H](C)N(C)Cc1ccc(N(C)C)cc1 2195527104 VBNFMFMZQYZEBU-CYBMUJFWSA-N 277.412 2.099 10 10 CECE CCNCc1ccc(N(C)[C@@H]2CCC(=O)NC2)c(Cl)c1 2183454197 MDOBWMREQGTHOK-GFCCVEGCSA-N 295.814 2.164 10 10 CECE C[C@@H](CN(C)C(=O)CCOc1ccc(N)cc1)C(F)F 2183947532 KDUDGODKAFYVJD-JTQLQIEISA-N 286.322 2.397 10 10 CECE C[C@H](N[C@H]1C[C@@H](n2ccnc2)C1)c1c(O)cccc1O 2184164937 OKSBFRNCCHYDSN-SDDRHHMPSA-N 273.336 2.349 10 10 CECE COc1ccc(N2CC[C@H](N)C(F)(F)CC2)cc1 2044313701 TYPHEOPEUWIPGB-LBPRGKRZSA-N 256.296 2.258 10 10 CECE COc1ccc(N2CCC[C@@H](N)[C@H]2C)c(OC)c1 2044330555 MAIBGCFGWIHXEN-ZYHUDNBSSA-N 250.342 2.020 10 10 CECE Oc1ccc(CNCCOCCC2CC2)cc1O 2047217666 LDQRRAVYYKSJLM-UHFFFAOYSA-N 251.326 2.004 10 10 CECE Cc1ncc(CN(C)c2ccc3c(c2)CC[C@H]3N)n1C 2184739352 FSVJDYKAWDWTLC-MRXNPFEDSA-N 270.380 2.311 10 10 CECE CN[C@H]1CCc2cc(N3CCOC[C@H]3C(F)F)ccc21 2184724915 AAGADMXZVZNDPI-KBPBESRZSA-N 282.334 2.364 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@]4(CCC[C@H]4O)C3)ccc21 2184723930 SQKPZTAZOGQUBS-BRWVUGGUSA-N 272.392 2.374 10 10 CECE Oc1cccc(CNC[C@H]2C[C@H](n3cccn3)C2)c1O 2184862010 QXEKFWCJGHTSDD-AULYBMBSSA-N 273.336 2.035 10 10 CECE CC[C@@H](N)c1ccc(N2CC[S@](=O)C[C@H]2C)cc1 2051909318 BMVZLIZDWQCESK-OMPKRAJASA-N 266.410 2.054 10 10 CECE C[C@@H]1C[C@@H](CO)CCN1c1ccc(CO)c(Cl)c1 2052357750 ZJLTYFOVZBHDCY-MNOVXSKESA-N 269.772 2.430 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](N(C)Cc3cc(N)ccc3O)[C@@H]2C1 2190526749 UQRKGUHHUUNNKB-JUDXGUMMSA-N 276.380 2.220 10 10 CECE CCNCc1ccc(N(C)[C@H]2C[C@H](O)C2)cc1Cl 2058952206 HMIPVDGDVSIIGA-JOCQHMNTSA-N 268.788 2.409 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H](C)NC(=O)C2(C)C)cc1 2186204137 UCQZWZCXMRUSFT-BXUZGUMPSA-N 275.396 2.200 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H](N)c2ccc(F)cn2)cc1 2191148803 SPYHEOHOSOCZHE-HUUCEWRRSA-N 275.327 2.020 10 10 CECE CCCN(C(=O)[C@]12CCOC[C@@H]1C2)c1ccc(N)cc1 2194357619 VOMKLGWMUWUNLQ-LRDDRELGSA-N 274.364 2.438 10 10 CECE COC[C@H]1C[C@@H]1CNCc1cc(F)cc(F)c1O 2069651918 XOHLXOJLXGKBGQ-PSASIEDQSA-N 257.280 2.043 10 10 CECE Nc1ccc(CNC(=O)c2ccn(C3CCC3)n2)cc1 2186779834 YTUUZFHGWIREGT-UHFFFAOYSA-N 270.336 2.120 10 10 CECE O=C(NOC1CCCCC1)c1ccc(O)c(O)c1 2072975094 JNINKGXOKRTOOB-UHFFFAOYSA-N 251.282 2.092 10 10 CECE CC[C@H](O)CN(C)c1c(F)cc([C@H](C)O)cc1F 2074083260 ROSNSKNGLYRPGK-WPRPVWTQSA-N 259.296 2.225 10 10 CECE Cc1ccc(O)c(CN[C@H]([C@@H](C)O)C(F)(F)F)c1 2074729267 OTUADHNXVFJNGS-LDYMZIIASA-N 263.259 2.102 10 10 CECE Fc1cc(CNC2CC2)ccc1N1CC[C@H]2COC[C@@H]21 2198567466 DBESFUKEQGOFCI-LRDDRELGSA-N 276.355 2.303 10 10 CECE CN(C[C@@H]1C[C@]12CCOC2)c1ccc(CO)cc1F 2100523576 LWRUXCXZXBBJDX-WFASDCNBSA-N 265.328 2.181 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1cccnn1 2101019039 MDRFRFYKXCKPCJ-HNNXBMFYSA-N 256.353 2.242 10 10 CECE COc1ccc(N2C[C@@H](C)N[C@H](C)C2)c(F)c1F 2081859835 CKUVKUPHEVCOIN-RKDXNWHRSA-N 256.296 2.160 10 10 CECE CC(C)C(=O)NCCCNCc1cccc(Cl)c1O 2102499220 BMKANXOLGFQSPX-UHFFFAOYSA-N 284.787 2.298 10 10 CECE CCN(c1ccc(CN)c(OC)c1)[C@@H]1CCSC1 2084017878 UKESOUQXTFKLNU-CYBMUJFWSA-N 266.410 2.486 10 10 CECE CO[C@H]1CC[C@H](NC(=O)Nc2ccc(N)cc2)CC1 2104405654 KYZWBRMUJVVSDJ-JOCQHMNTSA-N 263.341 2.348 10 10 CECE C[C@@H]1CN[C@H]([C@@H](O)c2ccc(N(C)C)cc2)[C@H](C)C1 2106804445 BQGHLJRAEMTOKA-VZAMPYOESA-N 262.397 2.420 10 10 CECE CC1([C@H](N)[C@H](O)c2ccc(N3CCCC3)cc2)CC1 2106821421 UWDGLEQUJURKNT-HUUCEWRRSA-N 260.381 2.448 10 10 CECE CN(C)c1ccc([C@H](N)[C@@](C)(O)[C@@H]2CCSC2)cc1 2106855480 OQZREPHXYKJCTH-SNPRPXQTSA-N 280.437 2.257 10 10 CECE C[C@@H](CN)CC[C@H](O)c1ccc2c(c1)CCCN2C 2106831090 NCERWPHNCYXOAR-WBMJQRKESA-N 262.397 2.477 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2C[C@@H]3COC[C@H]32)c1 2087580497 VOJDCKUUOXRKQY-GZZJDILISA-N 263.337 2.086 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)c1nncs1 2107894729 QQVDQWALPMZZPC-CYBMUJFWSA-N 274.393 2.229 10 10 CECE Cc1cc(N2[C@H](CO)C[C@H]3CCC[C@H]32)ccc1CO 2108391036 GTGUVVPHNHMRLV-UHOFOFEASA-N 261.365 2.227 10 10 CECE CCO[C@@H](C)Oc1ccc(N2CCCNCC2)cc1 2088450985 STKVFOQKARQWQG-CYBMUJFWSA-N 264.369 2.248 10 10 CECE CCCN(CCC(=O)O)Cc1ccc(OC)cc1O 2088874873 OSUVVMLNWPFRGM-UHFFFAOYSA-N 267.325 2.088 10 10 CECE C[C@H](c1ccccc1O)N(C)S(=O)(=O)c1cc[nH]c1 2089619087 UJEUHFRBXPNBQN-SNVBAGLBSA-N 280.349 2.102 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@@H]2CC3(CC3)CO2)CC1 2110152230 XSSRMEDOQXTECJ-QWRGUYRKSA-N 264.329 2.247 10 10 CECE COc1ccc(O)c([C@@H](C)NCCCC[S@](C)=O)c1 2110339893 OSCUAEOVPWLQNX-WYRIXSBYSA-N 285.409 2.210 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)c1cnsn1 2110824777 FIQSNEAFZJCKKW-OLZOCXBDSA-N 279.365 2.018 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@H]1CCC(F)(F)C1 2091865761 BFHPSBLIVGGRCN-BIMULSAOSA-N 271.307 2.449 10 10 CECE CC1(C)CCN(c2c(F)cc(CN)cc2F)CCO1 2092415353 LCBPDDXKVGBFGY-UHFFFAOYSA-N 270.323 2.429 10 10 CECE CC(=O)c1ccc(O)c(CN2CCOCC[C@@H]2C)c1 2092465521 FNWQPCDYQSAZGY-NSHDSACASA-N 263.337 2.206 10 10 CECE Oc1cccc(CN[C@]23CCCC[C@@H]2OCC3)c1O 2092698950 HDEVBMXBYGWKPI-ZFWWWQNUSA-N 263.337 2.289 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3[C@H](C2)[C@@H]3CO)cc1Cl 2093096735 AYCLKIDGMNOBEZ-IGJVIKARSA-N 280.799 2.424 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)[C@@H](O)C[C@@H]2C)cc1O 2093106591 ZHUMKOGNYHHYIC-RMIALFOJSA-N 264.369 2.008 10 10 CECE C[C@H]1CCO[C@@H]1CN(C)c1c(F)cc(CO)cc1F 2096107217 PMGWYRMJDPSRBA-TVQRCGJNSA-N 271.307 2.318 10 10 CECE Nc1cc2c(cc1N1CC[C@@H]1CC1CC1)OCCO2 2097780814 KCXRFOMFJJVWEZ-LLVKDONJSA-N 260.337 2.419 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)Cc2ccncc2)CC1 2099340959 HVCGABRJDFWFCG-GFCCVEGCSA-N 259.313 2.316 10 10 CECE C[C@H](C(=O)N1CCC[C@H](N=[N+]=[N-])CC1)[C@H]1CCCO1 2099332605 KXVFZLRRGLJNOI-SDDRHHMPSA-N 266.345 2.493 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CCCC(F)(F)C1 2112604052 KPZSIBYRLLWYMI-JTQLQIEISA-N 276.287 2.398 10 10 CECE CCCN1CCCN(c2ccc(CNC)cc2)CC1 2113701959 RLUJMRQOWMDEPZ-UHFFFAOYSA-N 261.413 2.328 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3[C@@H]4CCCO[C@@H]43)ccc21 2119950424 KEPINOVFNJZMBS-TUUVXOQKSA-N 259.349 2.137 10 10 CECE COc1cc(N(C)CC23CC(CCO2)C3)ccc1CO 2204558513 DKIWCBGJQVMZFY-UHFFFAOYSA-N 277.364 2.193 10 10 CECE COc1cc(N(C)CC[C@@H]2CCO[C@H]2C)ccc1CN 2204558458 COHGONFVLINYQT-QWHCGFSZSA-N 278.396 2.405 10 10 CECE Oc1cc(F)ccc1CNCc1noc(C(F)(F)F)n1 2204747900 WLTSDZRFKJJJHP-UHFFFAOYSA-N 291.204 2.223 10 10 CECE CN1CCc2cc(CN3CC[C@@H](C(C)(C)N)C3)ccc21 2204746409 GISNTRBGQSEDSA-OAHLLOKOSA-N 273.424 2.238 10 10 CECE Oc1cccc(CNC[C@@H]2C[C@@H]3COC[C@@H](C3)C2)c1O 2206872595 MPWUHQGWSLNMLE-CLLJXQQHSA-N 277.364 2.250 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](CCO)C2)cc1C 2269662295 KYBSCAKAGJGSLM-UONOGXRCSA-N 262.397 2.484 10 10 CECE CON(C)CCCN[C@H](C)c1ccc(C)cc1O 2218695872 KPNKXSYDUVXBFN-GFCCVEGCSA-N 252.358 2.235 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H]2[C@H](CO)C[C@H]2C1 2232096276 ORWBOBMIRPWWBG-UNQGMJICSA-N 260.381 2.079 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@H]2COC[C@@H]2C1 2232098349 MVXAOMQVAWNZLZ-QEJZJMRPSA-N 260.381 2.487 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CCC[C@@H]2C(=O)O)CC1 2234172625 UNPTZTGBIOCNRP-MXWKQRLJSA-N 280.328 2.179 10 10 CECE C[C@@H]1C[C@H](C(=O)O)[C@H](C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2234171783 ONJCWCPSIHORLE-SSRBZLIGSA-N 280.328 2.081 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1cn2c(n1)CCCC2 2234173656 YSMCOZULZYPBDU-VHSXEESVSA-N 274.328 2.181 10 10 CECE NCc1ccc(N2C[C@@H](O)C[C@H](F)C2)c(C(F)(F)F)c1 2234672932 IWJPSPQDHCJZPC-UWVGGRQHSA-N 292.276 2.073 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C[C@H](F)C2)cc1Cl 2226315987 ZGWGXOVBXHMBIH-AAEUAGOBSA-N 286.778 2.359 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@H](O)C[C@H]3C2)cc1F 2226775115 LUTCXDSHQULRGN-GMXVVIOVSA-N 265.328 2.432 10 10 CECE CC1(C)CN(c2ccc3c(c2)COCC3)CC[C@@H]1O 2226712843 HVOXYMMLHHXXHJ-HNNXBMFYSA-N 261.365 2.357 10 10 CECE COc1ccc(N2CC[C@H](C(C)(C)O)C2)cc1OC 2226803764 DQURQIOKZZLDOB-NSHDSACASA-N 265.353 2.301 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCN3C)CC[C@H]1CO 2226806294 RTODHHOHHXDMGE-OCCSQVGLSA-N 260.381 2.134 10 10 CECE O[C@@H]1CCc2cc(N3CC(OC(F)(F)CF)C3)ccc21 2237643953 MPRRTWLNYBRCIE-CYBMUJFWSA-N 287.281 2.434 10 10 CECE Cc1cccc(S(=O)(=O)Nc2ccc(O)c(N)c2)c1 2227839183 WFOHTBHWNQNULJ-UHFFFAOYSA-N 278.333 2.084 10 10 CECE COc1cccc(CN(C)C[C@H](F)[C@H]2CCOC2)c1O 2238367799 OUGHRGKHFAHZMT-STQMWFEESA-N 283.343 2.207 10 10 CECE CC(C)NCc1ccc(N2CC=C[C@@H]2CN(C)C)cc1 2238696277 BGTYCIHUYYHTHJ-QGZVFWFLSA-N 273.424 2.491 10 10 CECE CCN(CCO)c1ccc(CNC2CCC2)c(OC)c1 2239999347 GTKRQPSFMCBVTH-UHFFFAOYSA-N 278.396 2.156 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@@H](N2CC=CC2)C1 2240759527 LQVOIQBNWRZUEA-GOEBONIOSA-N 271.408 2.465 10 10 CECE CSc1ncc(CN[C@@H]2C[C@H]3C[C@H]2C[C@@H]3N)s1 2248706423 XHGJYRCRGDNVOO-YKDSUIRESA-N 269.439 2.080 10 10 CECE COCCN(C[C@@H](C)O)c1ccc([C@H](C)O)c(Cl)c1 2272335650 ROYWPGGMBPUOBH-MNOVXSKESA-N 287.787 2.227 10 10 CECE Cc1ccc(F)c(C(=O)NCc2ccccc2O)n1 2265165944 NPFDCDYQGYISTH-UHFFFAOYSA-N 260.268 2.165 10 10 CECE Nc1ccc(CC(=O)c2ccn(C(F)(F)F)n2)cc1 2277852670 CFPDBCVHVRWYJI-UHFFFAOYSA-N 269.226 2.367 10 10 CECE COc1ccc(N(C)C[C@H](O)C2CC2)c(OC)c1C 2277991056 DHTWWXYMVUWQGY-ZDUSSCGKSA-N 265.353 2.219 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])[C@@H]1CC12CCC2 2268436153 AEIKLEMLTQWPEI-CMPLNLGQSA-N 266.345 2.398 10 10 CECE COC[C@]1(C)[C@@H]2C[C@H]2CN1CCc1ccc(N)cc1 2269254204 JAVORQAANAAMSP-NUEKZKHPSA-N 260.381 2.168 10 10 CECE Cc1cc(N(C)Cc2cnn(C)c2)ccc1[C@H](C)N 2269651073 HBSLFJWCPQBYRI-LBPRGKRZSA-N 258.369 2.385 10 10 CECE Cc1cc(N2CCC3(CC(O)C3)C2)ccc1[C@H](C)O 2269684844 CLZGFRXWLQJOPQ-YGONEPDPSA-N 261.365 2.400 10 10 CECE Cc1cc(N2CC[C@@H]3OCCO[C@@H]3C2)ccc1[C@H](C)N 2285127378 JPTRWPYCVHTENA-VBNZEHGJSA-N 276.380 2.009 10 10 CECE C[C@H](O)c1cc(F)c(N2CCn3cncc3C2)c(F)c1 2286543231 NXDAWLSTACOSIC-VIFPVBQESA-N 279.290 2.235 10 10 CECE CC[C@@H]1[C@H](O)CCN1Cc1cc(F)cc(C(C)=O)c1O 2288910831 YCCQZGSVQRBKAL-ZIAGYGMSSA-N 281.327 2.079 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@@H]3C[C@@H](O)[C@H]2C3)c1O 2296665264 HAYNOJUNNHDYAS-CUOATXAZSA-N 295.766 2.203 10 10 CECE Cc1nnccc1CN(C)c1ccc2c(c1)CC[C@@H]2N 2290049320 PLECXHMLSYKWBW-INIZCTEOSA-N 268.364 2.367 10 10 CECE Oc1ccc(Br)cc1CN[C@@H]1C[C@@H]2CO[C@H]1C2 2298560138 KZSWPDIQPFAEIC-KDDOJWQBSA-N 298.180 2.422 10 10 CECE C[C@H](O)c1ccc(N2CCOC[C@H](F)C2)c(F)c1 2315067319 LZRQAHLVJLKMDX-GXSJLCMTSA-N 257.280 2.054 10 10 CECE CCN(CCN=[N+]=[N-])Cc1nc(CC(C)C)no1 2315992898 SXIFTJFCIOKTCQ-UHFFFAOYSA-N 252.322 2.400 10 10 CECE Oc1cc2c(cc1O)CN(C[C@@H]1C[C@H]1CF)CC2 2318676137 ZKHDHRMSTFRVFD-QWRGUYRKSA-N 251.301 2.062 10 10 CECE Oc1cc(F)ccc1CN1CC[C@H]2CCCN[C@H]2C1 2336223414 SRMMDAAHDCBANN-RISCZKNCSA-N 264.344 2.105 10 10 CECE CC[C@@]1(C)[C@H](O)CCN1c1ccc2c(c1)CC[C@@H]2O 2336870749 GNQNHHXBHDLLRA-XHSDSOJGSA-N 261.365 2.406 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@@H]3C[C@H]3[C@@H]2CO)c1C 2341068935 JQZHHNPLFLXBSI-FIRUKDTASA-N 260.381 2.140 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1CCCC[C@@H]2C[C@@H]21 2342110453 HWIDRFRQXJBUPI-SUZMYJTESA-N 259.353 2.358 10 10 CECE COc1cc(Cl)c(N2CC(O)(C(F)F)C2)c(OC)c1 2342418097 WFWOUOHRTZRQPU-UHFFFAOYSA-N 293.697 2.173 10 10 CECE NC(=O)c1cccc(N)c1N[C@H](CC1CC1)C1CC1 2343640877 PVXDEOPFRVCEBV-CYBMUJFWSA-N 259.353 2.358 10 10 CECE CN[C@@](CSc1nccs1)(C(=O)O)[C@H]1CC12CCC2 2344987813 BDLUMCNQWANBOZ-TVQRCGJNSA-N 298.433 2.468 10 10 CECE CC(=O)N(C)C1CN(c2ccc([C@@H](C)N)c(Cl)c2)C1 2353534000 DKWKSMKDUJPYNR-SECBINFHSA-N 281.787 2.027 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@@H]2C[C@H]1C[C@H]2OC 2354478822 SFZWGIPLEKTKJS-GKSGUAPZSA-N 277.364 2.304 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@H]3[C@@H]2C[C@H]3O)c(F)c1 2355698180 HSGKMBAOKZESFM-UDNPPVAFSA-N 278.371 2.456 10 10 CECE Nc1ccc(CCNC(=O)c2cc(-c3ccco3)on2)cc1 22347199 ABEACDBECQTLDS-UHFFFAOYSA-N 297.314 2.489 10 10 CECE CCCCN(CC(N)=O)Cc1cc(Cl)cc(C)c1O 179768384 VKWVZTKBJIRURH-UHFFFAOYSA-N 284.787 2.441 10 10 CECE NC[C@@H](N)c1cc(C(F)(F)F)cc(Cl)c1O 309235104 ISACXYMJHMITRJ-SSDOTTSWSA-N 254.639 2.023 10 10 CECE COc1ccc(N2CCC[C@H]2C[C@@H](C)O)c(N)c1 302609475 KRLNAMKRUXDWAK-MNOVXSKESA-N 250.342 2.017 10 10 CECE Nc1ccc(Cn2nnnc2-c2cccs2)cc1 213323143 IOSLUVXZSKKIOE-UHFFFAOYSA-N 257.322 2.032 10 10 CECE CC(C)=C(F)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183427453 GWBQCRRNELYIFG-VIFPVBQESA-N 267.300 2.408 10 10 CECE CC(C)CNCc1ccc(N(C)[C@H](C)CO)c(F)c1 122657203 IHQNSDLNYFRUMA-GFCCVEGCSA-N 268.376 2.388 10 10 CECE Cc1cc(CN(C)[C@@H](C)C(=O)Nc2ccc(N)cc2)no1 36198669 LFCPOCRWGAEZLN-NSHDSACASA-N 288.351 2.024 10 10 CECE CC[C@@H](C)N1CCN(c2ccc(OC)cc2N)CC1 213399128 VNDVGCNXQYRLKT-GFCCVEGCSA-N 263.385 2.198 10 10 CECE Nc1ccc(OCc2nc([C@@H]3C[C@H]4CC[C@@H]3O4)no2)cc1 70427663 RVAORIYOVPDLFX-UPJWGTAASA-N 287.319 2.266 10 10 CECE CNCC[C@H]1CCN(c2ccc(OC)cc2OC)C1 76368803 DOLZNXXFUGJQLG-LBPRGKRZSA-N 264.369 2.140 10 10 CECE COc1ccc(N2CCCC2)cc1NC(=O)[C@H]1CCCO1 41372812 DXMHWSQCENVACV-OAHLLOKOSA-N 290.363 2.413 10 10 CECE CCOC(=O)[C@H](NCC1CC1)c1cc(F)ccc1O 233706857 SNFYFHUSMXXSOF-CYBMUJFWSA-N 267.300 2.135 10 10 CECE COc1cc2c(c(OC)c1)N1CC(C)(C)NC[C@@H]1CC2 527419831 GRKPRWVQAFIEME-LBPRGKRZSA-N 276.380 2.207 10 10 CECE NC1(c2c(O)c(O)cc(F)c2Br)CCC1 258584257 MIKTVWWEURWQGW-UHFFFAOYSA-N 276.105 2.337 10 10 CECE CC(C)N1CC[C@@H](CN)[C@H]1c1ccc(N(C)C)cc1 250509930 OQDKFCLTMBMOAY-GOEBONIOSA-N 261.413 2.483 10 10 CECE CNC[C@H]1CCN(C2CC2)[C@H]1c1ccc(N(C)C)cc1 250703791 DJMKJHBXPWSKQD-PBHICJAKSA-N 273.424 2.497 10 10 CECE Cc1cc(O)c(O)c(Br)c1CCCCN 258488886 MDTQVSAWACCCGI-UHFFFAOYSA-N 274.158 2.450 10 10 CECE Oc1ccc(F)cc1CN1CCc2ccnc(O)c2C1 277100933 VIXYEBJYBRBPMN-UHFFFAOYSA-N 274.295 2.190 10 10 CECE c1cc2c(cc1N1C[C@@H]3[C@H]4CC[C@@H](NC4)[C@H]3C1)CCO2 2162659979 OFJCDJNXXDFHOG-DRPJVOAASA-N 270.376 2.056 10 10 CECE COCCC1(C)CN(Cc2cc(OC)c(OC)cc2O)C1 297538595 ZYRVGEKHAZLAGA-UHFFFAOYSA-N 295.379 2.268 10 10 CECE CO[C@@H]1CC(N(C)c2ccc([C@H](C)N)cc2)C[C@H]1OC 2166103872 XQPBGWOIIKRTIM-IUIKQTSFSA-N 278.396 2.335 10 10 CECE CN1CCc2cc(N3C[C@H](N)[C@H](C(F)(F)F)C3)ccc21 2163071767 RAVQSUKRXDGASK-NEPJUHHUSA-N 285.313 2.005 10 10 CECE CCN[C@H](C[C@H]1COCCO1)c1ccc(N(C)C)cc1 2163073930 NPBPIDVHQZSMDR-JKSUJKDBSA-N 278.396 2.209 10 10 CECE CN1CCCc2cc(N3CC4(CCC[C@@H]4N)C3)ccc21 2163094431 LMPLVWQPNFFXMO-INIZCTEOSA-N 271.408 2.387 10 10 CECE C[C@@H]1CN(C)CC[C@]1(O)c1ccc(N2CCCC2)cc1 2163096308 HWIKRUSXJVKCSK-RHSMWYFYSA-N 274.408 2.446 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2OCCO[C@@H]2C)cc1 2163098734 XJWUBOMMEPSNJL-KCXAZCMYSA-N 279.380 2.370 10 10 CECE CN1CCCc2cc([C@]3(O)CC[C@H](CCN)C3)ccc21 2163108480 XTRCXAYHMAGHPW-DYVFJYSZSA-N 274.408 2.406 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H](O)C3(C)CSC3)ccc21 2163134996 FRVBMBCJWLLWPZ-HUUCEWRRSA-N 292.448 2.183 10 10 CECE COC1([C@H](O)[C@H](N)c2ccc(N(C)C)cc2)CCCC1 2163139570 YOFHCMYFSFJPNP-HUUCEWRRSA-N 278.396 2.073 10 10 CECE COCC[C@H](C)[C@H](NN)c1ccc(N2CCCC2)cc1 2163158364 OLZJQIJZDICIQS-BBRMVZONSA-N 277.412 2.464 10 10 CECE Nc1ccc(C[C@H](O)c2ncc(C(F)(F)F)cn2)cc1 2163300598 VLIGBTBUHSHXGU-NSHDSACASA-N 283.253 2.354 10 10 CECE Cc1ccc(C(=O)N(C(C)C)[C@@H]2CCOC2)c(O)c1O 292825989 MIZIOHQQXVZHPC-LLVKDONJSA-N 279.336 2.046 10 10 CECE CN1CCc2cc([C@H](O)C(=O)[C@H]3C[C@@H]4C[C@@H]4C3)ccc21 2163855287 HPVBEKGWCALWIY-FQLMCAECSA-N 271.360 2.328 10 10 CECE N[C@H](c1c(F)ccc(Br)c1O)[C@H](O)C1CC1 713798692 BFCQCABJWDNDGB-NXEZZACHSA-N 290.132 2.065 10 10 CECE O=C(O)/C=C/c1ccc(N2C[C@@H]3COC[C@H]3C2)c(F)c1 718638928 SNRJGEGFXMORJW-VNPHXJNISA-N 277.295 2.006 10 10 CECE O=C(N[C@H]1COc2ccc(F)cc2C1)c1cc(O)cs1 811567524 ZSGHKMJAKVWYFL-SNVBAGLBSA-N 293.319 2.326 10 10 CECE CCC[C@H](c1cccc(F)c1O)N1CCNCC1 575267093 WXLCLVIAIJZOTN-CYBMUJFWSA-N 252.333 2.278 10 10 CECE Nc1ccc([N+](=O)[O-])c(NCCc2ccc(O)c(O)c2)c1 811810877 GZUGRULCTFWAKJ-UHFFFAOYSA-N 289.291 2.243 10 10 CECE Oc1ccc2ccccc2c1CNC[C@H]1C[C@H](O)C1 720894690 WPEPVWDOEYFYHX-AULYBMBSSA-N 257.333 2.406 10 10 CECE CNCc1ccc(N(C)Cc2ccn(C)n2)cc1Cl 723524186 OFBIAZIYKVMEFV-UHFFFAOYSA-N 278.787 2.429 10 10 CECE O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)CCN2 722213171 RXRJGBIVWDVSBK-UHFFFAOYSA-N 290.344 2.161 10 10 CECE CC(C)(C)C[C@@H](O)CNC(=O)/C=C\c1ccc(O)c(O)c1 588407962 GZYGCCCVGBFQQW-SMYYYNMVSA-N 293.363 2.024 10 10 CECE OC[C@H](NCc1cc(Cl)c(F)cc1O)C1CCC1 826867161 HVJBBHMWCIRLEQ-LBPRGKRZSA-N 273.735 2.435 10 10 CECE CN(C)c1ccc(/C=C\CN2CCO[C@@H]3C[C@H]32)cc1 835052633 IDBSNVDHTBXPSN-JGPFYOFESA-N 258.365 2.239 10 10 CECE CCOc1cccc(CN[C@@H](C)c2nncs2)c1O 1892858864 DNEQPIWDJOYYNM-VIFPVBQESA-N 279.365 2.493 10 10 CECE CCC/C=C\[C@@H](O)C(=O)N[C@H](C)c1ccccc1O 913763812 SBLZQSHFCCJPKT-SUKBLBECSA-N 263.337 2.287 10 10 CECE CN(C)c1ccc(/C=C\CN2CC[C@@H](CN)C2)cc1 843048310 IPRHULVVUQSORL-JZIMQPMSSA-N 259.397 2.046 10 10 CECE C[C@H](C(=O)NCc1ccccc1O)c1cccnc1 746411414 OOOSNJMZYCVGMS-NSHDSACASA-N 256.305 2.207 10 10 CECE CO[C@H](C(=O)NCc1ccc(O)cc1O)C1CCCCC1 910944860 XNXGSJUQSAFNOJ-HNNXBMFYSA-N 293.363 2.309 10 10 CECE C[C@H](NCc1ccc(N2CCOCC2)cc1)c1ccnnc1 924749573 JGRDUUUGIOSZPT-AWEZNQCLSA-N 298.390 2.164 10 10 CECE CCN(CC)c1ccc(CNC(=O)c2cccnn2)cc1 858605643 WDIIRJYPHAWLKM-UHFFFAOYSA-N 284.363 2.253 10 10 CECE O=C(c1cc(O)cs1)N1CCC[C@@H]2COCC[C@@H]21 756800016 PYMCODXDIQIUMF-KOLCDFICSA-N 267.350 2.095 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1C[C@H]2CC[C@H]1O2 935946478 IDPUTTVQPXAIHX-NTZNESFSSA-N 296.363 2.062 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H]3COC[C@@H]32)c(F)c1 1899110199 HRVMYQYRUUUBGL-RVBZMBCESA-N 269.291 2.243 10 10 CECE C[C@H](N[C@@H]1C[C@@H](O)C12CCC2)c1cc([N+](=O)[O-])ccc1O 850544882 BYNILQYEOVHWGF-CUOATXAZSA-N 292.335 2.255 10 10 CECE COC(=O)c1coc([C@@H](C)OC(=O)c2cc(O)cs2)n1 869393825 PKXXZRJLDLBWHZ-ZCFIWIBFSA-N 297.288 2.146 10 10 CECE 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CC[C@H](C)[C@@H](N[C@H](C)c1ccc(O)cc1O)C(=O)OC 252410141 LFIHEKANGBGJCY-IMSIIYSGSA-N 281.352 2.336 10 10 CECE OCc1cc(F)c(N2CCO[C@@H](C3CC3)CC2)c(F)c1 2144813750 YYALFHZUTWZYRT-CQSZACIVSA-N 283.318 2.462 10 10 CECE CCCCN(CC(N)=O)c1ccc(CNCCC)cc1 42691743 MIEUEDQFMQWXON-UHFFFAOYSA-N 277.412 2.278 10 10 CECE Cc1ccc(CNC[C@H]2CCC[C@@H]2C(=O)O)c(O)c1 1972641707 LQNGWLRBJCFDRK-YPMHNXCESA-N 263.337 2.291 10 10 CECE NCc1ccsc1-c1nc(-c2ccc(O)c(O)c2)no1 2148775744 YRIQGXBMHPTZBO-UHFFFAOYSA-N 289.316 2.335 10 10 CECE C[C@H](F)CS(=O)(=O)Nc1ccc(O)cc1Cl 1983743630 FCMKPLHETACWQO-LURJTMIESA-N 267.709 2.145 10 10 CECE COC(=O)C[C@@H](N)c1cc(C(C)C)cc(OC)c1O 260305953 NEYUCXZDZAXKGH-LLVKDONJSA-N 267.325 2.087 10 10 CECE NN[C@@H](c1ccc(C(F)(F)F)cn1)c1ccccc1O 2146240161 JDTRFFQUEKXKJC-GFCCVEGCSA-N 283.253 2.359 10 10 CECE Nc1ccc(-n2ccc(C(=O)N3CCCCC3)n2)cc1 35427819 CHSTZOYUXWGURY-UHFFFAOYSA-N 270.336 2.081 10 10 CECE Nc1cccc(Br)c1N[C@@H]1C[C@@H]2NCC[C@H]21 1989344493 GJLAXPUBNRLUDD-PPKCKEKNSA-N 282.185 2.194 10 10 CECE COc1ccc([C@H](C)N[C@@H]2CCC[C@H](O)C2)c(O)c1 37163487 DOGJDBVPGPXESF-TUAOUCFPSA-N 265.353 2.355 10 10 CECE Cc1csc(C(=O)[C@H](O)c2ccc3c(c2)CCN3C)n1 2147119405 YAONFZUSJVQSKM-CYBMUJFWSA-N 288.372 2.360 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@@H](OC)[C@H]1CCOC1 2150297002 WWSZINWKJWRZQJ-GOEBONIOSA-N 278.396 2.142 10 10 CECE Cc1nc2n(c1[C@H](N)c1ccc(N(C)C)cc1)CCC2 2151130239 JKKQCPGESPHXSO-OAHLLOKOSA-N 270.380 2.252 10 10 CECE CN[C@H]1C[C@@H]2CC[C@H](C1)N2[C@H](C)c1ccc(O)cc1O 2151262117 OBSWPIZZOUIFPG-LPWJVIDDSA-N 276.380 2.374 10 10 CECE CN1C[C@@H]2CCC[C@H](N(C)Cc3ccc(N)cc3)[C@H]2C1 2152861407 GZFUUBCCGSQHSJ-XIRDDKMYSA-N 273.424 2.431 10 10 CECE C[C@H](NCCCCn1ccnc1)c1cc(O)ccc1O 45094532 KZFPSRLBBMIYHW-LBPRGKRZSA-N 275.352 2.425 10 10 CECE Oc1cc(Cl)ccc1CN[C@H]1COC2CC1C2 2011778811 YGECAGLBJFEPIC-NHNAUAITSA-N 253.729 2.313 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)CCCOC1(C)C 2153810462 PSMKTAKTIOWUGS-GDBMZVCRSA-N 279.380 2.363 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CC[C@@H]2CNC[C@H]21 2016950516 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2.047 10 10 CECE CCN[C@@H](C)c1ccc(N(CCO)CC2CC2)cc1O 688390304 JRNCDBKRWWSTKF-LBPRGKRZSA-N 278.396 2.271 10 10 CECE CCC[C@]1(O)CCCN(Cc2cc(N)ccc2O)C1 710185165 DJWRJXSQCJEZMY-HNNXBMFYSA-N 264.369 2.101 10 10 CECE CCCN(Cc1ccc(N)cc1)C[C@H]1CCCS1(=O)=O 710620517 XQSJSGYVGXGROV-OAHLLOKOSA-N 296.436 2.058 10 10 CECE C[C@@H]1CCN(S(=O)(=O)Cc2ccc(N)cc2)C2(CC2)C1 2171954872 SYBVAZVAHVKBSD-GFCCVEGCSA-N 294.420 2.363 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCC[C@H](CF)C2)cc1 711518052 FZDGDDCTBVGFDJ-CJNGLKHVSA-N 279.403 2.434 10 10 CECE CC[C@@H]1[C@H](C(=O)O)CCN1Cc1ccc(OC)cc1O 690679209 OAFOGBMHSSKFIJ-CHWSQXEVSA-N 279.336 2.086 10 10 CECE C[C@@H](NCCOC1CCC1)c1cc(O)ccc1O 690707600 YPUYYNAYGVCSET-SNVBAGLBSA-N 251.326 2.318 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CO[C@@H](C3CC3)C2)cc1 691264600 QPUPJBTZDAQVHH-CVEARBPZSA-N 276.380 2.028 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@@H](N)C(C)(C)C1 388614909 HQWXNDLTEQIIFC-GXFFZTMASA-N 264.369 2.218 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2C[C@H]3O)c(F)c1 2172094001 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C[C@@H]1[C@H]2CNC[C@H]2CN1c1ccc2c(c1)CCCO2 2106341363 MVNIVIIFPCJSPX-OSAQELSMSA-N 258.365 2.056 10 10 CECE NCC[C@@H]1CCCN(c2ccc3c(c2)COCC3)C1 2106325185 GFZVBSKBRCSUHJ-ZDUSSCGKSA-N 260.381 2.325 10 10 CECE CC1(C)CNCCN(c2ccc3c(c2)COCC3)C1 2106369842 FQHNBGTVDAYRRQ-UHFFFAOYSA-N 260.381 2.195 10 10 CECE CCC[C@@](CSc1nccs1)(NC(C)C)C(N)=O 2086570478 HMGSYEKACUCVIY-LBPRGKRZSA-N 287.454 2.257 10 10 CECE CCN1CCc2cc([C@H](NC)[C@@H]3CCOC3)ccc21 2106793549 OCGQKLPNMTYPQA-ZBFHGGJFSA-N 260.381 2.366 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)c3ccco3)ccc21 2106859942 OJTHYXHRAQFAER-LSDHHAIUSA-N 258.321 2.005 10 10 CECE NC[C@@H]1C[C@@H]1[C@H](O)c1ccc(N2CCCCC2)cc1 2106826833 WYVVFVFPMBRCRS-CWRNSKLLSA-N 260.381 2.305 10 10 CECE CN1CCCc2cc([C@@]3(O)CCCC[C@@H]3N)ccc21 2106831220 OLCIJPURVOVFSR-HOTGVXAUSA-N 260.381 2.158 10 10 CECE CC(C)[C@@H](N)[C@@](C)(O)c1ccc(N2CCCC2)cc1 2106830776 KBCWRFATELOWJZ-CVEARBPZSA-N 262.397 2.478 10 10 CECE CC(C)[C@@H](CN)[C@H](N)c1ccc2c(c1)CCCN2C 2107773753 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COc1ccc([C@H](C)NC[C@H]2OCC[C@H]2C)c(O)c1 2096100896 AGLBZAVMYHZFRS-JRPNMDOOSA-N 265.353 2.476 10 10 CECE O=C(O)C[C@H]1CC2(CC2)CN1Cc1ccccc1O 2096348082 PBNYHRDNONTBIH-LBPRGKRZSA-N 261.321 2.221 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@H]2CC[C@@]2(CN)C1 2201353221 XVNKCIDHZPLNFT-FRFSOERESA-N 273.424 2.484 10 10 CECE Cc1cc(CN)ccc1N(C)CCCn1cccn1 2113776735 ZKTXZFJZSGAFRP-UHFFFAOYSA-N 258.369 2.177 10 10 CECE CCN(c1ccc(CO)cc1[N+](=O)[O-])[C@@H]1CCSC1 2113799418 HTDZCWXIEJJJKH-LLVKDONJSA-N 282.365 2.419 10 10 CECE CN1CC[C@@H]2[C@H](CCN2c2ccc(CO)cc2Cl)C1 2114506185 ZNSNMIUSKKWPBZ-TZMCWYRMSA-N 280.799 2.363 10 10 CECE C[C@H]1CN(Cc2cc(Cl)ccc2O)CCCN1 2213064888 BHDSCAFUDONGRU-JTQLQIEISA-N 254.761 2.229 10 10 CECE CN[C@@H](c1ccccc1O)[C@](C)(O)Cc1ccncc1 2203555301 HZEJHHZDNIUEGT-JKSUJKDBSA-N 272.348 2.041 10 10 CECE CCO[C@@H](CNCc1ccc(OC)cc1O)C(F)(F)F 2203837370 NOCICWOMFPXHTP-LBPRGKRZSA-N 293.285 2.458 10 10 CECE CCCNCc1ccc(N2C[C@@H](C)[C@@H](O)C2)cc1OC 2204557605 RIBRLVYPZKULPL-DOMZBBRYSA-N 278.396 2.012 10 10 CECE COc1ccc(O)c(CN[C@H]2C[C@H]3CC[C@H]2[C@H](O)C3)c1 2204615811 AYYQSABMYKAYOC-HPAJIGNASA-N 277.364 2.040 10 10 CECE Cc1cccc(CNC(=O)C23CC(C)(C2)O[C@@H]3C)c1O 2204626053 PVQVZZFQUBPOEJ-VHWKEVPUSA-N 275.348 2.274 10 10 CECE CCC[C@@H]1CN(c2ccc(CN)c(F)c2F)C[C@@H]1CO 2205807130 GPVZFGWFYUTBSA-VXGBXAGGSA-N 284.350 2.268 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H](CN3)C2)c(Br)c1 2215800610 HXFAETNDKSYUOE-ZJUUUORDSA-N 297.196 2.256 10 10 CECE C[C@@H]1C[C@@]1(F)CN(C)c1cc2c(cc1N)NC(=O)CC2 2206342920 JNGGSUIMOXDAPG-RFAUZJTJSA-N 277.343 2.338 10 10 CECE COc1cc(C)c(N2C[C@@H]3CC[C@@H](N)[C@H]3C2)c(C)c1 2269577127 PYUKXNYZKRUUCT-AEGPPILISA-N 260.381 2.486 10 10 CECE CNCc1ccc(N(C)[C@@H]2CC[C@@H]2COC)cc1OC 2207393315 VYNKNWQYDMFASA-UKRRQHHQSA-N 278.396 2.276 10 10 CECE COC[C@@H]1CC[C@@H]1N(C)c1cc(OC)c(OC)cc1N 2207395359 CEGRTGAGMGLQQQ-JQWIXIFHSA-N 280.368 2.147 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@]1(O)CC[C@H]1COC 2207384979 MBIXUYSNBFNCTI-APHBMKBZSA-N 279.380 2.220 10 10 CECE OC[C@]12CCC[C@]1(CNCc1cc(F)cc(F)c1O)C2 2208150218 FCVOEGGLXCVWAG-HUUCEWRRSA-N 283.318 2.313 10 10 CECE COc1ccc(N2CCC[C@H]([C@@H](C)O)C2)cc1F 2219609923 UMQNVJQEWPTBJA-MNOVXSKESA-N 253.317 2.432 10 10 CECE COc1ccc(N2CC[C@H](CO)[C@H](C)C2)cc1F 2219622281 QRPOSXSJHLKUAH-GHMZBOCLSA-N 253.317 2.289 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCS[C@H](CCO)C1 2232095986 LMVXNMFZUPMJEE-TZMCWYRMSA-N 280.437 2.319 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCN(C)[C@@H]2CC[C@@H]21 2232027873 OLZRHIVDWCSYRZ-MAZHCROVSA-N 259.397 2.298 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](N(C)C)C2)c(C)c1 2232026578 CMFTYYXARZEZHI-DZGCQCFKSA-N 261.413 2.416 10 10 CECE COCCN(CCF)c1ccc([C@H](C)O)cc1C 2223975042 JVHNPRVTFPJRED-LBPRGKRZSA-N 255.333 2.471 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CCC[C@H](C(=O)O)C2)C1 2234172155 RQUOVDZUPYUQNR-OUAUKWLOSA-N 280.328 2.179 10 10 CECE C[C@H]1Cc2cc(N3CC[C@H](C(F)(F)CO)C3)ccc2O1 2235067142 MXILEWFGRAKDMN-JQWIXIFHSA-N 283.318 2.464 10 10 CECE CCCOc1ccc(N2CC[C@](C)(O)[C@](C)(O)C2)cc1 2235100940 HLOITSDTKDDDGN-JKSUJKDBSA-N 279.380 2.188 10 10 CECE C[C@]1(O)C[C@@H]2[C@H]1CCN2c1ccc2c(c1)OCCCO2 2235120265 NHIZZVQERSFJCQ-IOASZLSFSA-N 275.348 2.198 10 10 CECE CNCc1cc(OC)ccc1N1C[C@@H](C)C[C@@H](OC)C1 2235964081 QZYODSMESOIUSV-SWLSCSKDSA-N 278.396 2.276 10 10 CECE COC[C@H]1CN(c2ccc(OC)cc2C(=O)O)C[C@@H]1C 2235949668 HRFULXJIYKWSRC-WDEREUQCSA-N 279.336 2.112 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C[C@@H](F)C2)c(Cl)c1 2226283721 FIUHFIVADXOMAO-NEPJUHHUSA-N 286.778 2.359 10 10 CECE C[C@@H]1Cc2cc(N3C[C@]4(C)C[C@]4(CO)C3)ccc2O1 2226698414 GVQBZEKFSKHICX-XFBWCDHKSA-N 259.349 2.219 10 10 CECE COc1cnc(N(C)[C@@H](C)c2ccccc2O)cn1 2226668449 ORZWTGAXTIOUNO-JTQLQIEISA-N 259.309 2.388 10 10 CECE CN(c1ccc2c(c1)OCCO2)C1(CO)CCCC1 2226782073 VHSDAGKIOCCQFS-UHFFFAOYSA-N 263.337 2.199 10 10 CECE OC[C@H]1CC=CCN1c1ccc(OCC(F)F)cc1 2226745158 IXNHIKOYNUFDKK-GFCCVEGCSA-N 269.291 2.458 10 10 CECE O=C(O)c1cc(OC(F)(F)F)ccc1N1CCOCC1 2237290493 NVYYFUGKNKPNNA-UHFFFAOYSA-N 291.225 2.120 10 10 CECE 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2.494 10 10 CECE CC[C@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H]1O 294148581 HWRJLWMOYKWSPW-ISVAXAHUSA-N 273.735 2.387 10 10 CECE Cc1cc(N2C[C@H]3COC[C@H]32)ccc1CNC1CC1 2129799235 PYCLQKJWSWEPDC-XJKSGUPXSA-N 258.365 2.082 10 10 CECE COC(=O)[C@@](C)(CCF)NCc1ccc2c(c1)CCO2 827352839 RDPBVAQOVVZMMA-OAHLLOKOSA-N 281.327 2.002 10 10 CECE COc1cc(O)c(CNCCC2CC(OC)C2)cc1OC 826796533 JZSWVTHFOMWXOP-UHFFFAOYSA-N 295.379 2.314 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)C1(C(F)(F)F)CC1 720378120 KEBZKWLOIRQMEA-JTQLQIEISA-N 286.253 2.203 10 10 CECE Oc1ccc(Cl)cc1CN1CC[C@](O)(C(F)F)C1 824726196 JCVBPQXTQJVTAS-GFCCVEGCSA-N 277.698 2.248 10 10 CECE CCN[C@H](C)c1ccc(N2CC(CC(N)=O)C2)cc1Cl 723182966 QAVGPRZQLCSFPI-SNVBAGLBSA-N 295.814 2.322 10 10 CECE CN(C)c1ccc(/C=C\CN2CCCC[C@H]2C(N)=O)cc1 835025334 IFEPDFICNVNFII-KJPDOMRESA-N 287.407 2.106 10 10 CECE NC[C@H](NCc1cc(Cl)cc(F)c1O)C(F)(F)F 848714058 DSNNEFOKDWCEGZ-QMMMGPOBSA-N 286.656 2.164 10 10 CECE COCCN(Cc1ccc(N(C)C)cc1C)[C@H]1CCOC1 840940655 JBYDHCKQZJKPFT-KRWDZBQOSA-N 292.423 2.298 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@H]2CCCN2)cc1 841034531 DYUAUNZHBQVWDV-SJDLMVEWSA-N 259.397 2.107 10 10 CECE COC[C@H](CNC(=O)OC(C)(C)C)Oc1ccc(N)cc1 1896225614 MKMFLIGNTGKOKY-ZDUSSCGKSA-N 296.367 2.187 10 10 CECE CC[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)c(C)c1 851708806 ZPVGKCVNOLYRBF-CYBMUJFWSA-N 264.369 2.356 10 10 CECE C[C@H](N[C@H]1C[C@H](C)n2ncnc21)c1ccc(F)cc1O 850499709 VUHAXVKXIJVWJF-AUTRQRHGSA-N 276.315 2.479 10 10 CECE CN(C)c1ccc(CN(CCc2cn(C)nn2)C2CC2)cc1 859082134 OODOSFKFJQIHQW-UHFFFAOYSA-N 299.422 2.088 10 10 CECE Cc1nnc(CN(C)c2ccc(CN)c(F)c2)s1 697807563 QFWNLUKOPZJWBC-UHFFFAOYSA-N 266.345 2.081 10 10 CECE C[C@@H](NCc1cc(Cl)cc(F)c1O)C(C)(C)O 776151412 MRIRVUNMVNSOLL-SSDOTTSWSA-N 261.724 2.434 10 10 CECE CC[C@@H]1CN[C@@H](C)CN1c1ccc(OC)c(OC)c1 83479467 KCBVWSYQCDLWHU-NWDGAFQWSA-N 264.369 2.281 10 10 CECE CCCN(CC(=O)O)[C@H](C)c1cc(F)ccc1O 94622255 JICHJSFNAFWMSP-SECBINFHSA-N 255.289 2.389 10 10 CECE CCN(CC)c1ccc(CNCCCNC(C)=O)cc1 74231086 IBTGUGOCWKXVBE-UHFFFAOYSA-N 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10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2O3)C1 1912168878 XNMSMWZUZWWUEK-DDHJBXDOSA-N 264.329 2.103 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H]3C[C@H]3[C@@H]2CO)cc1 1905555591 KBKZDYBBLFYVCC-UKMLZYKCSA-N 260.381 2.174 10 10 CECE C[C@H]1CCCCN1C(=O)CN1CCC[C@H](N=[N+]=[N-])C1 1912151356 GIXADVRDZAYOAF-RYUDHWBXSA-N 265.361 2.162 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CC(=O)NC2CCCCC2)C1 1912184233 CSRYGTLIGOQITM-NSHDSACASA-N 265.361 2.068 10 10 CECE CN(CCCN=[N+]=[N-])S(=O)(=O)CCC1CCC1 1912160570 XVNVRCCOCGENPH-UHFFFAOYSA-N 260.363 2.139 10 10 CECE Cc1ccc(O)c(CN2CCN(C[C@@H](C)F)CC2)c1 2133452908 BAOFHPNVCGZQDX-CYBMUJFWSA-N 266.360 2.176 10 10 CECE C[C@]1(C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)CCCCO1 1908025919 UWDAUUNIEDVFKL-DGCLKSJQSA-N 266.345 2.495 10 10 CECE COc1ccc(N2CC[C@@H](C(=O)OC(C)C)C2)cc1 107937646 QBVWQQGNGGNVNE-GFCCVEGCSA-N 263.337 2.473 10 10 CECE O=C(NCc1cc(Cl)ccc1O)c1cc([N+](=O)[O-])c[nH]1 1452946643 OXZWDACTZKSFAB-UHFFFAOYSA-N 295.682 2.212 10 10 CECE CC(C)(C)OC(=O)Nc1ccc(O)c([C@@H](N)CC(=O)O)c1 1535927674 ABXUFDXHAOAWQG-JTQLQIEISA-N 296.323 2.214 10 10 CECE C[C@@H]1C[C@@H](C)[C@H](C(=O)O)N(Cc2ccccc2O)C1 2136409847 WOVTZVMZPQRTSI-JTNHKYCSSA-N 263.337 2.323 10 10 CECE CC(C)C1CC(C(=O)NCc2cc(N)ccc2O)C1 1921106894 JDRIUFUAFLBBER-UHFFFAOYSA-N 262.353 2.273 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@@H](C)[C@@H]1CO 227060850 CRCDIESULMMMDY-PXAZEXFGSA-N 274.408 2.454 10 10 CECE O=C(NCc1ccc(F)c(F)c1)c1ccc(O)c(O)c1 227016871 LIDPWVVVNQUGEE-UHFFFAOYSA-N 279.242 2.306 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1Cl 227325442 FUNWOZUGXJTDOI-GHMZBOCLSA-N 295.814 2.322 10 10 CECE Nc1ccc(CCCN2CCO[C@@H]3CCC[C@H]32)cc1 228083207 GACVHNCTSFQWMC-HZPDHXFCSA-N 260.381 2.455 10 10 CECE CNCc1cc(F)c(N(CCCO)C2CCC2)c(F)c1 228425123 CEVNEIRJVGAXPU-UHFFFAOYSA-N 284.350 2.426 10 10 CECE CN1CCc2cc(CN[C@@H]3CCCC[C@@H]3CO)ccc21 228687527 HOBKRZBBAVCGAI-HZPDHXFCSA-N 274.408 2.320 10 10 CECE O=C(NCc1cccc(Cl)c1O)c1nccnc1Cl 1640405269 OSPHBAZSGWKGDZ-UHFFFAOYSA-N 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10 10 CECE Nc1ccc(NC(=O)c2n[nH]cc2Br)cc1 1988872297 YDFNUTFKBCYOBK-UHFFFAOYSA-N 281.113 2.007 10 10 CECE CN1C[C@@H]2[C@@H](CC[C@H]2NCc2ccc(N(C)C)cc2)C1 2149714492 YUGAXGRADCEBTI-USXIJHARSA-N 273.424 2.182 10 10 CECE Nc1ccc(CCCN2CCC(F)(F)[C@@H](CO)C2)cc1 2146752816 IDPAQEMBDVUMBX-CYBMUJFWSA-N 284.350 2.151 10 10 CECE NCc1cc(F)c(N2CCOC[C@@H]2C(F)(F)F)c(F)c1 2150385044 ATFNJBXALSVBES-SNVBAGLBSA-N 296.239 2.191 10 10 CECE CN1CCCc2cc(CN[C@@H]3CC[C@@H]3N(C)C)ccc21 2157699710 DIZJIAWMCULZLU-WBVHZDCISA-N 273.424 2.251 10 10 CECE CN(c1cc2c(cc1F)[C@@H](O)C(=O)N2)[C@@H]1[C@H]2CCC[C@H]21 2151276556 UQEGWAWSMQLBKY-TUTWKPOWSA-N 276.311 2.046 10 10 CECE COc1ccc(N2CC[C@H](CO)C2(C)C)c([N+](=O)[O-])c1 2151524388 VXUWZDRRPFFTBY-SNVBAGLBSA-N 280.324 2.201 10 10 CECE CNCc1ccc(N2CC3(CCC3)C[C@@H]2CO)cc1C 2151517353 BLHKKLABPBNHHI-MRXNPFEDSA-N 274.408 2.456 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@H]3C=CCC3)ccc21 2153100251 GITKCMKAIZMSBZ-NHYWBVRUSA-N 271.364 2.302 10 10 CECE CC(C)n1ccc(C(=O)N(C)Cc2ccc(N)cc2)n1 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[N-]=[N+]=NC1CN(C(=O)[C@H]2CC[C@@]3(C2)CC3(F)F)C1 2038573818 AMWCCIJKZVCERK-OIBJUYFYSA-N 256.256 2.333 10 10 CECE COc1ccc(O)c(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)c1 403761017 YPHUCBWCUGRGQG-VIFPVBQESA-N 276.296 2.316 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2c(O)cccc2F)C1 403841693 PRKAFBKLMXSPMS-MRVPVSSYSA-N 264.260 2.446 10 10 CECE CCOc1cccc(CN[C@@H]2CO[C@@H](C)[C@H]2C)c1O 405786603 RBPIMTMWCOSDOU-NTZNESFSSA-N 265.353 2.304 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(F)c2)[C@H](C)C1 310593563 ROHZNUWFYAOHIR-MFKMUULPSA-N 252.333 2.288 10 10 CECE CC[C@H](N)c1ccc(N(CCS(C)(=O)=O)C2CC2)cc1 2170152530 LOCZHLTYVODNPD-HNNXBMFYSA-N 296.436 2.110 10 10 CECE CN(C)CC[C@@H]1CCN(CCc2ccc(N)cc2)C1 700969169 WERVCCJOMLYUAU-OAHLLOKOSA-N 261.413 2.085 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1cnc(Cl)cn1 701319390 NNIVFVDTCMAQPZ-ZETCQYMHSA-N 266.692 2.045 10 10 CECE CN1CCCC[C@@H]1COC(=O)Nc1ccc(N)cc1 88165896 AXHJNFOMJGFZOZ-CYBMUJFWSA-N 263.341 2.302 10 10 CECE CCOc1cc(N(C)Cc2ccc(N)cc2)nc(C)n1 90788007 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[N-]=[N+]=NCCCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1 42013011 KWAAWULBSCVNFQ-AATRIKPKSA-N 275.268 2.425 10 10 CECE CC(C)[C@H](CCO)N[C@H](C)c1c(O)cccc1O 231072612 PYTRLCMBYVNKFZ-MNOVXSKESA-N 253.342 2.155 10 10 CECE CCC[C@H](O)[C@H](N)c1cc(F)cc(Br)c1O 95805289 TXBBEHNGMKVCSE-VHSXEESVSA-N 292.148 2.455 10 10 CECE CCOc1cccc(CN[C@H]2CCC[C@H]2OC)c1O 50369645 NSVIXGKFKRYYFW-QWHCGFSZSA-N 265.353 2.448 10 10 CECE Oc1cc(Br)cc(C[C@@H]2CCCN2)c1O 258510609 NWMXUSYAKOKGPF-VIFPVBQESA-N 272.142 2.155 10 10 CECE CC(C)(O)c1c(O)c(O)cc(Br)c1F 258582309 YRRAXRXVKLMCAU-UHFFFAOYSA-N 265.078 2.227 10 10 CECE Cc1csc(=O)n1CCOCc1ccc(N)cc1 700190853 KQMQCVHZJLHVNE-UHFFFAOYSA-N 264.350 2.017 10 10 CECE C[C@H]1C[C@@H](C(=O)N(C)Cc2ccccc2O)CCN1C 279186221 KWKAHELMLUZBPO-STQMWFEESA-N 276.380 2.081 10 10 CECE CCc1noc(C)c1CNCc1cc([N+](=O)[O-])ccc1O 292877602 DTXIAKUQADFMJZ-UHFFFAOYSA-N 291.307 2.449 10 10 CECE CN[C@@H](COC[C@@H]1CCCO1)c1ccc(N(C)C)cc1 2163061119 FDBHVUAWFSTLSF-HOTGVXAUSA-N 278.396 2.209 10 10 CECE CN1CCCc2cc([C@H](O)[C@H]3CNCC34CC4)ccc21 2163100565 SCWRITZROAUONP-ZBFHGGJFSA-N 272.392 2.102 10 10 CECE NCc1nc([C@H](O)c2ccc(N3CCCC3)cc2)cs1 2163112096 YUIUHPSIFGOOSD-OAHLLOKOSA-N 289.404 2.284 10 10 CECE Cc1nnccc1[C@H](O)c1ccc(N2CCCC2)cc1 2163113059 HYWIOFPYPJAELC-MRXNPFEDSA-N 269.348 2.467 10 10 CECE CC1(C2CC2)CN(c2cc3c(cc2F)[C@@H](O)C(=O)N3)C1 2163420488 ZPFIRZFQGGRNPL-CYBMUJFWSA-N 276.311 2.048 10 10 CECE COc1ccc(N(C)[C@]2(CN)C[C@H](C)O[C@H](C)C2)cc1 724235053 ZRVYSKHQBRDXFS-VIKVFOODSA-N 278.396 2.416 10 10 CECE CC(C)NCc1ccc(N2C[C@@]3(C)C[C@@]3(CO)C2)cc1 2165465857 XNTCLAWLHCWSOS-SJORKVTESA-N 274.408 2.393 10 10 CECE CCC[C@H](CCO)NCc1ccc2c(c1)CCN2C 716930867 RIYBAPFKKFIYAO-OAHLLOKOSA-N 262.397 2.320 10 10 CECE CSc1ccc(CCCC(=O)OCC(=O)C(C)=O)cc1 829624762 PMNKFMZKWVIKHN-UHFFFAOYSA-N 294.372 2.433 10 10 CECE CN(C(=O)COc1ccc(N)cc1)C1(C)CCCC1 720365848 ITDQMFRETNGDMR-UHFFFAOYSA-N 262.353 2.439 10 10 CECE CC[C@@H](C)NC(=S)NCc1c(O)cccc1F 905660155 DZAYUVBICSQNSX-MRVPVSSYSA-N 256.346 2.294 10 10 CECE O=C(NC[C@@H]1C[C@H]1C(F)(F)F)c1c(F)ccc(O)c1O 900691570 NNTUHMSEQRIJKV-NTSWFWBYSA-N 293.216 2.165 10 10 CECE CC(C)[C@H](O)CNC/C=C\c1ccc(N(C)C)cc1 835039789 LMCXQXREDIOFEL-OGZRUICASA-N 262.397 2.372 10 10 CECE O=C(O)[C@@H]1CCN[C@H](c2ccc(Cl)cc2O)C1 1952452925 RGZRTSWVAIZGKD-XCBNKYQSSA-N 255.701 2.171 10 10 CECE Cc1cc(O)c(CN2CCN(C(C)C)C(=O)C2)c(Cl)c1 840937678 UTPFXVHETFESNW-UHFFFAOYSA-N 296.798 2.407 10 10 CECE CCOC[C@H](C)N[C@H](C)c1cccc(OC)c1O 846163971 KSSFTCKKDHGCLA-WDEREUQCSA-N 253.342 2.476 10 10 CECE CCO[C@H](CN[C@H](C)c1cccc(OC)c1O)CN(C)C 926964304 WYDQZNBCEIOSEU-CHWSQXEVSA-N 296.411 2.018 10 10 CECE CN(C)c1ccc(CN2CCO[C@@H](CCF)C2)cc1 859908955 RZZOICZKMFWTRJ-HNNXBMFYSA-N 266.360 2.313 10 10 CECE CN(C(=O)OC(C)(C)C)[C@H]1CCN(CCN=[N+]=[N-])C1 1953751643 MQZZIAHKPUMFJM-JTQLQIEISA-N 269.349 2.238 10 10 CECE C[C@H](N)c1ccc(N2CC3(COC3)C2)cc1Br 697097413 WWSYHGNWNQUKPP-VIFPVBQESA-N 297.196 2.305 10 10 CECE COCCNCc1ccc(N2CCCOCC2)c(Cl)c1 164057579 JZEMQBDEOIBBHP-UHFFFAOYSA-N 298.814 2.303 10 10 CECE COc1ccc(N(C)CCCCCNC(C)=O)cc1 930841606 LWTJTZSERCHEJZ-UHFFFAOYSA-N 264.369 2.438 10 10 CECE COc1ccc2c(c1O)[C@H](c1cncc(F)c1)NCC2 83708280 OIIUNBYPCVWNTR-AWEZNQCLSA-N 274.295 2.170 10 10 CECE COc1ccc(N2CCCC[C@H]2CN)cc1OC 84585886 FHWKZUFLHCTJBZ-LBPRGKRZSA-N 250.342 2.021 10 10 CECE COc1cc2c(cc1Cl)N1CCNC[C@@H]1CC2 84798570 VOCAKJJDGQVNHS-JTQLQIEISA-N 252.745 2.073 10 10 CECE COc1ccc2c(c1)N[C@@H](C)CN2CCCC(=O)O 76928059 XUWSSVLMIUQUCO-JTQLQIEISA-N 264.325 2.180 10 10 CECE COc1cc2c(cc1OC)N(CCCN(C)C)C[C@H](C)N2 76928149 MPUYIGDICWYTPI-LBPRGKRZSA-N 293.411 2.276 10 10 CECE COc1ccc([C@H](C)N[C@H](C)[C@H](C)CO)c(O)c1 168791121 YBPVMZYLSFTEEC-MXWKQRLJSA-N 253.342 2.068 10 10 CECE Oc1c(CNCC2CCC(O)CC2)ccc(F)c1F 703345790 ATOZXEFIAKBEMI-UHFFFAOYSA-N 271.307 2.311 10 10 CECE C[C@@H]1C[C@]1(C)CNC(=O)CCOc1ccc(N)cc1 704065420 KROAQGNKZQLFBJ-IAQYHMDHSA-N 262.353 2.200 10 10 CECE COc1ccc(N2CCC[C@H](C)[C@H]2CN)c([N+](=O)[O-])c1 70178446 AZHNUADXZRKYIX-IINYFYTJSA-N 279.340 2.167 10 10 CECE COc1cccc(CN2CC[C@@H](C(F)F)C2)c1O 707170807 KVHUGGBPUDNGSM-SNVBAGLBSA-N 257.280 2.488 10 10 CECE CCOC[C@@H]1CCN(c2ccc(CO)cc2F)C1 707538572 GCGWSXJJWQGPBO-GFCCVEGCSA-N 253.317 2.181 10 10 CECE CCC[C@@]1(O)CCCN(c2ccc(OC)cc2N)C1 710186914 HCWMKOFVGAJINH-OAHLLOKOSA-N 264.369 2.409 10 10 CECE C[C@@H](NCCc1nccn1C)c1ccc(F)cc1O 62747986 OMHUKXYJIGRXSF-SNVBAGLBSA-N 263.316 2.158 10 10 CECE CN1CCN(c2ccc(CN)c(F)c2F)CCC1(C)C 712659845 SDBKMCJLCNJMDB-UHFFFAOYSA-N 283.366 2.344 10 10 CECE C[C@@H]1CN=C(NC(=O)c2ccc(N=NC(N)=O)cc2)S1 1142671893 MWONQYCRIFFFDL-SSDOTTSWSA-N 291.336 2.070 10 10 CECE Cc1ccc(O)c([C@H](C)NCC[C@@H](O)C(F)F)c1 716775427 VYEJFDXLUJQGQR-JOYOIKCWSA-N 259.296 2.367 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1O 718155899 PFUVUVQPSPIDKY-KPZJGCQBSA-N 274.364 2.026 10 10 CECE FC1(F)C[C@H]1OCCNCc1ccc2c(c1)CCO2 690724977 JLQFAAGWZVYCGF-CYBMUJFWSA-N 269.291 2.135 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3COC[C@@H]3C2)c(F)c1 690287767 CJMUAPFAKZYFIP-WXHSDQCUSA-N 264.344 2.318 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](C)[C@](C)(CO)C2)cc1O 694645974 MTVWBIJHSBBKPN-HSMVNMDESA-N 278.396 2.127 10 10 CECE COc1cccc(CNC[C@@H]2CCCC[C@@H]2CO)c1O 89523956 ULZPMYCYHKWBTH-GXTWGEPZSA-N 279.380 2.289 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC(O)CC2)cc1O 93670167 KBQILJSFWDJKFG-NSHDSACASA-N 264.369 2.024 10 10 CECE CCNCc1ccc(N2CCN3CCC[C@@H]3C2)c(C)c1 94462804 SDIYVOUUFWJUPH-MRXNPFEDSA-N 273.424 2.389 10 10 CECE C[C@H](N(C)C(=O)COc1ccc(N)cc1)C(C)(F)F 2122317987 CHIUHRVAGQZIBU-VIFPVBQESA-N 272.295 2.150 10 10 CECE [N-]=[N+]=NC1CCN(Cc2cnc3cccnn23)CC1 2115657168 DQHRQOLYPNYYJO-UHFFFAOYSA-N 257.301 2.004 10 10 CECE NCCc1ccc2ccn(C[C@H]3OCC[C@@H]3F)c2c1 2122529968 HPJXPQAJNQRROE-DZGCQCFKSA-N 262.328 2.270 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)Cc2ccc(O)cc2)CC1 2117729068 UIGSOADWOYGVBD-UHFFFAOYSA-N 260.297 2.141 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CCCc2ccoc21 2126528564 OMZJJMWSXVMDMP-HIFRSBDPSA-N 259.305 2.209 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3O)C[C@@H]1O 2128275777 WRFXFYWCGJXLFY-RLCCDNCMSA-N 261.365 2.263 10 10 CECE CN[C@@H]1CCCc2cc(N(C)[C@@H](C)CCO)ccc21 2128271667 CYVQNPWVFYBMFG-BLLLJJGKSA-N 262.397 2.491 10 10 CECE O[C@@H]1CCCc2cc(N(C3CC3)C3COC3)ccc21 2128270791 KMQKJJGVJWSZOW-MRXNPFEDSA-N 259.349 2.424 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2O)C1CCC(O)CC1 2128317007 ARTHEFQWWLNGRX-LDZOIKDWSA-N 261.365 2.406 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2N)[C@H]1COC2CC1C2 2128315937 YEALDRQLCHTKER-GLVOJVMSSA-N 258.365 2.246 10 10 CECE CC1(C)C[C@@H](O)CN(c2ccc3c(c2)CC[C@H]3O)C1 2128325309 QUIBNWCRCLLSNI-UKRRQHHQSA-N 261.365 2.263 10 10 CECE CCNCc1ccc(OC[C@@H]2COC(=O)C2)c(C)c1 2131149468 KXTWLQZTPKFASC-CYBMUJFWSA-N 263.337 2.046 10 10 CECE C[C@]1(F)CN(CCN=[N+]=[N-])C[C@]1(C)Br 1905098883 UIIGBCYWUSMNHN-YUMQZZPRSA-N 265.130 2.494 10 10 CECE CCO[C@@H](CNCc1cc(OC)ccc1O)C1CC1 2131885484 JCKSYFJTGKDKJB-HNNXBMFYSA-N 265.353 2.306 10 10 CECE CO[C@H]1CCN(c2ccc([C@H](C)N)cc2F)[C@H]1C 1914266292 FNAZERVBNBREAY-BHDSKKPTSA-N 252.333 2.459 10 10 CECE CC[C@@H]1CO[C@H](C)CN1c1cc(OC)c(OC)cc1N 213475288 OUIOKOLZTVMQAK-GHMZBOCLSA-N 280.368 2.290 10 10 CECE C[C@@H](F)CN1CCN(c2ccc([C@@H](C)N)cc2)CC1 2133451558 YRAIRLFHXBDJJB-CHWSQXEVSA-N 265.376 2.186 10 10 CECE Cc1ccc(/C=C\C(=O)N2CCCc3ccnc(O)c32)cn1 1279195844 FWSZXGMBTIPMJZ-SREVYHEPSA-N 295.342 2.483 10 10 CECE COCc1cccnc1N(C)Cc1ccc(N)cc1 1910449274 IAGZLYNZPWRYFW-UHFFFAOYSA-N 257.337 2.447 10 10 CECE C[C@@H](CS(=O)(=O)N(C)CCN=[N+]=[N-])c1ccccc1 1912178389 MVHPFPPPAOMHHM-NSHDSACASA-N 282.369 2.362 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)c2ccnnc2)C1 1912180660 DRQSBIFERKNWIY-SNVBAGLBSA-N 260.301 2.029 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)COc2ccccc2)CC1 1912171304 IYRYCCBTLYAOEZ-UHFFFAOYSA-N 260.297 2.367 10 10 CECE C[C@@H]1COC[C@@H]1C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912155884 JQAKJQXZTBZUCX-WOPDTQHZSA-N 266.345 2.208 10 10 CECE CN(C)c1nc(CN2CCC[C@@H](CN=[N+]=[N-])C2)ns1 1912146460 BMEXEOZDTMPOLH-VIFPVBQESA-N 281.389 2.126 10 10 CECE Cc1c(NC(=O)c2ccc(N=NC(N)=O)cc2)cnn1C 1294985483 SCECTYOOBYDOSZ-UHFFFAOYSA-N 286.295 2.143 10 10 CECE CN(C)c1ccc(CNC(=O)C[C@@H]2CCCC[C@H]2O)cc1 1290250867 ZENNVWGDUIYLLL-GOEBONIOSA-N 290.407 2.310 10 10 CECE CC(C)Oc1c[nH]ccc1=NC(=O)c1cc(O)cs1 1456951624 CFNMDBOFBFSNKP-UHFFFAOYSA-N 278.333 2.310 10 10 CECE CCOc1cccc([C@@H](C(N)=S)N2CCCC2)c1O 211944929 LHCSTKUVCKTBDD-LBPRGKRZSA-N 280.393 2.214 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H](O)CC(C)(C)C2)c1 1923141906 MOSSJYYQODMJOZ-AWEZNQCLSA-N 277.364 2.188 10 10 CECE CN(C)[C@H]1CCC[C@@H](C(=O)NCc2ccccc2O)C1 1636058285 UTRIBYUYUGULHM-OCCSQVGLSA-N 276.380 2.129 10 10 CECE Cc1oc(C(C)C)nc1C(=O)NCc1c(O)cccc1O 1645362901 FIIDJQHQUBNPOO-UHFFFAOYSA-N 290.319 2.448 10 10 CECE CC[C@H](C)NC(=O)CN1CCCc2cc([C@@H](C)N)ccc21 162224819 BUOURITYDXFVKI-QWHCGFSZSA-N 289.423 2.374 10 10 CECE Nc1ccc(CCC(=O)NC2(CC(=O)O)CCCC2)cc1 158159327 KOUORFJPGJDCPF-UHFFFAOYSA-N 290.363 2.105 10 10 CECE CCN[C@H](CSc1nccs1)[C@@H]1CCOC1 158772465 XNKVMXSIYHYQLE-NXEZZACHSA-N 258.412 2.250 10 10 CECE Oc1cc(F)ccc1CN1CCC[C@@H]1[C@H]1CCCN1 2139755654 HUMRPRMRSXVZQA-ZIAGYGMSSA-N 264.344 2.248 10 10 CECE COc1cc(N(C)[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)ccc1CN 2139702227 IAEDLXROLJQSQS-KYBZKERUSA-N 258.365 2.245 10 10 CECE CNC(=O)C1CCN(c2ccc3c(c2)CC[C@H](C)N3)CC1 168355993 XPZVYKNJZJQQMI-LBPRGKRZSA-N 287.407 2.396 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@H](C)CN(C)C)c1 168599608 NYTHQVRSKGVLDB-GHMZBOCLSA-N 252.358 2.002 10 10 CECE COC(=O)c1sc2cccc([N+](=O)[O-])c2c1O 200267301 RJCNBOAFIWSFHP-UHFFFAOYSA-N 253.235 2.302 10 10 CECE CCOC(=O)CCN(CC)/N=N/c1ccc(C(N)=O)cc1 1860480887 JPQSSQAVSGVZHK-WUKNDPDISA-N 292.339 2.059 10 10 CECE Cc1ccc(OC(=O)CCN2C(=O)CSC2=S)cc1 1865774365 DMJZKQGTNTWRLF-UHFFFAOYSA-N 295.385 2.151 10 10 CECE Cc1cccc(NC(=O)CN2C(=O)[C@H](C)SC2=S)c1 11635362 GYMUJEJCZUEGGA-VIFPVBQESA-N 294.401 2.182 10 10 CECE CC1(C)C[C@@H](NCc2ccc3c(c2)CCO3)CCN1 258801831 MFIHIPCFDIIPRQ-AWEZNQCLSA-N 260.381 2.242 10 10 CECE CCS[C@@H]1CC[C@H](NC(=O)COc2ccc(N)cc2)C1 233824277 SGAHFQYIJILEAE-GXTWGEPZSA-N 294.420 2.438 10 10 CECE CC[C@H](C)C[S@@](=O)CCC(=O)Nc1ccc(N)cc1 234005563 PDOGFVRFTLOTDI-WLRWDXFRSA-N 282.409 2.392 10 10 CECE C[C@@H](NCCCCC(N)=O)c1ccc(N(C)C)cc1 235198473 ZACXIKJHENJTML-GFCCVEGCSA-N 263.385 2.059 10 10 CECE CC[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ccccc1F 127381112 XBRVRDKPWZJHAF-ZDUSSCGKSA-N 279.319 2.206 10 10 CECE OCC[C@@H](NCc1c(O)cccc1Cl)C1CC1 1942823802 UFWZTKOXYMBWMC-GFCCVEGCSA-N 255.745 2.296 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]2C(=O)N(C)C)c(Cl)c1 2143658680 ODVIZVWHOMWEBO-IINYFYTJSA-N 296.798 2.450 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1[C@H]2CCOC[C@@H]21 1945022155 AWMKTLQCJXXIRH-JBLDHEPKSA-N 253.729 2.170 10 10 CECE COc1cccc(CNC[C@@H]2C[C@@H](O)C23CCC3)c1O 1875433973 YABTWKFRHLJSCT-GXTWGEPZSA-N 277.364 2.042 10 10 CECE Cc1cccc(N)c1C(=O)N(C)c1ccc(N)cc1 1876480695 UHVVQJNUYCPOPP-UHFFFAOYSA-N 255.321 2.436 10 10 CECE N[C@H]1CCC[C@H](c2nc(-c3ccc(O)c(O)c3)no2)C1 236331614 QXWGFEZELCFXMA-UWVGGRQHSA-N 275.308 2.133 10 10 CECE O=C(N[C@H]1CC[C@@H]1C1CCC1)c1cccc(O)c1O 1876627622 HUUJWFCNGXVXNJ-PWSUYJOCSA-N 261.321 2.406 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@]2(C)CCCO2)cc1O 1876701538 YAJXPBMRCBXKJS-NHYWBVRUSA-N 264.369 2.417 10 10 CECE CCNCc1ccc(N2CC[C@@H](C)[C@](C)(O)C2)cc1 1876952704 YVUALOVMKBYFNT-CZUORRHYSA-N 262.397 2.393 10 10 CECE COc1cc(Cl)cc(CN2CC[C@H]3CCN[C@H]3C2)c1O 2143785516 QPDOIDJHJDXRTO-MFKMUULPSA-N 296.798 2.238 10 10 CECE CCc1cc(CNCc2cc(F)ccc2O)n(C)n1 1877246662 HFCKTEQGOXVGPH-UHFFFAOYSA-N 263.316 2.117 10 10 CECE C[C@H](Nc1cncc(C(=O)O)n1)c1ccccc1O 1877569632 MAJWIRUYRHHGIM-QMMMGPOBSA-N 259.265 2.054 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H](C(=O)N(C)C)C2)c(Cl)c1 2143704171 XVGODJUBOQBYKW-PWSUYJOCSA-N 295.814 2.274 10 10 CECE CCNCc1ccc(N2C[C@@H]3COCC[C@@H]32)c(C)c1 1878825909 XCGMMQIETZWGMR-ZBFHGGJFSA-N 260.381 2.330 10 10 CECE C[C@H]1CC[C@@](C)(NC(=O)c2cc(O)c(O)c(O)c2)C1 1878820278 WOGGQAQOSMYLAX-RMLUDKJBSA-N 265.309 2.112 10 10 CECE CN(C)c1ccc([C@@H](O)[C@]2(CN)CCCSC2)cc1 1879870959 VGWOXVOBFJHCFH-CABCVRRESA-N 280.437 2.258 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H]2CN(C)C)c(F)c1 1880478876 IWSKWSUWHXPCFL-ONGXEEELSA-N 270.323 2.158 10 10 CECE C[C@H](O)c1cc(F)c(N2CCO[C@@H](CF)C2)c(F)c1 1880488470 VSDYBNCUVDEBPV-WPRPVWTQSA-N 275.270 2.193 10 10 CECE Nc1ccc(N(OCc2ccccc2)C2CNC2)cc1 1883154473 ATNOMOXHADUHQZ-UHFFFAOYSA-N 269.348 2.179 10 10 CECE C[C@H]1OCC[C@@H]1CC(=O)N1CCC(CN=[N+]=[N-])CC1 1885779408 PNQBVXVAZGLEQK-ZYHUDNBSSA-N 266.345 2.350 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccc2cncn2c1 1963732047 FXTLQJPBTZFMHG-UHFFFAOYSA-N 258.285 2.155 10 10 CECE CO[C@@H](C1CC1)[C@@H](C)NCc1ccc(F)cc1O 1964594720 RTYISOWPTFBMCE-YMTOWFKASA-N 253.317 2.434 10 10 CECE CC(C)C[C@@H](CNCc1ccc(O)cc1O)N(C)C 20201267 CFEWJLRNIHHQDE-ZDUSSCGKSA-N 266.385 2.164 10 10 CECE Nc1ccc(NC(=O)C[S@@](=O)c2ccc(F)cc2)cc1 40962145 DIJKQXTYMCNCCI-FQEVSTJZSA-N 292.335 2.154 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])C[C@H](C)O[C@H](C)C1 250671150 MEIWOSFDIAINFF-PJXYFTJBSA-N 284.360 2.166 10 10 CECE C[C@@H](N[C@H]1CCCN(C2CC2)C1=O)c1ccccc1O 1967475552 DKBSSVDUSARWDC-RISCZKNCSA-N 274.364 2.196 10 10 CECE CC[C@@H](NCCc1cn(CC)nn1)c1ccccc1O 1967498223 OAJGLNXESYMMLK-CQSZACIVSA-N 274.368 2.287 10 10 CECE Oc1cc(Cl)ccc1CNCCCc1cn[nH]c1 1969238267 NUWFZGKVKALDCE-UHFFFAOYSA-N 265.744 2.491 10 10 CECE CC(C)[C@@H]1C[C@H](NCCc2ccc(O)c(O)c2)CCO1 2148016501 PQHFYHGVOKGMLN-CJNGLKHVSA-N 279.380 2.434 10 10 CECE COc1ccc(CNC2CC(n3cncn3)C2)cc1C 1970807319 KZTVGVHCXPFONW-UHFFFAOYSA-N 272.352 2.088 10 10 CECE CCCN[C@H](c1ccccc1O)[C@]1(O)CO[C@H](C)[C@@H]1C 2148161488 MISXYDZKJUNNQQ-OJDYBEQGSA-N 279.380 2.219 10 10 CECE Cc1cc(N2CC[C@@H]3COCC[C@H]32)ccc1C[C@H](C)N 2145002858 GPULUSURAYSRNN-YSVLISHTSA-N 274.408 2.500 10 10 CECE Oc1cccc(CNC[C@@H]2Cc3ccccc3O2)c1O 41117854 XVKXLMRSQISJPF-ZDUSSCGKSA-N 271.316 2.191 10 10 CECE Nc1ncccc1OCc1cnsc1Br 1974668207 NPSHGCFSSAFCDK-UHFFFAOYSA-N 286.154 2.462 10 10 CECE CC(C)[C@H](O)CN(C)c1ccc(CO)cc1Cl 2002415908 QVZMRYADYHODDZ-CYBMUJFWSA-N 257.761 2.285 10 10 CECE Cc1sncc1[C@@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2150649424 QLMRUKNWANELIA-HUUCEWRRSA-N 289.404 2.177 10 10 CECE CC1(C)C[C@@H](CC(=O)O)N(Cc2ccc(O)c(O)c2)C1 2150649288 UBEQVFJVRLRPIU-LLVKDONJSA-N 279.336 2.173 10 10 CECE COC(=O)CC[C@H](N)c1ccc(N2CCCC2)c(F)c1 260615686 NYDOCCGUCZKVGI-ZDUSSCGKSA-N 280.343 2.379 10 10 CECE OC1CC2(C1)CN(c1ccc(CNC3CC3)cc1F)C2 2146326097 LSZSXWBEOXPOAH-UHFFFAOYSA-N 276.355 2.039 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@@]3(CO)C2)c(F)c1 2146312252 CXQZCXMVXVUVNH-KFNAQCHYSA-N 278.371 2.315 10 10 CECE Cc1cc([N+](=O)[O-])cnc1NCc1ccc(N)cc1 159526427 RQSZIBNJBHFDDK-UHFFFAOYSA-N 258.281 2.493 10 10 CECE CC(C)CN(C)C(=O)c1ccn(-c2ccc(N)cc2)n1 35427903 BLIRYNMOECOGRQ-UHFFFAOYSA-N 272.352 2.183 10 10 CECE CCN(CC)c1ccc(CNC[C@H](C)[S@](C)=O)cc1 159711873 HDLNHEWIPOZEDP-ORAYPTAESA-N 282.453 2.389 10 10 CECE C[C@@H](NCc1ccc(N)cc1)c1nnc2ccccn12 2148941169 JENSUSSRMILMMH-LLVKDONJSA-N 267.336 2.162 10 10 CECE CCN[C@@H](CC)c1ccc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1 2146877090 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COC(=O)[C@@H](NCCN=[N+]=[N-])c1cc(C)c(C)s1 2026967986 AXNASXVOMSPJHI-JTQLQIEISA-N 268.342 2.479 10 10 CECE NN[C@@H](c1ccc(F)c(F)c1)c1ccccc1O 2029541740 BRICQUFIKWEMBC-ZDUSSCGKSA-N 250.248 2.223 10 10 CECE CCN(CCCCO)c1ccc([C@H](C)O)cc1[N+](=O)[O-] 2159109408 ILHVFMMYACSCTG-NSHDSACASA-N 282.340 2.247 10 10 CECE C[C@H](NC[C@@H](C)CN1CCCC1)c1cc(O)ccc1O 62077768 MBBFHQJBJIBTQV-OLZOCXBDSA-N 278.396 2.480 10 10 CECE C[C@H](CN[C@H](C)c1cc(O)ccc1O)CN1CCCC1 62077774 MBBFHQJBJIBTQV-CHWSQXEVSA-N 278.396 2.480 10 10 CECE CC[C@]1(C(=O)O)CCN([C@H](C)c2c(O)cccc2O)C1 300443582 XQRLFUIXZQRZBB-BMIGLBTASA-N 279.336 2.346 10 10 CECE CN(C)CCCC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2038003834 ASAZAQFJWCHNHA-NSHDSACASA-N 253.350 2.020 10 10 CECE C[C@]1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C[C@H]1C(F)(F)F 2039126463 UKKKORICDDNAPM-BHNWBGBOSA-N 262.235 2.486 10 10 CECE CNCCC1CCN([C@H](C)c2ccc(O)cc2O)CC1 70188728 KWTKDTMWFBOEQH-GFCCVEGCSA-N 278.396 2.480 10 10 CECE C[C@H]1CCCCCN1c1ccc2c(c1)NC(=O)[C@@H]2N 70410034 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Nc1ccc(CCN=c2cc[nH]c3cccnc23)cc1 379193529 ZLVXEKPULRESED-UHFFFAOYSA-N 264.332 2.289 10 10 CECE CC[C@@H]1C[C@H](N(C)Cc2cc3c(cc2O)OCO3)CO1 711224934 ROZGZPRDIMVNRD-NWDGAFQWSA-N 279.336 2.120 10 10 CECE C[C@@H](CO)[C@@H]1CCCCN1CCOc1ccc(N)cc1 711329703 NUYOAZZQFHMMRT-BBRMVZONSA-N 278.396 2.131 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCC2(OC)OC)c1 711426687 VMLCHJKIZKFCCS-HZMBPMFUSA-N 281.352 2.203 10 10 CECE Nc1ccc(OCCN2CCC[C@@H](CF)C2)cc1 711511720 DSIGPWHHGFCVBQ-LBPRGKRZSA-N 252.333 2.329 10 10 CECE CN(C)c1ccc([C@@]2(C)[C@H](N)CCN2CC2CC2)cc1 711946157 AVAYPDCMZKKXEX-SJORKVTESA-N 273.424 2.411 10 10 CECE CC[C@@H](CNCc1cc(Cl)ccc1O)N(C)C 388947828 ZCRSLQVMBXWTEL-LBPRGKRZSA-N 256.777 2.475 10 10 CECE CC[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 691686884 OLQUMYRLZBTEST-DCAQKATOSA-N 252.318 2.103 10 10 CECE C[C@H]1CCC(C)(C)C[C@@]1(NCCCN=[N+]=[N-])C(N)=O 713063396 VWLDXGWSLPCOKA-GWCFXTLKSA-N 267.377 2.347 10 10 CECE COc1ccc(CN[C@@]23CCCN(CC2)C3)cc1C 714925825 SKDFCLKNICPFTN-INIZCTEOSA-N 260.381 2.332 10 10 CECE CC[C@H](C[C@H](C)O)N[C@@H](C)c1cc(O)ccc1O 716920043 UZGDEGBNPBPXKI-GARJFASQSA-N 253.342 2.298 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@H]2CC[C@H]1O2 386839936 UASWRLDCTWQWBV-RBSFLKMASA-N 274.364 2.185 10 10 CECE COc1ccc(N2CCC[C@H](C)[C@H]2CCO)c(N)c1 697185136 UKYZWWORUSMWOS-SMDDNHRTSA-N 264.369 2.265 10 10 CECE CNCc1ccc(N2CCC[C@](O)(C(F)(F)F)C2)cc1 718903664 YQOWBUXMEGFKJZ-CYBMUJFWSA-N 288.313 2.300 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(F)c2F)CCCO1 387701879 POAFSPFABGCBJL-LLVKDONJSA-N 270.323 2.429 10 10 CECE C[C@H]1CN(c2ccc(CNC3CC3)c(Cl)c2)C[C@@H]1O 388081099 MFTHPTMZTBDWME-BONVTDFDSA-N 280.799 2.409 10 10 CECE CC1(C)CN(Cc2cc(Br)ccc2O)C[C@H]1N 720826883 NKEVJQNTVFADJA-GFCCVEGCSA-N 299.212 2.324 10 10 CECE COc1ccc([C@H](C)NCC2=CCN(C)CC2)c(O)c1 392240938 KBWGGKITAQMLNV-LBPRGKRZSA-N 276.380 2.313 10 10 CECE C[C@@H]1C[C@H](N[C@H](C)c2cc(O)ccc2O)[C@@H](C)O1 395095503 JTIGWSVJDOMCHN-PRFIWBCESA-N 251.326 2.314 10 10 CECE CC(C)[C@]1(C)C[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 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C[C@H](N)c1ccc(N2CCC[C@H]3COCC[C@@H]32)cc1O 2170257720 UFQZXGGHDPJOPX-HUBLWGQQSA-N 276.380 2.417 10 10 CECE O=C(O)[C@@H]1C[C@H](C(F)(F)F)CN[C@H]1c1ccccc1O 2176729103 JGFVGJUSXGTVQV-NMLBEHRDSA-N 289.253 2.306 10 10 CECE C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCC[C@H]2CN=[N+]=[N-])C1 2179616669 CHPVVHXIMKIKOE-UPJWGTAASA-N 279.388 2.266 10 10 CECE CN1CCCc2cc([C@]3(O)CCN[C@H]3C3CC3)ccc21 2188249466 BMAKGCQFYJPAIJ-DLBZAZTESA-N 272.392 2.029 10 10 CECE O=C(CN1CCC12CC(CF)C2)c1ccc(O)c(O)c1 2182235053 KODONBJSOWXJPX-UHFFFAOYSA-N 279.311 2.105 10 10 CECE CCNCc1ccc(N2CCC[C@@H]3[C@@H]2CCN3C)cc1 2183752972 WMKHWSDHSWZNBP-SJORKVTESA-N 273.424 2.469 10 10 CECE CCCCN(CC(N)=O)c1ccc2c(c1)CCC[C@H]2N 2184693184 NJMAVVQFJHMAQD-OAHLLOKOSA-N 275.396 2.115 10 10 CECE CO[C@@H]1CC[C@@H]2CN(c3ccc4c(c3)CC[C@H]4N)C[C@@H]21 2184724121 VLJGOAHBVUSTDI-VJUNAUMWSA-N 272.392 2.494 10 10 CECE CN[C@@H]1CCc2cc(N3CCn4nccc4C3)ccc21 2184730445 VROYZCQIHCRBGU-MRXNPFEDSA-N 268.364 2.110 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@H](O)C(F)(F)C3)ccc21 2184728224 VGAROGLYNKSSMZ-KBPBESRZSA-N 282.334 2.100 10 10 CECE Oc1cccc(F)c1CNC[C@H]1C[C@@H](n2ccnc2)C1 2184866774 LWFMLKVXSUTZDO-TXEJJXNPSA-N 275.327 2.469 10 10 CECE CO[C@H]1CC[C@@H](NCc2ccc(O)c(O)c2)CC1 2042524696 SVRRQKHFAFFUOB-TXEJJXNPSA-N 251.326 2.145 10 10 CECE C[C@@H]1NC[C@@H](C)N(Cc2c(O)cccc2F)[C@@H]1C 2042636835 BUSQKMMETHALFS-OUAUKWLOSA-N 252.333 2.102 10 10 CECE CCNC1CCN(c2ccc(OC)cc2F)CC1 2044340837 PQJGDBSIVXUCHZ-UHFFFAOYSA-N 252.333 2.413 10 10 CECE CO[C@@H]1CN(c2ccc(CCN)c(C)c2)CC(F)(F)C1 2185150663 QZAPDAVYNRHDRM-AWEZNQCLSA-N 284.350 2.357 10 10 CECE Oc1ccc(Cl)cc1CN1C[C@H]2CCNC[C@H]2C1 2049692474 GVSKWGXICCOYAW-PWSUYJOCSA-N 266.772 2.087 10 10 CECE CCn1nc(CNCc2ccc(OC)cc2O)cc1C 2185719376 WFQWCWLERHYCDY-UHFFFAOYSA-N 275.352 2.215 10 10 CECE CC[C@@H](O)c1ccc(N2CC[S@@](=O)[C@H](C)C2)cc1 2051901852 GSABFAWLUCGGTL-YRILPIOLSA-N 267.394 2.087 10 10 CECE CC[C@H](c1ccccc1O)N1CC[S@](=O)C[C@H]1C 2051942787 WDALLRGCJINHQK-BVRBVLIYSA-N 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COc1ccc(N(C)C(=O)C=Cc2cncc(F)c2)cn1 2297490856 BLDXGVREYKTEBY-UHFFFAOYSA-N 287.294 2.301 10 10 CECE NC[C@@H]1C[C@@H]2CC[C@H]1N2Cc1cc(Cl)ccc1O 2309702309 LTCXGHCNRVQLBL-TVYUQYBPSA-N 266.772 2.357 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@@H]3CN)c(F)c1 2309709212 WXYUZIMYKQHESO-BREBYQMCSA-N 250.317 2.150 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)cc1Cl 2309942629 OWZOLGRDCBJEPI-HZZFPTLFSA-N 267.756 2.353 10 10 CECE CS[C@H]1C[C@@H](COC(=O)Cc2ccc(N)cc2)C1 2314263752 XXHXYDYRVFESDY-BJHJDKERSA-N 265.378 2.496 10 10 CECE CCC(CC)NC(=O)[C@H](C)N(CC)CCN=[N+]=[N-] 2315992033 GMCHQXQOCVQAGC-JTQLQIEISA-N 255.366 2.312 10 10 CECE CN[C@](CSc1nccs1)(CC1CCC1)C(=O)O 2318371706 ICNMCXJCRQGCPO-LBPRGKRZSA-N 286.422 2.468 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCCC[C@H]2C[C@H]21 2319450835 KRRLLIRSDFYXGD-UMNHJUIQSA-N 252.318 2.008 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H]3CO)c(F)c1 2329059685 JJFDCKNWEXACIA-LHMODEAPSA-N 264.344 2.195 10 10 CECE Nc1ccc(CCCNC[C@@H]2C[C@H]3CC[C@@H]2O3)cc1 2330006285 CENICVSJCMLXOH-IMJJTQAJSA-N 260.381 2.359 10 10 CECE CC[C@@H](N)c1ccc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)cc1 2330987745 MALGPQMACOWLKA-BVUBDWEXSA-N 260.381 2.446 10 10 CECE C[C@H](N[C@H]1CC[C@@H]2C[C@]12CO)c1cc(F)ccc1O 2331798077 QDYVDWJJXQZWIU-WVGQAWGZSA-N 265.328 2.343 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@H]2[C@H]2C[C@H]23)cc1OC 2333187956 NTSQRAWXCISCTR-MXAVVETBSA-N 258.365 2.259 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H](C(=O)O)[C@@H]2C[C@@H]21 2344009375 NVLFRFPDTCGFRM-BQUFFADESA-N 261.321 2.248 10 10 CECE COc1cccc(O)c1CN[C@H]1C[C@@H]2C[C@H]1C[C@@]2(C)O 2355729162 LVZDUEAUBAYBSI-XALPAYFRSA-N 277.364 2.040 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2C[C@H]1[C@@H]2CCOC[C@@H]21 2355958048 AIAMGTMPIFYDTD-MEYUZBJRSA-N 272.392 2.351 10 10 CECE O=C(O)C1=NN(c2ccc(Cl)c(Cl)c2)C(=O)C1 104712934 BFNDBLUQWZCJEM-UHFFFAOYSA-N 273.075 2.171 10 10 CECE Cc1cc(C)c(O)c(CN(C)CC(=O)NC(C)(C)C)c1 111891026 JJFYJCPCRNMBES-UHFFFAOYSA-N 278.396 2.356 10 10 CECE COc1ccc(CN2CCCN(C3CC3)CC2)c(O)c1 179733395 PYMMAPRJODOIJH-UHFFFAOYSA-N 276.380 2.071 10 10 CECE C[C@@H](NCc1nnc2ccccn12)c1ccc(F)cc1O 62745269 MOBPGISAEOOXGD-SNVBAGLBSA-N 286.310 2.425 10 10 CECE Cc1cc(C(=O)N2CCN(C)CC2)c(C)n1-c1ccccc1 68050575 RAEMDNFNZZBIJP-UHFFFAOYSA-N 297.402 2.482 10 10 CECE Oc1c(CN[C@@H]2C[C@H]3[C@@H]2[C@@H]2CC[C@H]3O2)ccc(F)c1F 2356929545 UCSYEZSXJIIGAO-XTAFZBPGSA-N 281.302 2.326 10 10 CECE C[C@H]1CN(c2c(F)cc(CN)cc2F)CCCO1 62719253 HTXUJTLDQXQNJP-VIFPVBQESA-N 256.296 2.039 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CC[C@H](C2)[C@@H]1C(=O)O 2357922447 QVJRJNJUWFGSBL-DLVJRCHESA-N 277.320 2.096 10 10 CECE C[C@@H]1OCC[C@H]1SCC(=O)Nc1ccc(N)cc1 235293672 QLNZXDCSJIDHBP-JOYOIKCWSA-N 266.366 2.118 10 10 CECE CN(C)C[C@@H]1CCCN1c1ccc(/C=C\C(=O)O)cc1F 212766230 VDZQLKDSXFFABC-WOLRVDTOSA-N 292.354 2.454 10 10 CECE C[C@@H]1CCC[C@H](OC(=O)[C@@H](N)Cc2ccc(O)c(O)c2)C1 40953853 UINULACLFWVEAD-WXHSDQCUSA-N 293.363 2.090 10 10 CECE CC[S@](=O)CCN[C@H](C)c1ccc(N(C)C)cc1 130854680 XBMODZUKVDQZFR-KZULUSFZSA-N 268.426 2.172 10 10 CECE C[C@@H]1CCN(c2ccc(CN)cc2Br)[C@@H]1CO 226907736 HLGVQIRRQZJWKH-NOZJJQNGSA-N 299.212 2.115 10 10 CECE COc1ccc(CN2CCC[C@@H]2c2cnn(C)c2)c(O)c1 131962224 ZNUIVLTWLLGVRS-OAHLLOKOSA-N 287.363 2.471 10 10 CECE Oc1cccc(CNc2ccccc2-n2cncn2)c1O 41117192 NWNWEFHMUQWYSH-UHFFFAOYSA-N 282.303 2.291 10 10 CECE O=C1N[C@H](c2cc(Br)cc(F)c2O)CCO1 95718614 TWSXKAXRJZPUOP-QMMMGPOBSA-N 290.088 2.465 10 10 CECE C[C@](NCCN=[N+]=[N-])(C(N)=O)c1ccc(F)cc1Cl 90257687 AJEBFKVRACCDAU-LLVKDONJSA-N 285.710 2.080 10 10 CECE C[C@H](N[C@H]1CCC[C@H]1O)c1ccc(N2CCOCC2)cc1 246490936 RVNQCJXOBLCVDQ-RRQGHBQHSA-N 290.407 2.087 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)c2cn[nH]c2)c1 273345737 APJAPZIGPJPQAQ-VHSXEESVSA-N 289.335 2.314 10 10 CECE C[C@H](O)C[C@@H]1CCCCN1c1ccc(CN)cc1F 387988466 JQYHDRFTEWJAMY-AAEUAGOBSA-N 266.360 2.414 10 10 CECE Nc1ccc(COC[C@H](O)CN2CCCCCC2)cc1 380616628 IITVQWYDPUQQFR-MRXNPFEDSA-N 278.396 2.022 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1ncc(Cl)n1C 2164081749 VJSMLRLBSAASOO-CQSZACIVSA-N 290.798 2.375 10 10 CECE Cc1nc(/C=C/C(=O)NCc2ccccc2O)cs1 706281159 COENQLARVNVSKO-VOTSOKGWSA-N 274.345 2.487 10 10 CECE CN(C[C@@H]1C[C@H]1C(C)(F)F)C(=O)c1ccc(O)c(O)c1 2164442829 QQOAWVNDIQLUML-VHSXEESVSA-N 285.290 2.461 10 10 CECE N[C@@H]1C[C@H]2C[C@H]1C[C@@]2(O)c1ccc(N2CCCC2)cc1 2164488611 ACSQWETTXUJHOD-LBRJOISOSA-N 272.392 2.232 10 10 CECE CCN[C@H](C)c1ccc(N2CCO[C@H](COC)C2)cc1 706584580 LXFPCWDSLXXSBK-CJNGLKHVSA-N 278.396 2.209 10 10 CECE CN[C@H](C)c1ccc(N(C)CC(=O)NC(C)C)c(F)c1 723163282 GMLJQULNNWCYEB-LLVKDONJSA-N 281.375 2.067 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H]3C[C@H]4C[C@H]4CO3)ccc21 2163077396 VFHDQXZPSHQOCQ-OHFALNGGSA-N 272.392 2.494 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H](N)CC(C)(F)F)ccc21 2163091823 KVSFGAKIQJHACR-JSGCOSHPSA-N 284.350 2.475 10 10 CECE NN[C@@H](Cc1cncs1)c1ccc(N2CCCC2)cc1 2163100239 PHOWAKKEEVWSHK-HNNXBMFYSA-N 288.420 2.490 10 10 CECE CN1CCCc2cc([C@@H](O)c3cccc(N)n3)ccc21 2163109062 VZDSHNPVMNBZBB-MRXNPFEDSA-N 269.348 2.128 10 10 CECE CCSCC[C@@H](O)[C@@H](NC)c1ccc2c(c1)CCN2C 2163138282 LORBUEPFBKDTBA-CVEARBPZSA-N 294.464 2.444 10 10 CECE C[C@@H]1C[C@H]1N(CCO)c1ccc(CO)cc1C(F)(F)F 2167110538 XEBHMDOYIROYOU-NOZJJQNGSA-N 289.297 2.405 10 10 CECE N[C@H]1CCC[C@@H]1NCc1ccc(N2CCSCC2)cc1 817887737 DIRASLLKDDEQEU-HOTGVXAUSA-N 291.464 2.209 10 10 CECE CN1C[C@@H]2CCN(Cc3cc(Cl)cc(F)c3O)[C@@H]2C1 814173731 PDIKVPZTVMTXSL-TVQRCGJNSA-N 284.762 2.321 10 10 CECE CCOc1cccc([C@@H](CC)N2CCNCC2)c1O 575273322 OOMVRLLDZAPZEZ-CYBMUJFWSA-N 264.369 2.147 10 10 CECE CC[C@@H]1[C@@H](C(=O)N[C@H](C)c2ccccc2O)CCN1C 827952119 GQRAFWXDXFXVNC-KWCYVHTRSA-N 276.380 2.300 10 10 CECE CC[C@H](NC1CC(CC(N)=O)C1)c1ccc(C)cc1O 903261269 VNXLZAGMOMIPFT-YIZWMMSDSA-N 276.380 2.395 10 10 CECE COc1ccc(CNC(=O)NC[C@@H]2C[C@H]2C2CC2)c(O)c1 836661486 XICBCVYSOUVCOL-JSGCOSHPSA-N 290.363 2.246 10 10 CECE OCC1(c2ccccc2)CN(Cc2cc(F)ccc2O)C1 840969906 LYUIEQFTMKKLQJ-UHFFFAOYSA-N 287.334 2.277 10 10 CECE C[C@H]1C(=O)N(C)CN1Cc1cc(Cl)cc(Cl)c1O 843435654 QHYHSIGPCMWQLG-ZETCQYMHSA-N 289.162 2.319 10 10 CECE CCOC(=O)[C@@](C)(N)c1cc(Cl)cc(Cl)c1O 1951740387 SXXSNKWZLPUOJI-NSHDSACASA-N 278.135 2.436 10 10 CECE CN[C@H](COC)c1cccc(Br)c1O 1951971922 XAHVLHFZDCGBAD-SECBINFHSA-N 260.131 2.062 10 10 CECE CC(C)(C(=O)NCc1c(O)cccc1F)N1CCCCC1 928710163 OZRQMCJSSRQQFE-UHFFFAOYSA-N 294.370 2.412 10 10 CECE CCOc1ccc(O)c(CN[C@H]2CC[C@@H](C)NC2)c1 863484764 LVAVVWFNKCRKCP-YPMHNXCESA-N 264.369 2.021 10 10 CECE [N-]=[N+]=NC1CN(C(=O)CCOCc2ccccc2)C1 1953503929 ISHRWQQYKNRLJS-UHFFFAOYSA-N 260.297 2.114 10 10 CECE O=C([C@@H]1C[C@H]1c1cccnc1)N1Cc2cccc(O)c2C1 871205644 IZOJKKPPDXQUAG-UONOGXRCSA-N 280.327 2.433 10 10 CECE Cc1cnc(CN2CCOc3cc(N(C)C)ccc32)nc1 774752848 MXNCUOYZEGLNOB-UHFFFAOYSA-N 284.363 2.250 10 10 CECE O=C(c1onc2c1CCCC2)N1Cc2cccc(O)c2C1 871205174 QEEXQGPDINGTHJ-UHFFFAOYSA-N 284.315 2.415 10 10 CECE CC(C)(C)OC(=O)N1CCCN1Cc1cc(N)ccc1O 1955923701 AMEVYZCDBRJVRR-UHFFFAOYSA-N 293.367 2.332 10 10 CECE COC(=O)c1cnccc1NCc1ccccc1O 83429918 RLNLMMYYMLTLPW-UHFFFAOYSA-N 258.277 2.186 10 10 CECE CCC[C@@H](C)c1nnc([C@@H](N)c2cccc(O)c2O)o1 83580584 HAGZHSNDGVCDTK-KCJUWKMLSA-N 277.324 2.433 10 10 CECE O=C(O)c1ccccc1[C@@H]1NCCc2cccc(O)c21 83659614 WYKYEEBUBQBVRX-HNNXBMFYSA-N 269.300 2.326 10 10 CECE Cc1c(O)cccc1[C@H]1NCCc2cc(O)c(O)cc21 83724405 VDOCQYFWBKHTJA-MRXNPFEDSA-N 271.316 2.347 10 10 CECE Cc1cnccc1[C@H]1NCCc2ccc(O)c(O)c21 83724070 GAUAZCJXYBJLSB-CQSZACIVSA-N 256.305 2.036 10 10 CECE CC[C@@H](Cn1cncn1)NCc1ccc2c(c1)CCCN2C 788585895 XJKLZOPNZSPBSL-INIZCTEOSA-N 299.422 2.229 10 10 CECE Cc1ccc(CN2C[C@H]3CC[C@H]2[C@@H](CO)C3)c(O)c1 895943402 AWYXFZAECCXIQC-CFVMTHIKSA-N 261.365 2.293 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2COc1ccccc1 75794332 URVXHPIXYYEITO-CQSZACIVSA-N 271.316 2.364 10 10 CECE CC[C@@]1(C)CN(CCO)c2ccc(OC)cc2N1 76931122 WGKHQXAYNVEQMG-AWEZNQCLSA-N 250.342 2.088 10 10 CECE Cc1cc(O)c(CN[C@H](CO)C[C@@H](O)C(C)(C)C)cc1C 790619741 RGZIXZQGCMKQNA-GOEBONIOSA-N 295.423 2.257 10 10 CECE CN(C)c1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)ccn1 701291619 OWQJUFXEYBBMKG-NSHDSACASA-N 274.328 2.063 10 10 CECE C[C@H](N)c1ccc(N2CC([C@H](C)O)C2)cc1Cl 719748757 SVKNUHAZCNIHMQ-IUCAKERBSA-N 254.761 2.177 10 10 CECE COc1ncc(CN(C)c2ccc3c(c2)OCO3)c(C)n1 799145249 OUACVVXUNRITBO-UHFFFAOYSA-N 287.319 2.159 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@H]3CC[C@@H](C2)S3)cc1 703797664 BVLDRONTWQVRTF-KGLIPLIRSA-N 291.420 2.177 10 10 CECE CN(Cc1cc(F)cc(F)c1O)C1(C(=O)O)CCCC1 708089159 KHKZPRHPWNEBFQ-UHFFFAOYSA-N 285.290 2.500 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1COC2(CCC2)C1 688274159 RKJRNNBMQWWCIX-LBPRGKRZSA-N 251.301 2.333 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)c(Cl)c1 709892897 DKXFCXWAVZAMAW-UTUOFQBUSA-N 266.772 2.148 10 10 CECE CC(C)(O)C1CCN(c2c(F)cc(CN)cc2F)CC1 716361249 GBYFOBLRXVAODO-UHFFFAOYSA-N 284.350 2.411 10 10 CECE CCN(C[C@H](C)O)c1ccc(CN)c(Br)c1 691404617 QUJGIVHAKQSKSK-VIFPVBQESA-N 287.201 2.115 10 10 CECE NCc1ccc(N2CCC23COC3)c(C(F)(F)F)c1 2115165693 XWCLCASLSMZKDH-UHFFFAOYSA-N 272.270 2.143 10 10 CECE CN(Cc1cc(N)ccc1O)[C@@H]1CCCCC[C@@H]1O 2115912791 AYYFQTXBKGWMEE-HIFRSBDPSA-N 264.369 2.100 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](CN)C3)cc1 2117662232 BNBFCOIVTUHJRK-KBMXLJTQSA-N 259.397 2.064 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@@H](CO)C2)cc1O 226455593 SCBFRTJOJLEQQI-QWHCGFSZSA-N 278.396 2.271 10 10 CECE Nc1ccc(N2CCN([C@@H]3CCC[C@H]3F)CC2)cc1 2118864055 HLNXITBOLQMMEI-HUUCEWRRSA-N 263.360 2.281 10 10 CECE Cc1ccc([C@](C)(N)c2ccc(N(C)C)cc2)nn1 2119378695 KGNZTYSPSJYBCD-OAHLLOKOSA-N 256.353 2.073 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H](O)[C@H]2C3)c(F)c1 2120642049 VYYNFTHULYVRGR-RZCHIYRCSA-N 264.344 2.066 10 10 CECE COc1cccc(C(=O)N2CCC(N=[N+]=[N-])CC2)n1 2125337493 SUTXJTDKTHQIGW-UHFFFAOYSA-N 261.285 2.005 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)C[C@@H]1F 2128279209 MUZFOLLVINHDCA-SOUVJXGZSA-N 265.328 2.229 10 10 CECE N[C@H]1CCc2cc(N3CC[C@]4(CCCO4)C3)ccc21 2128321920 NRVJZZHTYZUREV-JKSUJKDBSA-N 258.365 2.392 10 10 CECE Cc1cc(N2CCC3(CC[C@@H]3O)CC2)ccc1CN 2130899907 GGMVMXOTLFOMNX-HNNXBMFYSA-N 260.381 2.195 10 10 CECE CN(CC1(F)CCC1)c1ccc(CO)c([N+](=O)[O-])c1 2132057978 KQPCCYFMAYCAHY-UHFFFAOYSA-N 268.288 2.416 10 10 CECE Nc1ccc(O)c(CNC(=O)CC2CC(F)(F)C2)c1 2131098350 XNUJSMYOWCKZPW-UHFFFAOYSA-N 270.279 2.026 10 10 CECE C[C@H](c1cc(O)ccc1O)N1C[C@H](CN)CC1(C)C 2132471095 JKNCHFHEWFALFR-MNOVXSKESA-N 264.369 2.218 10 10 CECE COc1cc(N)ccc1OCCc1ccc(N)cc1 1904081038 CDKPMMVLKAHROM-UHFFFAOYSA-N 258.321 2.481 10 10 CECE Nc1ccc(CCN2[C@H]3CC[C@@H]2[C@H]2CC[C@H]3O2)cc1 1900614372 MUTJNQGOEOVQMC-QKPAOTATSA-N 258.365 2.206 10 10 CECE C[C@@H](O)c1ccc(N(C)C2COCCOC2)c(Cl)c1 2131503229 PBWOEVOQZMPBDM-SNVBAGLBSA-N 285.771 2.245 10 10 CECE C[C@H]1CCCN(C(=O)c2cc(O)c(O)c(O)c2)[C@H]1C 2132348792 SGLHVPNSPCZFTA-IUCAKERBSA-N 265.309 2.064 10 10 CECE COc1ccc(CNCCOC2CCCC2)c(O)c1 104154804 OBFZLLYGGTUFLA-UHFFFAOYSA-N 265.353 2.450 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2cccc(Cl)n2)C1 1912171347 JJZJGIFATQVQKU-SSDOTTSWSA-N 251.677 2.260 10 10 CECE C[C@H]1C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)C[C@@H](C)O1 1912160024 PMUJKJIKSINJRF-VLEAKVRGSA-N 252.318 2.101 10 10 CECE Cc1cc2ccccc2n1CC(=O)N1CC(N=[N+]=[N-])C1 1912170690 ALTBUPRIGNJBPX-UHFFFAOYSA-N 269.308 2.471 10 10 CECE [N-]=[N+]=NCC1CCN(S(=O)(=O)[C@@H]2CC23CCC3)CC1 1912175901 RLJVTZNHRXHHSE-LLVKDONJSA-N 284.385 2.281 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)Nc1c(F)cccc1F 1912148806 XXAAKTSJLHVQJF-UHFFFAOYSA-N 269.255 2.145 10 10 CECE CC[C@@H]1C[C@@H]1[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2135153817 SDXHHKSFGGIIBW-UHDJJACNSA-N 260.381 2.086 10 10 CECE C[C@H](O)c1ccc(N2CC3(CCOCC3)C2)cc1O 1915330892 LAKGYOFVVLODPE-NSHDSACASA-N 263.337 2.062 10 10 CECE Cc1ccc(NC(=O)c2cccc(O)c2O)c(N(C)C)n1 1466312965 PWERKDAFCIZYKB-UHFFFAOYSA-N 287.319 2.120 10 10 CECE CNCc1ccc(N2C[C@@H](N(C)C)[C@H](C)C2)c(Cl)c1 227232335 WMLOKTUAEXMAFZ-IAQYHMDHSA-N 281.831 2.446 10 10 CECE CC[C@H](c1ccccc1O)N1CC[C@H](NC(=O)OC)C1 228354714 KROAHSUEUDLSHR-WCQYABFASA-N 278.352 2.274 10 10 CECE C[C@H](NC[C@@H]1CCC[C@H]1N(C)C)c1ccc(O)cc1O 1924679413 LQRBYKHPZBAWRM-SLEUVZQESA-N 278.396 2.479 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc2nn[nH]c12 1569372857 JCWOLVSLTOLMNZ-ALCCZGGFSA-N 296.286 2.021 10 10 CECE Oc1cc2c(cc1CNC1(C(F)(F)F)CC1)OCO2 229655398 CASLIQRUHGXORA-UHFFFAOYSA-N 275.226 2.305 10 10 CECE CC(=O)NN1C(=O)/C(=C\c2cccc(F)c2)SC1=S 5226366 YBTSVWRNDHEOEK-UXBLZVDNSA-N 296.348 2.078 10 10 CECE CC(=O)C(=O)[C@@H](O)c1cccc(OCc2ccccc2)c1 1929124081 JLNBPQZHHQLQDQ-KRWDZBQOSA-N 284.311 2.457 10 10 CECE C[C@@H](NCc1cccc(CO)c1)c1cc(O)ccc1O 230972005 KJCMVKVYHXBPNE-LLVKDONJSA-N 273.332 2.441 10 10 CECE C[C@@H]1CC[C@@H](CN2CCN(c3ccc(N)cc3)C2=O)O1 232033707 JICZVJHIYZMKGF-RISCZKNCSA-N 275.352 2.078 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1ccc(O)c(F)c1 232437393 SYRSYSRAGWLIDV-LLVKDONJSA-N 282.275 2.035 10 10 CECE COCCN(C)c1ccc(C=CC(=O)O)cc1F 1876378775 SECNNFKDERFCPJ-UHFFFAOYSA-N 253.273 2.006 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCN2CCCC[C@H]12 161073328 MICJJGAGUWIWRW-ZIAGYGMSSA-N 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275.348 2.258 10 10 CECE CC1(C)[C@@H]2C[C@H]1CN(c1ccc3c(c1)NC(=O)[C@@H]3N)C2 2237481503 PXSUJWBJPFDGHY-ISTVAULSSA-N 271.364 2.121 10 10 CECE CCCNCc1cc(OC)ccc1N(C)[C@H](C)CO 2227674200 VDOZVABIBJZJGP-GFCCVEGCSA-N 266.385 2.012 10 10 CECE CCNCc1cc(OC)ccc1N(C)CC[C@@H](C)O 2227683235 URGZEHDNBJYMIN-GFCCVEGCSA-N 266.385 2.012 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CCc1cnn(C)c1 2240835181 HKRVNYPKNVZGBE-CYBMUJFWSA-N 273.380 2.461 10 10 CECE Cc1nscc1CC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2254289648 HQGNIGSHGIQUGF-UWVGGRQHSA-N 265.342 2.342 10 10 CECE COc1ccc(N2CCSC[C@@H]2CO)c(C)c1C 2256946022 QQGXDKPELVBKAN-LBPRGKRZSA-N 267.394 2.226 10 10 CECE COc1ccc(N)c(NCc2cnc(SC)s2)n1 2257097092 NUCSPPZLHYZKDM-UHFFFAOYSA-N 282.394 2.463 10 10 CECE CSc1ncc(CNC[C@]2(N)CCC[C@H]3C[C@H]32)s1 2257109333 WLDSITUBNUIMIO-UFGOTCBOSA-N 283.466 2.472 10 10 CECE COc1cc(C)c(N2C[C@@H](F)C[C@@H](O)C2)c(C)c1 2257403396 FYZBQAKVIZIDJE-NWDGAFQWSA-N 253.317 2.221 10 10 CECE CN[C@H](C)c1ccc(N(C)CC[C@@H](C)O)cc1C 2257469866 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C[C@H]1CC[C@@H](CN)N(c2ccc3c(c2)OCCCO3)C1 1144536069 QPWUPGCBOJZNFI-JSGCOSHPSA-N 276.380 2.412 10 10 CECE CC1(C)NCCC[C@]1(Sc1nccs1)C(=O)O 2307041163 IBPFSWMZZSGZKW-NSHDSACASA-N 272.395 2.221 10 10 CECE CCc1nc(C)c(C(=O)N(CC)CCN=[N+]=[N-])o1 2315986145 AWKSHVICQQPFMN-UHFFFAOYSA-N 251.290 2.318 10 10 CECE CSc1ncc(CNCc2ncc3n2CCC3)s1 2316325899 MUMDXNIRAJHDSY-UHFFFAOYSA-N 280.422 2.298 10 10 CECE CSc1cc(N(C)[C@@H]2CO[C@@H](C)C2)ccc1CN 2328536824 UTOTYYDTXNNHIF-GWCFXTLKSA-N 266.410 2.481 10 10 CECE CN(C)c1ccc([C@H](N)[C@]2(O)C[C@H]3C=C[C@@H]2C3)cc1 2329489142 YXGBMLOEVLPESO-YOENINGUSA-N 258.365 2.080 10 10 CECE CCc1cccc(CN[C@@H]2C[C@@H](CO)[C@@H]3C[C@H]23)c1O 2329876286 CKOVCGZMHBARCI-ZQDZILKHSA-N 261.365 2.061 10 10 CECE C[C@@H](NC[C@H]1C[C@@H]2C[C@@H]2CO1)c1ccc(O)cc1O 2331053058 MCKNKJCFNZFZLM-LSCVPOLPSA-N 263.337 2.173 10 10 CECE C[C@@H](N)c1ccc(N(C)CCOC2CCC2)cc1O 2338459024 ACHDMYYKRYBTBR-LLVKDONJSA-N 264.369 2.417 10 10 CECE C[C@@H]1[C@H](CO)CCN1c1ccc(CO)c(C2CC2)c1 2339159396 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C[C@@H](CN[C@@H](C)c1c(O)cccc1O)CN1CCCC1 235135154 PEALJGKAMVWUCP-STQMWFEESA-N 278.396 2.480 10 10 CECE Cc1cc(N)ccc1N1C(=O)[C@]23CCC[C@@]2(C3)C1=O 2142223176 ZNUAYZDZQAZJSL-HUUCEWRRSA-N 256.305 2.011 10 10 CECE CN1CCC[C@H](N(C)c2ccc(CN)c(F)c2)CC1 1877823895 SKFVUKNQLKGNBQ-ZDUSSCGKSA-N 265.376 2.205 10 10 CECE CN(C)c1ccc(N)c(OCCCN(C)C2CC2)c1 1879256639 LSYRTKRNTBKYJT-UHFFFAOYSA-N 263.385 2.198 10 10 CECE C[C@@H](O)c1ccc(N2CC(c3cnn(C)c3)C2)cc1 1882894161 FBGJTSKUKVIDGV-LLVKDONJSA-N 257.337 2.077 10 10 CECE COc1ccc(N2CCN(C[C@H]3CC3(F)F)CC2)cc1 1963439216 DGFPKMMYGBJSAS-GFCCVEGCSA-N 282.334 2.472 10 10 CECE CC(C)(C)[C@H]1NC[C@@H]1NCc1ccc2c(c1)CCO2 1887654312 XCTRZIPLXMVGHT-ZFWWWQNUSA-N 260.381 2.098 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H](N)c3cncs3)ccc21 2147838192 ZFZNWYHJAZUVLJ-HUUCEWRRSA-N 289.404 2.259 10 10 CECE CC1(C)[C@@H](C(=O)NCc2ccc(N)cc2)C1(F)F 1966807137 MNTXWOZIFGTLEH-SNVBAGLBSA-N 254.280 2.176 10 10 CECE C[C@H]1CC[C@@H](CC(=O)N(C)Cc2ccccc2O)O1 1968858252 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CCn1cnc(Sc2nccs2)c1C[C@@H](C)N 2006582769 RQBQYQKCYVNBGY-MRVPVSSYSA-N 268.411 2.400 10 10 CECE Oc1ccc(CNc2cnc(Cl)cn2)c(O)c1 2008700564 AWCNBHIDEYFDQV-UHFFFAOYSA-N 251.673 2.153 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H]2C)cc1Br 2011373712 QEYKMQHYGGQZJL-ZDMBXUJBSA-N 299.212 2.299 10 10 CECE CN(C[C@H]1C[C@@H]1C(F)F)c1ccc([N+](=O)[O-])c(CO)c1 2159775844 KIWNNUYAUDVNQT-KCJUWKMLSA-N 286.278 2.425 10 10 CECE OCc1ccc(N2CC[C@H]3COC[C@@H]32)c(Cl)c1 2021412447 KVSADJXAPWDZNO-GWCFXTLKSA-N 253.729 2.057 10 10 CECE CCCN(c1ccc(N)cc1)[C@@H]1C[C@H](COC)C[C@H]1O 2155671397 MNNQBQAEXLEUGH-APHBMKBZSA-N 278.396 2.271 10 10 CECE CCCN(C[C@H](O)COC(C)C)c1ccc(CN)cc1 2155694523 DKYQYFFXPGDTRI-INIZCTEOSA-N 280.412 2.148 10 10 CECE C[C@@]12C[C@@H](CO1)N(Cc1ccc(F)c(F)c1O)C2 2028067686 UYQQPXWKKLIVLF-ZANVPECISA-N 255.264 2.034 10 10 CECE C[C@@H]1COCC[C@@H]1N(C)c1ccc(CO)cc1F 2031926669 VVGQRPUDBOHNNT-MFKMUULPSA-N 253.317 2.179 10 10 CECE Nc1ncccc1OCc1ccc2nsnc2c1 2034192585 AVMACDLIZGUXDW-UHFFFAOYSA-N 258.306 2.248 10 10 CECE COc1ccc(CNCC23CC(C)(C2)O[C@H]3C)c(O)c1 2156675859 NDUBUEOMDMDEBT-SOISORPOSA-N 277.364 2.448 10 10 CECE CCCN(CCOC)CCOc1ccc(N)cc1 2036721491 BAJZIGSKEVROSM-UHFFFAOYSA-N 252.358 2.006 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CC[C@@H]2[C@@H]1C2(F)F 2040540348 DVYUBTSSEIJZCO-IWSPIJDZSA-N 258.272 2.437 10 10 CECE C[C@@H](NC1CC(n2cccn2)C1)c1c(O)cccc1O 2159857797 XCVNFUHQNZAOHI-VOMCLLRMSA-N 273.336 2.349 10 10 CECE CO[C@@H]1C[C@]2(C(=O)N3CCCC[C@@H](CN=[N+]=[N-])C3)C[C@H]12 2157485160 BVBJIFYVGDODKP-FMCLSXCISA-N 278.356 2.350 10 10 CECE C[C@H](N)c1ccc(N(CCCO)C2CC2)c(F)c1 404211864 VZPQFCNZNSCHIG-JTQLQIEISA-N 252.333 2.197 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)[S@](C)(=N)=O 404806481 TVCNOUSBMPJOCW-KRWDZBQOSA-N 255.387 2.166 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H](N)C23CCC3)cc1 405206195 GGRJPIKWOWXUCU-LSDHHAIUSA-N 259.397 2.112 10 10 CECE c1cc2c(cc1CNC1[C@H]3CC[C@H]1CNC3)CCCO2 2160561492 RKMLICCNPVBKBE-GJZGRUSLSA-N 272.392 2.099 10 10 CECE CCOC(=O)C[C@@H](C)NCc1ccc2c(c1)CCCO2 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CN1CCC[C@H]1[C@H]1CCCN1c1ccc(CO)cc1F 2171438109 XJIINJNQIYPAPV-JKSUJKDBSA-N 278.371 2.381 10 10 CECE CCNCc1ccc(N2CC(n3cncn3)C2)c(Cl)c1 707680718 WAVFXFXWLIKGPN-UHFFFAOYSA-N 291.786 2.102 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2)C[C@@H](C)C1O 688052803 GRZWZJAQVWBMIM-CHWSQXEVSA-N 274.408 2.392 10 10 CECE COc1ccc(N(C)[C@@H]2COC[C@H]2C(C)C)c(N)c1 688202412 YUZBDAVLRGMNLR-SWLSCSKDSA-N 264.369 2.385 10 10 CECE CCCN(C(=O)[C@@]12COC[C@H]1C2)c1ccc(N)cc1 689151762 DATGOZXKFUFLAI-ABAIWWIYSA-N 260.337 2.048 10 10 CECE Oc1ccc(F)cc1CN1C[C@@H]2[C@H]3CC[C@@H](O3)[C@H]2C1 378495634 NGDDXPXQWGTODJ-DDHJSBNISA-N 263.312 2.141 10 10 CECE C[C@@H](NCCO[C@H]1CC1(F)F)c1c(O)cccc1O 690744479 WSWXSTFEUDBEEW-KCJUWKMLSA-N 273.279 2.173 10 10 CECE C[C@@H]1CCC[C@H]1N(C)c1cc2c(cc1F)[C@H](O)C(=O)N2 691182431 RQBYOKIEJNSDPF-RGZBUGHASA-N 278.327 2.436 10 10 CECE Oc1ccc(CN2CCC3(CCNCC3)CC2)c(O)c1 380263237 TZENUZRACMDGOP-UHFFFAOYSA-N 276.380 2.063 10 10 CECE CN1CCc2cc([C@@H](O)c3cccc(CN)c3)ccc21 2163068200 FLDFOBFVFNLLRI-KRWDZBQOSA-N 268.360 2.219 10 10 CECE CN1CCCc2cc([C@@H](O)c3cnc(CN)s3)ccc21 2163095840 DZNIAKGNEJONLD-OAHLLOKOSA-N 289.404 2.066 10 10 CECE COc1ccc(O)c(CN[C@@H]2CCC[C@H](N(C)C)C2)c1 715581770 UHFVXZYHEXLVLH-KGLIPLIRSA-N 278.396 2.363 10 10 CECE CCN1CCc2cc([C@H](N)[C@@]34C[C@@H]3[C@H](OC)C4)ccc21 2163129981 CQJSWGCKAFSSAT-MXASKKJJSA-N 272.392 2.494 10 10 CECE CC(C)(C)NCc1ccc(N2CC(O)C2)c(Cl)c1 384105249 GBJXHRHPFHKYJW-UHFFFAOYSA-N 268.788 2.409 10 10 CECE CN(C[C@@H]1CCSC1)c1ccc([N+](=O)[O-])c(CO)c1 718390000 XFPUTQNGQWYSIV-JTQLQIEISA-N 282.365 2.276 10 10 CECE Oc1cc(Br)ccc1CNCCc1cnoc1 718896672 MGVGDPZWEFJGIZ-UHFFFAOYSA-N 297.152 2.475 10 10 CECE CN1CCCc2cc(CNCCc3cnoc3)ccc21 718893942 FRTQUSGKBWOPLO-UHFFFAOYSA-N 271.364 2.389 10 10 CECE C[C@@H](NCc1ccc(O)nc1)c1c(O)cccc1O 392785240 IMNVMJCLYWROFG-SECBINFHSA-N 260.293 2.049 10 10 CECE CC[C@@H](NCc1ccc(OC)cc1O)C(C)(C)O 394008575 FGBYHGHGILEGPT-CYBMUJFWSA-N 253.342 2.040 10 10 CECE CN(C[C@@H]1C[C@@]1(C)C(F)F)C(=O)c1cccc(O)c1O 2177413068 COJBBERQGCTCTM-RMLUDKJBSA-N 285.290 2.461 10 10 CECE COc1cncc(C(=O)N2CCC(CN=[N+]=[N-])CC2)c1 2167211317 DNWHDQJCUOIENK-UHFFFAOYSA-N 275.312 2.253 10 10 CECE CCOC(=O)c1cn([C@@H](C)c2cccc(C)c2O)nc1O 2070623412 BPJVWLCNIMJSFS-JTQLQIEISA-N 290.319 2.389 10 10 CECE CC[C@H](N)CN(C)Cc1cc(Cl)cc(OC)c1O 1236884301 NZEFJDMWPLOYQM-NSHDSACASA-N 272.776 2.223 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2ncn(C)n2)cc1Cl 2178355542 YJFWIISJGGWPNG-JTQLQIEISA-N 293.802 2.385 10 10 CECE CCc1cccc([C@H](NN)c2ccc(N(C)C)cc2)n1 2178462349 HHIQEXBLCJHCEY-MRXNPFEDSA-N 270.380 2.263 10 10 CECE Cc1cnc(CN(C)c2ccc(CO)cc2[N+](=O)[O-])s1 2170156041 BHNWXEFWBMYSIX-UHFFFAOYSA-N 293.348 2.488 10 10 CECE COC[C@@H](C)CCOc1ccc(N2CCNCC2)cc1 2187509370 PXBLABOXCMUMGB-AWEZNQCLSA-N 278.396 2.148 10 10 CECE C[C@H](NC(=O)C[C@H]1CCC[C@@H](N)C1)c1ccccc1O 2192623627 HFIGSUPUPBKCAC-RWMBFGLXSA-N 276.380 2.477 10 10 CECE OCc1ccc(N2C[C@H]3COCC[C@H]32)c(C(F)(F)F)c1 2193275074 NNMIZFXDZSSOEE-CMPLNLGQSA-N 287.281 2.423 10 10 CECE 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61845624 PNTJWYLXCMAJQJ-UHFFFAOYSA-N 254.761 2.007 10 10 CECE CC(C)[C@](C)(O)CN[C@H](C)c1ccc(O)cc1O 381453259 RLAAFQCGVLULFN-QMTHXVAHSA-N 253.342 2.155 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1cccc(Cl)c1 90256331 KADIHXYUTNCDCT-VIFPVBQESA-N 254.677 2.366 10 10 CECE CN[C@@H](CO)c1cc(Cl)cc(Br)c1O 238361121 JRWDULHEFDCUQA-QMMMGPOBSA-N 280.549 2.061 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@]2(C)OCC)c1O 527783330 IVVGGNKAVRRXKG-HIFRSBDPSA-N 265.353 2.448 10 10 CECE CN1C(=O)/C(=C/c2cnn3ccccc23)SC1=S 255674980 UVJCSRPKABOUIG-POHAHGRESA-N 275.358 2.165 10 10 CECE C[C@@H]1[C@H]2CNC[C@H]2CN1Cc1ccc2c(c1)CCCN2C 252556495 LKSLFKXSNRRPLS-XOKHGSTOSA-N 285.435 2.109 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(Cl)c(Cl)c1O 808515931 RUJUSOYNCMIPFC-UHFFFAOYSA-N 291.086 2.014 10 10 CECE CN1CCCN(Cc2ccc(Cl)cc2O)CC1 1140461748 SSENAYIPQQRKGC-UHFFFAOYSA-N 254.761 2.183 10 10 CECE COc1ccc(N2CC[C@H]3CCNC[C@@H]3C2)c(OC)c1 2162664764 SHXKXJPGIBJTDM-CHWSQXEVSA-N 276.380 2.140 10 10 CECE CN[C@H](C)c1ccc(N(C)C2CC(C(N)=O)C2)c(Cl)c1 723161972 YWGMPGVYVOUGAI-OIKLOGQESA-N 295.814 2.321 10 10 CECE CCN1CCc2cc([C@@H](O)CC3CC(CN)C3)ccc21 2163066852 PYRLWCDCQBVHNL-FVKWTLKZSA-N 274.408 2.477 10 10 CECE CN(C)c1ccc([C@@H](O)c2ccc3c(c2)CNC3)cc1 2163080844 WJEIBWLUDOWZML-QGZVFWFLSA-N 268.360 2.438 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CCCC[C@@H]3CN)ccc21 2163081007 XIKBRPGVHDKIIO-INMHGKMJSA-N 274.408 2.477 10 10 CECE C[C@@H]1O[C@H](C)[C@H]([C@H](NN)c2ccc(N(C)C)cc2)[C@H]1C 2163107175 NJUQEAQWBDFFNN-YYFFNPIBSA-N 277.412 2.317 10 10 CECE CC1CC([C@](C)(O)[C@H](N)c2ccc3c(c2)CCN3C)C1 2163131000 MYNOJUWYMWUOHE-QVTLUWRMSA-N 274.408 2.476 10 10 CECE CCN1CCc2cc([C@H](N)c3cncn3CC)ccc21 2163141007 PUVONGCWIVZWPO-INIZCTEOSA-N 270.380 2.334 10 10 CECE CC(C)[C@@H]1[C@H](C(=O)O)CCN1Cc1ccc(O)c(O)c1 2279365756 DIRDWPVIHMSOHX-BXUZGUMPSA-N 279.336 2.029 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CC=CC1 808094076 AAWSIRUHGITCTH-UHFFFAOYSA-N 266.337 2.460 10 10 CECE OCc1cc(F)c(N2CC[C@H]3CC[C@H](O)[C@H]2C3)c(F)c1 721602064 MKORQKBEKWCMNM-FZQKWOKYSA-N 283.318 2.197 10 10 CECE CN1CCCc2cc([C@@H](N)CC3CCNCC3)ccc21 2164051976 ZMLYFFUBMGJSHJ-INIZCTEOSA-N 273.424 2.459 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H](C)C[C@@H]1OC 2162129809 JQZHUWDAQOJDDU-GVXVVHGQSA-N 284.360 2.023 10 10 CECE O=C1CN(Cc2ccc3ccccc3c2O)CCN1C1CC1 816512400 HNWUCRCAHFXIKV-UHFFFAOYSA-N 296.370 2.352 10 10 CECE COC1(C(F)(F)F)CN(c2ccc(CN)cc2F)C1 724151243 FIFJKYWZFZQYDD-UHFFFAOYSA-N 278.249 2.052 10 10 CECE COc1cc(OC)cc(N(C)C(=O)/C=C\c2cnccn2)c1 492005699 MHUVJXUNQMOOJD-PLNGDYQASA-N 299.330 2.170 10 10 CECE CC[C@@H](NC)c1ccc(N2CCC[C@@H]2C(=O)NC)cc1 723185288 LDNVMKYRDYJLNB-HUUCEWRRSA-N 275.396 2.072 10 10 CECE CC(C)NC(=O)CCNC/C=C/c1ccc(N(C)C)cc1 835034864 BYLIGSIKTCEKTF-AATRIKPKSA-N 289.423 2.270 10 10 CECE Oc1ccccc1CN1CCCC[C@@H]1[C@H]1CCNC1 841087121 NBADVLLGPVCQSA-DZGCQCFKSA-N 260.381 2.356 10 10 CECE C[C@H](NC1COCCOC1)c1ccc(Cl)cc1O 841758041 RGUPPYRCBIAMDW-VIFPVBQESA-N 271.744 2.112 10 10 CECE CCN(CC)c1ccc(CN[C@@H](C)[C@@H](C)N)cc1F 841077037 XBRVJCXYOSSZTQ-NEPJUHHUSA-N 267.392 2.497 10 10 CECE CC[C@H](NC[C@@](C)(CO)OC)c1cccc(Cl)c1O 848556067 LRDCMFIUWAJLBP-JSGCOSHPSA-N 287.787 2.484 10 10 CECE O=C(NCC1=CCOCC1)NCc1cc(Cl)ccc1O 845228625 HLIAENQTHWZENQ-UHFFFAOYSA-N 296.754 2.192 10 10 CECE CC(C)(C)OC(=O)[C@@H]1CCN[C@@H]1c1ccc(O)c(O)c1 1952824442 BFIXDGYTFMONIO-ZWNOBZJWSA-N 279.336 2.090 10 10 CECE Cc1ccc([C@H](C)NC[C@@H](O)c2ccnn2C)c(O)c1C 927136327 QNBOLFOGVKRLLQ-SWLSCSKDSA-N 289.379 2.127 10 10 CECE COC[C@H](COC(=O)c1cccc(O)c1O)C(C)C 922619747 IPFSJZWVCGFUIT-SNVBAGLBSA-N 268.309 2.173 10 10 CECE CN(C)c1ccc(CNC[C@@]2(O)C[C@H]3C=C[C@H]2C3)cc1 850374677 MTMHRHFDTXTEOX-ZOBUZTSGSA-N 272.392 2.169 10 10 CECE CCn1cc(CNCc2c(O)cc(C)cc2Cl)nn1 850366699 JJZCRHOGPQYNCO-UHFFFAOYSA-N 280.759 2.255 10 10 CECE Cc1ccc(O)c(CNC(=O)/C=C/[C@@H]2CCCO2)c1 862755533 VOGZDNDYZHXNCU-IYNGYCSASA-N 261.321 2.052 10 10 CECE O=C(C[C@H]1CCCO1)NCc1ccc2cccnc2c1O 862024907 JJUUCTOLNPTXKH-CYBMUJFWSA-N 286.331 2.126 10 10 CECE COC(=O)C1=CC[C@H](NCc2cc(C)c(C)cc2O)C1 862464908 BICDLTWSKUYTTP-AWEZNQCLSA-N 275.348 2.360 10 10 CECE CCOC(=O)[C@H](CC=C(C)C)NC(=O)c1cc(O)cs1 871475446 GPDHDNKLWPQCCT-NSHDSACASA-N 297.376 2.472 10 10 CECE CCOC(=O)CCN1C[C@H](CC)Oc2cc(CN)ccc21 74337890 PIJDRJBJUXJVSN-ZDUSSCGKSA-N 292.379 2.076 10 10 CECE Cc1nnc2sc(CCCc3ccc(N)cc3)nn12 82585092 FVTXCHQCOXXYFP-UHFFFAOYSA-N 273.365 2.252 10 10 CECE N[C@H](C(=O)NCC1CCCCC1)c1ccccc1O 83456521 MKQBYBFVWPORHE-AWEZNQCLSA-N 262.353 2.089 10 10 CECE C[C@H]1CN(c2ccc(OC(F)(F)F)cc2)CCN1 83433802 CTRITCGEWTZDMI-VIFPVBQESA-N 260.259 2.383 10 10 CECE COC(=O)[C@H](C)[C@H](C)N1CCCc2cc(CN)ccc21 700969526 MPHDZBHGADJMSI-NEPJUHHUSA-N 276.380 2.096 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)CCCCC(=O)O 719356886 WMAIETZCPKPLPN-SNVBAGLBSA-N 267.325 2.346 10 10 CECE CN(c1ccc(CN)cc1Br)[C@@H]1CCC[C@@H]1O 709398771 IORRREHRCYVWDI-OLZOCXBDSA-N 299.212 2.257 10 10 CECE Oc1ccc2ccccc2c1CNCC1OCCCO1 716317749 VEIWCLXSESRKMW-UHFFFAOYSA-N 273.332 2.398 10 10 CECE C[C@@H](O)[C@H]1CCCN(c2ccc(CN)c(F)c2F)C1 688917071 PULMVTZAGQZBMQ-KOLCDFICSA-N 270.323 2.021 10 10 CECE C[C@H]1CC[C@H](NCc2ccc(O)c(O)c2)CS1 689614562 ZDXFTESEWFRFMN-ONGXEEELSA-N 253.367 2.472 10 10 CECE CCN(c1ccc([C@@H](C)N)cc1F)[C@@H]1CCN(C)C1 693489842 ASORPGSCSMCCGH-DGCLKSJQSA-N 265.376 2.376 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CCC[C@H]3C[C@H]32)cc1 694288368 GOPLHJAALQBRRW-NILFDRSVSA-N 274.364 2.343 10 10 CECE CCC[C@H]1C[C@@](NCCN=[N+]=[N-])(C(=O)OCC)CCO1 90257205 WXQWWPACIFODQJ-WCQYABFASA-N 284.360 2.167 10 10 CECE CC(C)[C@@H](CO)NCc1ccc2c(c1)CCCN2C 92392194 AKTDZIFCXJGMNN-OAHLLOKOSA-N 262.397 2.176 10 10 CECE CC[C@@]1(C(=O)N(C)[C@@H](C)c2ccccc2O)CCCN1 215306961 YZPWJCPCZOQWSJ-LRDDRELGSA-N 276.380 2.444 10 10 CECE CCN(C)c1ccc(CN2CCN3C[C@@H](F)C[C@H]3C2)cc1 1176777116 ICMKIWDGXCRLHI-RDJZCZTQSA-N 291.414 2.371 10 10 CECE CO[C@@H]1CC[C@H]([C@@H](NN)c2ccc(N(C)C)cc2)C1 2118221735 FPUNQDMYYBEZGD-CFVMTHIKSA-N 263.385 2.072 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)[C@H]1CCC[C@@H]1F 2118859347 KBDAJXUIAFQGKY-STQMWFEESA-N 286.372 2.316 10 10 CECE CCNCc1ccc(OC)c(COC[C@@H](C)OC)c1 2126692970 IMEXDSPALGWQAG-GFCCVEGCSA-N 267.369 2.356 10 10 CECE C[C@@](O)(c1ccncc1Cl)[C@@H](N)c1ccccc1O 2120048893 FHDVXRVKDQSURZ-UONOGXRCSA-N 278.739 2.348 10 10 CECE CC(C)C1(O)CN(c2ccc3c(c2)CCC[C@H]3O)C1 2128271027 AJZDOCSPFUBOKE-OAHLLOKOSA-N 261.365 2.263 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@H]4OCC[C@H]4C3)ccc21 2128319127 ZVUVKCFXCRDZDD-MAZHCROVSA-N 259.349 2.281 10 10 CECE O[C@@H]1CCc2cc(N3CC(OCC(F)F)C3)ccc21 2128317632 GBWXPLINFNYNNN-CYBMUJFWSA-N 269.291 2.137 10 10 CECE COc1ccc(CN[C@@H]2CC[C@H]3C[C@]32CO)cc1C 2132148706 FOPVKNNCHVKMIY-IMJJTQAJSA-N 261.365 2.254 10 10 CECE [N-]=[N+]=NC1CCN(Cc2ccc(Cl)nn2)CC1 1912157437 XVHSTYABYWJDSN-UHFFFAOYSA-N 252.709 2.405 10 10 CECE CN(C(=O)CN1CC[C@H](N=[N+]=[N-])C1)C1CCCCC1 1912152535 VJMZIQYMRFZURI-NSHDSACASA-N 265.361 2.162 10 10 CECE [N-]=[N+]=NCC1CCN(CCO[C@H]2CC2(F)F)CC1 1912152510 VCCKUGNWAASOIY-JTQLQIEISA-N 260.288 2.433 10 10 CECE COc1cccc(CNC(=O)N[C@@H](C)C2(C)CC2)c1O 1346432912 CUHOUYBKNVMDBQ-JTQLQIEISA-N 278.352 2.389 10 10 CECE CC1(C)CN[C@H](c2nc(-c3ccc(O)c(O)c3)no2)C1 1912454934 MLGFPSNZMVUMRE-VIFPVBQESA-N 275.308 2.208 10 10 CECE C[C@H](F)CN1CCN(Cc2cc(F)ccc2O)CC1 2133457603 PAINUVNKNGISPO-NSHDSACASA-N 270.323 2.007 10 10 CECE NCc1ccc(N2CC(F)C2)cc1Br 1917016803 NEFBWHPNMMOANO-UHFFFAOYSA-N 259.122 2.066 10 10 CECE CC(C)(C)NCc1ccc(N2CC[C@](F)(CO)C2)cc1 1917079299 DRLFOJIYMXTXND-MRXNPFEDSA-N 280.387 2.485 10 10 CECE O=C(Cc1ccc(F)c(F)c1)NCc1cc(O)ccc1O 1455355600 DJWFNLGQGHSQFE-UHFFFAOYSA-N 293.269 2.235 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H]3C[C@]3(CO)C2)cc1 2136090577 IMLHUVFDYDQIEM-NUEKZKHPSA-N 260.381 2.176 10 10 CECE CCN[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 258608966 PBMWJDOUTLPPPW-OAHLLOKOSA-N 261.413 2.327 10 10 CECE CC[C@H](CN)CN(C)c1ccc(OC)c(C)c1OC 258913839 GEKIBBMDJORSMV-GFCCVEGCSA-N 266.385 2.433 10 10 CECE Oc1ccc(CCNCc2cc(O)ccc2O)cc1 32149192 WVMNBCIXGTUIOG-UHFFFAOYSA-N 259.305 2.136 10 10 CECE CO[C@@H](C(=O)NCc1cc(O)ccc1O)c1ccccc1 1558175301 LIELXSLLTLASHM-OAHLLOKOSA-N 287.315 2.102 10 10 CECE COCCNCc1ccc(N2CC[C@@H]3CC[C@@H]32)cc1 1923968689 PNTCPQYWZOAMEH-HOCLYGCPSA-N 260.381 2.411 10 10 CECE CC[C@@H]1CC[C@@H](CN(C)Cc2cc(N)ccc2O)O1 2136728305 OFXNMFFDUGSZHJ-KGLIPLIRSA-N 264.369 2.364 10 10 CECE CC(C)CNC(=O)CCN[C@H](C)c1ccccc1O 228345737 DROUELJBNDVRNA-GFCCVEGCSA-N 264.369 2.205 10 10 CECE Cc1cc(CCC(=O)NCc2cc(Cl)ccc2O)n[nH]1 1628679856 BHFTZJBIRIFOOK-UHFFFAOYSA-N 293.754 2.326 10 10 CECE CNCc1ccc(N2CC=CCC23COC3)cc1C 2136996913 RRLCCESGUUILGO-UHFFFAOYSA-N 258.365 2.250 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@](C)(O)CSC)c1 230662867 YMMONOMIEMQYGR-YGRLFVJLSA-N 285.409 2.165 10 10 CECE O=[N+]([O-])c1cnc(NCc2ccc3cccnc3c2O)nc1 1655585805 RRFMFJXMSVOVHC-UHFFFAOYSA-N 297.274 2.251 10 10 CECE CNCc1ccc(N2C[C@H]3[C@@H](O)CC[C@H]3C2)c(Cl)c1 124025197 SZDVNZWHVIIZBF-ZOWXZIJZSA-N 280.799 2.267 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(C)[C@@H](C)CSC)ccc21 124119051 DMCNJODFBRHVMQ-IINYFYTJSA-N 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CC[C@@H](CN(C)C)NCc1ccc(Cl)cc1O 1942688938 UNQREQHORJTZPK-LBPRGKRZSA-N 256.777 2.475 10 10 CECE COC[C@H]1CC[C@@H]1N(C)c1ccc2c(c1)CC[C@@H]2N 2142415441 PZYSBOAZEZGZMY-KCXAZCMYSA-N 260.381 2.494 10 10 CECE CCCn1cc(CN[C@@H](C)c2ccccc2O)nn1 877758059 HOGIAUBOOAVQGJ-NSHDSACASA-N 260.341 2.245 10 10 CECE CN(Cc1ccccc1O)[C@@H]1CCNC2(CCC2)C1 1877544416 DQZQJYRJNCNXLA-CQSZACIVSA-N 260.381 2.499 10 10 CECE OC[C@]1(CNCc2ccccc2O)C[C@@H]1C(F)(F)F 1877512873 HDTAYPBIKXCCEK-NWDGAFQWSA-N 275.270 2.043 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@H]1CC=CCO1 1946381111 QRRKWZRGOCDVTC-LBPRGKRZSA-N 253.729 2.480 10 10 CECE CC[C@H](C)[C@@H](NCc1ccc(C)cc1O)C(=O)OC 1963189058 JWOFOEYRXZXRMG-SMDDNHRTSA-N 265.353 2.378 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H]3C[C@H]2CO3)c(F)c1 1880923496 IHSAOUBJYFUHRT-LSJOCFKGSA-N 268.307 2.352 10 10 CECE Cc1ccc(N(C)CCOc2ccc(N)cc2)cn1 1887178677 ZPWFVBMUYPGYIG-UHFFFAOYSA-N 257.337 2.487 10 10 CECE CCOCCOCCN1CCc2cc(N(C)C)ccc21 2143842936 QJDBWPAIFJDEHT-UHFFFAOYSA-N 278.396 2.168 10 10 CECE Nc1ccc(N2CCN(c3ncc(Cl)cn3)CC2)cc1 168075886 LEPIDYNLCQACSO-UHFFFAOYSA-N 289.770 2.039 10 10 CECE COc1ccc(O)c([C@H](C)NCCc2ncccn2)c1 1966190007 BKMRCRBYCCHNLI-NSHDSACASA-N 273.336 2.084 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3CCNC[C@H]3C2)c1 1967988693 SPUJEOPXQNHSCA-HIFRSBDPSA-N 260.381 2.132 10 10 CECE C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H](C)C1N 1968002548 XVMCHURUFWEBKH-STQMWFEESA-N 261.413 2.168 10 10 CECE C[C@@H]1C[C@@H](C)CN(c2ccc3c(c2)N(C)C(=O)[C@H]3N)C1 252087040 GPPZIBHGMBBNLR-HFAKWTLXSA-N 273.380 2.145 10 10 CECE COCc1ocnc1CNCc1cc(Cl)ccc1O 1969167925 ZJRYBKBXAUDAQV-UHFFFAOYSA-N 282.727 2.470 10 10 CECE CO[C@@H](C)COc1ccc(N2CCC[C@H](N)C2)cc1C 252812296 HHCCXBNNSGQWRU-KBPBESRZSA-N 278.396 2.336 10 10 CECE C[C@@]1(C(=O)O)C[C@H](NCc2ccc(Cl)cc2O)CCO1 1973210454 UFZINAKXKLJSSS-RISCZKNCSA-N 299.754 2.158 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H](C(=O)O)C2(C)CC2)c1 2150031107 YRZRFRJXPOHUFD-TVQRCGJNSA-N 279.336 2.305 10 10 CECE CN[C@@H](C)c1ccc(N(C)C2CCN(C)CC2)cc1 34839374 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C[C@H](N[C@@H]1CO[C@H](C)[C@H]1C)c1cc(O)ccc1O 405785335 URSMENZSPSRTJU-BSTOTGJRSA-N 251.326 2.172 10 10 CECE COC1(C)CCN(c2c(F)cc(CN)cc2F)CC1 311522379 DGSPQULJCDDFSM-UHFFFAOYSA-N 270.323 2.429 10 10 CECE O=C(NC[C@H]1CCCSCC1)c1cccc(O)c1O 700623041 NJJUZIUGAHHCDR-JTQLQIEISA-N 281.377 2.361 10 10 CECE CCNCc1ccc(N2CC[C@H]3CCN(C)[C@H]3C2)cc1 2158539709 YEBABQZPQPAQKZ-WBVHZDCISA-N 273.424 2.327 10 10 CECE Cc1cc(N2CC[C@H]3CN(C)CC[C@H]32)ccc1CCN 2170957524 SFIZORUEHDXKPJ-DOTOQJQBSA-N 273.424 2.027 10 10 CECE COc1ccc([C@H](C)N[C@@H]2C[C@H]3C[C@H]2C[C@H]3O)c(O)c1 2160695316 AKTPREQNTULAEG-ABNINFQISA-N 277.364 2.211 10 10 CECE CN(C)c1ccc([C@@H](O)c2ccc3cncn3c2)cc1 2176879975 BNZFTKPBESCCNF-MRXNPFEDSA-N 267.332 2.482 10 10 CECE COC1CC(CN(C)c2ccc(CO)cc2F)C1 703354228 ZHJPHPYNSWUDJR-UHFFFAOYSA-N 253.317 2.179 10 10 CECE NCc1ccc(N2CCO[C@H]([C@@H]3CCCO3)C2)cc1Cl 2171759905 LVUFZMHKKJAYIH-GJZGRUSLSA-N 296.798 2.183 10 10 CECE Nc1ccc(OCC(=O)OCc2ncccc2Cl)cc1 703900469 RDKKETGHKPZLEX-UHFFFAOYSA-N 292.722 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CC1=C[C@@H](NC(=O)COc2ccc(N)cc2)CCC1 2119104571 VRKTZSCWEOHVAX-ZDUSSCGKSA-N 260.337 2.263 10 10 CECE NCc1cc(F)c(N2CC[C@H](O)C3(CC3)C2)cc1Cl 2120883073 AAHSGFURNARGLD-ZDUSSCGKSA-N 284.762 2.289 10 10 CECE C[C@@H]1OCC[C@H]1CCNC(=O)Nc1ccc(N)cc1 2121100941 MGUSXGLHJFSUFQ-WDEREUQCSA-N 263.341 2.205 10 10 CECE Nc1ccc(OCCC(=O)NCC2(F)CCC2)cc1 2121343107 FAOXVZHNUJBYRX-UHFFFAOYSA-N 266.316 2.046 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H](C3(O)CC3)C2)c(F)c1 2130510328 JLUSKIBJGKVELT-PWSUYJOCSA-N 264.344 2.197 10 10 CECE CC1(C)C[C@H](CO)CN1c1c(F)cc(CN)cc1F 2127834582 LJPRKHIBZFJTPM-JTQLQIEISA-N 270.323 2.021 10 10 CECE C[C@@H]1COC[C@H]1N(C)c1ccc2c(c1)CCC[C@H]2N 2128278549 YJSDHOPBILSHDU-HFBAOOFYSA-N 260.381 2.494 10 10 CECE CN[C@H]1CCc2cc(N(C)CC3(O)CCC3)ccc21 2128310357 GLAHOXQZDUPEFH-HNNXBMFYSA-N 260.381 2.245 10 10 CECE C[C@H]1CCO[C@@H]1CN(C)c1ccc2c(c1)CC[C@@H]2N 2128321217 JOZHIYPXAPOSBE-KNXALSJPSA-N 260.381 2.494 10 10 CECE Cc1cc(CO)ccc1N1CCC2(CC[C@@H]2O)CC1 2130867717 CHTSDLSNUBSYEQ-HNNXBMFYSA-N 261.365 2.229 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1C[C@@H]2[C@H]3CC[C@@H](O3)[C@H]21 2132132361 CAVVFNSVWYUDQO-OXGONZEZSA-N 258.365 2.267 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@@H]2CCN[C@@H]2C1 2132358175 YTMASHKPGPHAEL-IVMMDQJWSA-N 259.397 2.107 10 10 CECE CC[C@@]1(C(=O)O)CCCN1Cc1cccc(OC)c1O 215607427 APKUAZBCEUMHFQ-HNNXBMFYSA-N 279.336 2.230 10 10 CECE CNCc1ccc(N2CCN(C)C(C)(C)C2)c(F)c1 104129749 AODVJMAIMYMRNQ-UHFFFAOYSA-N 265.376 2.076 10 10 CECE O=C(O)C=Cc1ccc(N2CC3(CCOCC3)C2)cc1 1911982849 HATJMQIQXFZCPN-UHFFFAOYSA-N 273.332 2.401 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2ccc3nc[nH]c3c2)C1 1912151836 LYJCCNBUTKQFKK-VIFPVBQESA-N 256.269 2.088 10 10 CECE CN(CCCN=[N+]=[N-])Cc1cnc(N(C)C)s1 1912155752 RENRJIQDUFUVGG-UHFFFAOYSA-N 254.363 2.341 10 10 CECE [N-]=[N+]=N[C@H]1CCN(Cc2nc(-c3ccco3)no2)C1 1912162856 BJTTULDGNREBPH-QMMMGPOBSA-N 260.257 2.214 10 10 CECE CC[C@H](C)NC(=O)[C@H](C)N1CCC[C@@H](N=[N+]=[N-])C1 1912163950 PYPQEAIBYGUXCO-GARJFASQSA-N 253.350 2.064 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1ccnc(Br)c1 1912186787 CDVFATMHRBQAOH-UHFFFAOYSA-N 284.117 2.226 10 10 CECE CC[C@@H](COC)CC(=O)N1CCC[C@H](N=[N+]=[N-])C1 1912210625 LWRMHAFMHRAVCD-MNOVXSKESA-N 254.334 2.350 10 10 CECE COCc1cccc([C@@H](NN)c2ccccc2O)c1 2134737186 WBNQLWNCDNMFCS-OAHLLOKOSA-N 258.321 2.091 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2CSC3)cc1F 1914573219 HWQWRLRWOUIQLS-RYUDHWBXSA-N 252.358 2.369 10 10 CECE COc1cc(OC)c2c(c1)[C@H](CC(=O)O)CCN2C 212065741 QKZHADJUCROZCY-VIFPVBQESA-N 265.309 2.102 10 10 CECE COc1cc2c(cc1Cl)N(C)C[C@H](CC(=O)O)C2 212149820 MEBGYEHZGALSRD-QMMMGPOBSA-N 269.728 2.432 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C2COC2)c(F)c1 1915666793 IXASXEGEAHTPAX-JTQLQIEISA-N 252.333 2.331 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H](CC(F)F)C3)ccc21 1916725822 YDYJTJKTGPJFJQ-OQPBUACISA-N 281.306 2.120 10 10 CECE [N-]=[N+]=N[C@H](CO)c1cccc(O)c1Br 1536013692 DMQNNLZEFKKEFR-ZCFIWIBFSA-N 258.075 2.498 10 10 CECE CCOc1ccc(N(C)CCNC2CC2)cc1F 258978524 UURIUKVEZXYASC-UHFFFAOYSA-N 252.333 2.413 10 10 CECE 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C[C@@H](c1ccccc1O)N(C)c1nc(NN)ccc1F 2204444776 KJBQBDPVKSEINI-VIFPVBQESA-N 276.315 2.409 10 10 CECE C[C@@H](NCCc1ccc(O)c(O)c1)c1ncccc1O 2205277369 RRFBHXFPAIZKPV-SNVBAGLBSA-N 274.320 2.092 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](OCCCO)C2)cc1Cl 2207078340 BWYOHVWOMZMMNN-DGCLKSJQSA-N 298.814 2.337 10 10 CECE CCCN[C@H](c1ccccc1O)[C@]1(O)CC[C@@H]1COC 2207384982 MBIXUYSNBFNCTI-WQVCFCJDSA-N 279.380 2.220 10 10 CECE COC1CC(COCCCOc2ccc(N)cc2)C1 2230152796 HYPYFZICLQEAFM-UHFFFAOYSA-N 265.353 2.479 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@H]1C[C@@H]2C[C@@H]2C1 2230397539 DZPCIOYBNWNGMT-AGGWBTHJSA-N 258.365 2.458 10 10 CECE COc1ccc(N(C)CC[C@H](C)OC)c(CN)c1 2220416959 HHCFOMQXWQUEAP-NSHDSACASA-N 252.358 2.015 10 10 CECE COc1ccc(N2CCCC[C@@H]2CF)c(CN)c1 2220408313 HBFFUOLMSHFBPP-GFCCVEGCSA-N 252.333 2.482 10 10 CECE Oc1ccccc1CNC[C@H]1OCC[C@H]1C(F)(F)F 2231828907 WNDRODXXUWZKPJ-ZYHUDNBSSA-N 275.270 2.449 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]([C@@H](C)O)C2)c(C)c1 2232092851 YZSGVNHBDCJOQI-UMVBOHGHSA-N 262.397 2.483 10 10 CECE Oc1ccc(CNC[C@@H]2CC[C@@H]2C(F)(F)F)c(O)c1O 2232595321 DHEIIQPRTYNLSX-CBAPKCEASA-N 291.269 2.482 10 10 CECE CC[C@H](C)NCc1cnc(Sc2nncn2C)s1 2223628559 QNDXYAKDBUFFPD-QMMMGPOBSA-N 283.426 2.311 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CCCC[C@H]1C(=O)O 2234171434 LWFLCJGOHOCGRI-CHWFTXMASA-N 280.328 2.225 10 10 CECE CCCOc1ccc(N2CCOC[C@H]2C[C@H](C)O)cc1 2235098314 FVEYPJZDVYTCRC-DZGCQCFKSA-N 279.380 2.452 10 10 CECE COc1cc(N2CCCC[C@@H](O)C2)cc(OC)c1OC 2235130785 CWUQFLGQFGTLLM-GFCCVEGCSA-N 281.352 2.064 10 10 CECE CCC1(C(=O)N[C@H](C)c2ccccc2O)CC(N)C1 2225158575 VDHWMWXSOSYUFZ-RWWNRMGGSA-N 262.353 2.087 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@H](O)CCC23CC3)c1 2235769236 PXVFUHVWEPLXBU-CQSZACIVSA-N 275.348 2.084 10 10 CECE CCOC[C@@H]1CCCN(c2ccc(OC)cc2CN)C1 2235962160 FOXAARVFVVYEHC-CYBMUJFWSA-N 278.396 2.407 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@@H]2C[C@H](C[C@@H]2N)C1 2226524980 NTHGHGRSSUMOER-MIJXAVMKSA-N 264.344 2.261 10 10 CECE COc1ccc(N2C[C@H](CO)[C@@H](C(F)(F)F)C2)cc1 2226798830 PCHCCFDOOPXNHW-SKDRFNHKSA-N 275.270 2.302 10 10 CECE CC[C@@]1(O)CCCN(c2ccc3c(c2)OCCO3)C1 2226772518 VVMABWMRVWHEFT-OAHLLOKOSA-N 263.337 2.199 10 10 CECE C[C@@H]1CN2CCC[C@H]2CN1Cc1ccc(F)cc1O 295382933 PFRDBWUIHUBKOH-RISCZKNCSA-N 264.344 2.200 10 10 CECE Cc1ccn([C@H](Cc2ccc(O)c(O)c2)C(=O)O)c1 2227293413 MFLBKQBXHROIHL-LLVKDONJSA-N 261.277 2.076 10 10 CECE COc1ccc(N(C)Cc2cscn2)c(C(=O)O)c1 2227666895 WAZGHLHKQQMNON-UHFFFAOYSA-N 278.333 2.486 10 10 CECE COc1ccc(N2C[C@H](O)CC23CCC3)c(C=O)c1 2227708510 JCDSMWMWOYGSMT-GFCCVEGCSA-N 261.321 2.001 10 10 CECE CN1CCc2cc([C@H](CN)N(C)CC3(Cl)CC3)ccc21 2237979858 UJOWFNNYZWLPAS-HNNXBMFYSA-N 293.842 2.382 10 10 CECE CN[C@H](C)c1ccc(N(C)CCC(=O)N(C)C)c(C)c1 2240829178 GHIMNBSWWAHSNK-CYBMUJFWSA-N 277.412 2.190 10 10 CECE CC(=O)NC1CCN(c2ccc([C@H](C)N)cc2C)CC1 2240828072 AORKMYQQYOGTGZ-LBPRGKRZSA-N 275.396 2.120 10 10 CECE [N-]=[N+]=NCCS(=O)(=O)CC1(C(F)(F)F)CCC1 2251751793 APTRZLXGUJNJGY-UHFFFAOYSA-N 271.264 2.444 10 10 CECE CSc1ncc(CNc2ccc(=N)[nH]c2)s1 2243826397 OZKDWAQJLJMRTR-UHFFFAOYSA-N 252.368 2.285 10 10 CECE CC[C@@H]1CN[C@@H](C)CN1Cc1cnc(SC)s1 2248690368 NXZCZHBYJZCOHC-VHSXEESVSA-N 271.455 2.437 10 10 CECE COc1ccc(N(C)CCCCCC(N)=O)cc1 2263725116 KFBNJWSTYFXVHN-UHFFFAOYSA-N 250.342 2.177 10 10 CECE CC[C@@H](C)[C@@H](NCc1cccc(Cl)c1O)C(N)=O 2264218093 PBHPJNCNTRXXBQ-LDYMZIIASA-N 270.760 2.035 10 10 CECE CN(Cc1ccnnc1)c1ccc2c(c1)CC[C@@H]2N 2274307413 YCCMORTWFXFQTE-HNNXBMFYSA-N 254.337 2.059 10 10 CECE CSc1ncc(CNC(=O)C[C@@H](N)C2CCCC2)s1 2269193528 MOFYFTUZUKRWLE-LLVKDONJSA-N 299.465 2.389 10 10 CECE COc1cc(C)c(N2CC[C@H]3CNC[C@@H]3C2)c(C)c1 2269581805 CEBCZALAFNSKAV-UONOGXRCSA-N 260.381 2.358 10 10 CECE Cc1cc(N2[C@H](CO)[C@H]3CC[C@@H]2C3)ccc1[C@@H](C)N 2269650174 AHABXDCHAKOIPQ-FAXLKDOZSA-N 260.381 2.364 10 10 CECE Cc1cc(N(C)CC(C)(C)S(C)(=O)=O)ccc1[C@H](C)N 2285128270 MOQDZUQSHDQMML-LBPRGKRZSA-N 298.452 2.274 10 10 CECE C[C@@H](OCc1cccnc1)C(=O)Nc1ccc(N)cc1 2296483749 APTXWYSOQYWTNF-LLVKDONJSA-N 271.320 2.208 10 10 CECE C[C@](Sc1nccs1)(C(=O)O)[C@H]1CC[C@H](N)C1 2306956191 CODFCHLDOCSFRN-DKCNOQQISA-N 272.395 2.206 10 10 CECE CSc1ncc(CNC[C@]23CC[C@H](C[C@@H]2N)C3)s1 2312992578 YWXGIHAAHXWAHG-SUZMYJTESA-N 283.466 2.472 10 10 CECE CC(C)(C)c1nnsc1COc1cccnc1N 2314399057 XANWTLIMKNTXPH-UHFFFAOYSA-N 264.354 2.392 10 10 CECE CC1(C)COC[C@H]1CNCc1cccc(F)c1O 2314576528 UIHLMRJLVIEQCY-LLVKDONJSA-N 253.317 2.294 10 10 CECE [N-]=[N+]=NCCN1CC[C@@H](CCN)C[C@@H]1C(F)(F)F 2315841974 LSPRSIYFUOFVDS-RKDXNWHRSA-N 265.283 2.288 10 10 CECE COc1ccc(N=NN2CCC(=O)CC2)cc1[N+](=O)[O-] 2330193248 LLSYGOVEWXEFJQ-UHFFFAOYSA-N 278.268 2.267 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)[C@H]2[C@H]3CCC(F)(F)[C@@H]23)C1 2330172549 XJVLLYMWAFJHSR-DOLQZWNJSA-N 270.283 2.437 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)[C@@H]1C[C@H]1C1CCC1 2332677006 ACDOYELOASQPJS-XRGAULLZSA-N 261.365 2.450 10 10 CECE O[C@@]1(c2ccc(N3CCCC3)cc2)C[C@@H]2CO[C@H]1C2 2334532034 IZBLUXFWWZINSH-UHOFOFEASA-N 259.349 2.283 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C2)cc1C1CC1 2339143523 LXTOZGHYKWBTBP-HNNXBMFYSA-N 260.381 2.245 10 10 CECE C[C@@H]1CN(c2ccc(CO)c(C3CC3)c2)CC[S@]1=O 2339161313 RVOAEGWJTNVIQN-NSPYISDASA-N 279.405 2.014 10 10 CECE Cc1ccc(OCc2ccn(C(F)(F)F)n2)c(N)n1 2340610889 DGMQYUQCQGPIRK-UHFFFAOYSA-N 272.230 2.224 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@H]3COC[C@H]3C2)c1C 2340850984 NFSLCFUVXVDDDQ-MCIONIFRSA-N 260.381 2.406 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC[C@H]3[C@@H]2C[C@H]3O)c1C 2340853010 LEQYYWDRULKNID-DLKVLKDVSA-N 261.365 2.316 10 10 CECE CC1=CC(=O)N(c2ccc(N)c(C(F)(F)F)c2)C1=O 2341249650 JMEHRBDWTHUEAS-UHFFFAOYSA-N 270.210 2.107 10 10 CECE CN(C[C@H]1[C@@H]2CCOC[C@@H]21)c1ccc2c(c1)CC[C@H]2O 2356172722 GKPYJCKOPXDCOA-LUKYLMHMSA-N 273.376 2.385 10 10 CECE CCCOCCOC(=O)c1ccn(-c2ccc(N)cc2)n1 111106562 NAQKAOWKLCOBKN-UHFFFAOYSA-N 289.335 2.038 10 10 CECE Nc1ccc(CCNC(=O)[C@H]2C[C@@H]3CC[C@@H]2C3)cc1 104562266 KZTYXCCNVWSDIQ-NFAWXSAZSA-N 258.365 2.364 10 10 CECE COc1ccc(CNC2CCSCC2)c(O)c1 134413935 YNQJFYVWHHLOLD-UHFFFAOYSA-N 253.367 2.386 10 10 CECE C[C@@H](OCc1ccc(N)cc1)C(=O)NC(C)(C)C 20391111 CEOAADRQEDXYNE-SNVBAGLBSA-N 250.342 2.089 10 10 CECE CN(C)S(=O)(=O)c1ccc(Cl)c(CCN=[N+]=[N-])c1 1951350409 KIDMWGDUBANZQZ-UHFFFAOYSA-N 288.760 2.443 10 10 CECE COCCNCc1ccc(N2CCCO[C@H](C)C2)c(F)c1 62738333 QXLVEODZXYMNEJ-CYBMUJFWSA-N 296.386 2.177 10 10 CECE CCOC(=O)CCC[C@H](N)c1ccc(F)cc1O 1951604492 WJOUGZUWPPGPIU-NSHDSACASA-N 255.289 2.265 10 10 CECE CC[C@H]1CN(CCCC(=O)Nc2ccc(N)cc2)CCO1 36769015 KBOCXDVSCBKKFQ-HNNXBMFYSA-N 291.395 2.098 10 10 CECE COc1ccc(N(C)CC2(O)CCCC2)c([N+](=O)[O-])c1 124193131 DNKYXVOCQNPVSO-UHFFFAOYSA-N 280.324 2.345 10 10 CECE Nc1ccc(NC(=O)CN2CCC3(CCCC3)C2)cc1 312530800 OGVWRMZLKFLAMJ-UHFFFAOYSA-N 273.380 2.473 10 10 CECE Cc1cccc(CNC[C@H](C)Cn2ccnc2)c1O 181164425 DJXLFQHECXKYMF-LBPRGKRZSA-N 259.353 2.323 10 10 CECE CNC(=O)CCN(C)c1ccc(/C=C\C(=O)O)cc1Cl 312194065 NTVSLSKOKWJAPN-XQRVVYSFSA-N 296.754 2.010 10 10 CECE CCOC(=O)[C@H](C)N[C@@H](CC)c1ccccc1O 49368304 IGUQKAGGNXUOPQ-JQWIXIFHSA-N 251.326 2.385 10 10 CECE CN(Cc1cc(Cl)ccc1O)[C@@H](CN)C1CC1 159744475 WGZJZXJVLVMOPJ-LBPRGKRZSA-N 254.761 2.215 10 10 CECE CCOc1cccc(CNC[C@H]2CCC[C@H]2C(=O)O)c1O 89448269 SOBDXRCIIMEAAX-DGCLKSJQSA-N 293.363 2.381 10 10 CECE C[C@@H](O)[C@@H](N)c1cc(NC(=O)OC(C)(C)C)ccc1O 1952101723 PKKLCCRCRRJIDT-PRHODGIISA-N 282.340 2.120 10 10 CECE CCCNCc1ccc(N2CCCN(C(C)=O)CC2)cc1 42681031 LQPVMESYUWODKI-UHFFFAOYSA-N 289.423 2.245 10 10 CECE CNC(=O)[C@@H]1CCCN1c1ccc(CNC(C)C)cc1F 42395772 HENRRJVBZHXYLN-HNNXBMFYSA-N 293.386 2.039 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)c2ccnc(C#N)c2)c1 193596011 QNDYBPOFQFMHOK-JTQLQIEISA-N 297.314 2.158 10 10 CECE C[C@H](NCc1ccc(N(C)C)c(F)c1)c1ccnn1C 192780149 VSYMCCXRFFQYJI-NSHDSACASA-N 276.359 2.476 10 10 CECE Nc1ccc(N2C(=O)[C@H]3CC[C@@H](C3)C2=O)c(Cl)c1 236393107 SMQBHOHTUVTZMH-YUMQZZPRSA-N 264.712 2.212 10 10 CECE Cc1ccc(Br)c([C@@H]2COCCN2)c1O 95719059 FBPMADIZUNJKAD-VIFPVBQESA-N 272.142 2.124 10 10 CECE O=C1N[C@@H](c2ccc(F)c(Br)c2O)CCO1 95718533 KWNHTDDBJNIXLF-SSDOTTSWSA-N 290.088 2.465 10 10 CECE CN(C)c1ccc([C@@H](N)c2c(Cl)cnn2C)cc1 97448480 FYVUUXOMUPAJDQ-GFCCVEGCSA-N 264.760 2.188 10 10 CECE Oc1c(F)c(F)cc(Br)c1[C@H]1CCN1 238722172 QYTGURDGQYQAIT-ZCFIWIBFSA-N 264.069 2.467 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@@H]1CCCNC1=O 50394487 INGWFJMLYFRJCK-IJLUTSLNSA-N 274.364 2.117 10 10 CECE Cc1cc(N2CCC[C@@H]3COC[C@@H]32)ccc1C[C@@H](C)N 690350828 KMBJIOYEEDCPDT-UNEWFSDZSA-N 274.408 2.500 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C(F)(F)C1(OC)CCC1 2337775668 DJESZOUOEJGRTG-UHFFFAOYSA-N 276.287 2.350 10 10 CECE COC(=O)c1cnc(SCc2ccnc(OC)n2)s1 295304805 MPTITQABUDTSOR-UHFFFAOYSA-N 297.361 2.021 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)c1ccc(CN)s1 722231632 NAGGZFXUASOXOW-UHFFFAOYSA-N 298.389 2.022 10 10 CECE CCCN(C(=O)c1nn(C)cc1C)c1ccc(N)cc1 723486755 RSIUNMMMNAWROH-UHFFFAOYSA-N 272.352 2.368 10 10 CECE C[C@@H]1CC[C@H]([C@@H](NN)c2ccc3c(c2)CCCN3C)O1 2163093669 DRNRNZXABQVTCI-LYRGGWFBSA-N 275.396 2.141 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1CNCC1(F)F 2163097633 PSVYHNVXRWZEMW-KGLIPLIRSA-N 282.334 2.175 10 10 CECE CC[C@](O)([C@H](N)c1ccc2c(c1)CCN2C)C(F)(F)F 2163129183 ZRFBPHUFURZKQF-OLZOCXBDSA-N 288.313 2.382 10 10 CECE CCN1CCc2cc([C@@H](NC)[C@](C)(O)C(F)F)ccc21 2163140483 JNECOQVIETXPPU-HIFRSBDPSA-N 284.350 2.346 10 10 CECE CN(C)c1ccc(CNC[C@@H](CO)c2cccnc2)cc1 808430145 CMJUDDAYDWFPGX-INIZCTEOSA-N 285.391 2.013 10 10 CECE CN(CCN1C(=O)c2ccccc2C1=O)c1ccc(N)cc1 702055421 IWWKWEXEHLYSJO-UHFFFAOYSA-N 295.342 2.001 10 10 CECE CN1CCCc2cc([C@H](N)[C@@](C)(O)C(F)(F)F)ccc21 2163227780 GOTJPEZYDAMAQT-QWHCGFSZSA-N 288.313 2.382 10 10 CECE CN(C)CC1(CNC(=O)Nc2ccc(N)cc2)CCC1 2163587684 TXBXHQFUQGVIAV-UHFFFAOYSA-N 276.384 2.122 10 10 CECE CCC[C@H]1CCOCC[C@@]1(NCCN=[N+]=[N-])C(=O)OC 2165350746 RBWAJCFAOCOHMQ-AAEUAGOBSA-N 284.360 2.025 10 10 CECE C[C@@H]1CCOCC[C@@H]1NC(=O)CCc1ccc(N)cc1 2165399008 BWCVLSLMLPSKJI-DOMZBBRYSA-N 276.380 2.133 10 10 CECE CC[C@@](C)(OC)c1noc(-c2cccc(O)c2O)n1 126901924 FZXGOVGPEKBLAY-CYBMUJFWSA-N 264.281 2.419 10 10 CECE CN(C)c1ccc(CN2C[C@H](C(F)(F)F)[C@@H](N)C2)cc1 720926644 UNMMMEOTVKRDAR-STQMWFEESA-N 287.329 2.074 10 10 CECE CN(C/C=C/c1ccc(N(C)C)cc1)C[C@H]1COCCO1 827140352 KWLSCFYHBPSQJJ-BDUNBXCCSA-N 290.407 2.113 10 10 CECE COC[C@H]1CCN1C/C=C/c1ccc(N(C)C)cc1 835056952 WYXWJDHLQZSSKA-DWTRPJMMSA-N 260.381 2.487 10 10 CECE C[C@@H](O)c1ccc(N2CCCCC23COC3)cc1O 1892827290 IGROAZNIMBJXFB-LLVKDONJSA-N 263.337 2.205 10 10 CECE Cc1cc(N(C)C)ccc1CN(CCO)[C@@H]1CCO[C@H]1C 840949832 CNMRCIAEKMZVPY-WMLDXEAASA-N 292.423 2.033 10 10 CECE CC[C@@H](NC[C@](C)(CO)OC)c1cc(Cl)ccc1O 848557075 BYQLAIZATGXOHO-TZMCWYRMSA-N 287.787 2.484 10 10 CECE C[C@H](O)[C@@H]1C[C@@H]1NCc1cccc(Br)c1O 1896006204 HQEHJTKOPDBTNK-ARENWVFISA-N 286.169 2.014 10 10 CECE C[C@@H](NC[C@H]1CN(C2CC2)C(=O)O1)c1ccccc1O 844313056 QKKDUXIMILIBRR-PWSUYJOCSA-N 276.336 2.026 10 10 CECE O=C(N[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1cccc(O)c1O 1329365520 PXLMFYLMNZSKCP-QNSHHTMESA-N 283.274 2.261 10 10 CECE CC(C)N(C)C(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843349755 AJYMPFADFVHIDT-CYBMUJFWSA-N 289.423 2.153 10 10 CECE O=C(CC(F)(F)C(F)F)NCc1c(O)cccc1F 928710466 MKGQRDRKKOJXEP-UHFFFAOYSA-N 283.196 2.438 10 10 CECE CCCOCCOC(=O)NCc1c(O)cccc1F 921451446 PWKLCHLUFODSDZ-UHFFFAOYSA-N 271.288 2.184 10 10 CECE CCn1cc(CNC/C=C/c2ccc(N(C)C)cc2)nn1 850366695 JHGZQMYIDKZNMI-AATRIKPKSA-N 285.395 2.167 10 10 CECE Oc1cccc2c1[C@@H](NC[C@H]1CNCCC1(F)F)CC2 925777848 QZAMNCHCSWXJBQ-NEPJUHHUSA-N 282.334 2.214 10 10 CECE CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2C)[C@H]1OC 1334955394 COIVNRAXSAGNMQ-GVDBMIGSSA-N 292.423 2.343 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)CP(C)(C)=O 1899484886 KTIAYXGAGUSLPW-SNVBAGLBSA-N 283.312 2.108 10 10 CECE Nc1ccc(C[C@H](O)Cc2ccncc2Cl)cc1 696564018 KHLVVEUZZXDYMN-ZDUSSCGKSA-N 262.740 2.463 10 10 CECE C[C@H]1CC[C@@H](NCc2cc(Br)ccc2O)CN1 863485620 NUGJQGWNDDXUKB-JOYOIKCWSA-N 299.212 2.385 10 10 CECE CSCCNC(=S)N[C@@H](C)c1ccccc1O 865270547 VLWSYWCRAPWLKR-VIFPVBQESA-N 270.423 2.280 10 10 CECE Nc1ccc(Cn2cc(C(F)(F)F)ccc2=O)cc1 57837768 OSBVVTNMGMJFNM-UHFFFAOYSA-N 268.238 2.498 10 10 CECE CC(=O)N1CCC(NCc2cc(Cl)cc(C)c2O)CC1 775818483 USCYGZXXOJNVHC-UHFFFAOYSA-N 296.798 2.455 10 10 CECE CCCOc1cc(N2CC[C@@H](NC)C2)ccc1[N+](=O)[O-] 133109025 OWCOHPMHBZHQSU-LLVKDONJSA-N 279.340 2.182 10 10 CECE CCCCCCNC(=O)[C@@H](N)c1cc(C)ccc1O 83479288 SMKIPXUXUGPDGQ-AWEZNQCLSA-N 264.369 2.397 10 10 CECE CCC(CC)c1nnc([C@@H](N)c2cc(O)ccc2O)o1 83580728 FCIPLTAMGPPPHJ-LBPRGKRZSA-N 277.324 2.433 10 10 CECE COc1cc(O)c2c(c1)[C@H](c1ccccc1O)NCC2 83620743 OJVGMBSBLDYPMA-INIZCTEOSA-N 271.316 2.342 10 10 CECE CC1(C)CN(c2ccc3c(c2)OCCO3)CCCN1 86285777 IUJMXRWJYPRJBA-UHFFFAOYSA-N 262.353 2.036 10 10 CECE COc1cc(C)cc(CN2CCC[C@@](O)(C3CC3)C2)c1O 895261590 VTOYPENVGKRVCG-KRWDZBQOSA-N 291.391 2.446 10 10 CECE CC[C@H](c1ccccc1O)N1CC([C@@H](C)C(=O)O)C1 166037265 ICLJOWSLWHSYNP-ZWNOBZJWSA-N 263.337 2.496 10 10 CECE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc[nH]n1 1135800280 CDUSTLXEIDPCNY-UHFFFAOYSA-N 284.363 2.282 10 10 CECE CCNCc1ccc(OC)c(Cn2ccnc2C)c1 16942169 RJCJSAYFBLOFGH-UHFFFAOYSA-N 259.353 2.358 10 10 CECE OCCC1(NCc2ccc3c(c2)CCO3)CCSCC1 719664472 YJDAEJJKSDNTCM-UHFFFAOYSA-N 293.432 2.359 10 10 CECE CC(C)Cn1ccnc(OCc2ccc(N)cc2)c1=O 61767048 CCEUWIOYPRCCKB-UHFFFAOYSA-N 273.336 2.061 10 10 CECE CC(C)(O)[C@H]1CCN(c2ccc(CN)c(F)c2F)C1 721844766 FLWQXUXLVDJOQA-JTQLQIEISA-N 270.323 2.021 10 10 CECE CC[C@@H](c1ccccc1O)N(C)C[C@@H]1CCCS1(=O)=O 710645955 NPGYNZCXJKJCED-JSGCOSHPSA-N 297.420 2.352 10 10 CECE CCN(CCO)c1c(F)cc(CNC(C)C)cc1F 62711440 FIDAPHGJXOBQHP-UHFFFAOYSA-N 272.339 2.281 10 10 CECE CC[C@@H](NC(=O)c1cccc(O)c1O)[C@H]1CCCOC1 723839514 JPEJGNBFKZIYIU-CMPLNLGQSA-N 279.336 2.033 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@H]2C[C@H](OC)C2)c1 714665276 AHJHUHIAVRICPF-NQBHXWOUSA-N 265.353 2.476 10 10 CECE COc1ccc(O)c(CNC[C@H]2CCC[C@@H](C)O2)c1 688873187 CLKYOQQPDBQBIK-BXUZGUMPSA-N 265.353 2.448 10 10 CECE CC(C)(C)N(CCCO)c1c(F)cc(CN)cc1F 689903214 BKANUNVOPUIQHN-UHFFFAOYSA-N 272.339 2.411 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3COC[C@H]3C2)cc1 690293029 VDDHXTDTOBLWHW-VHDGCEQUSA-N 260.381 2.440 10 10 CECE CCc1cccc(CN[C@@](C)(CO)C(C)C)c1O 691472839 DBBCPLSSFAKCJE-HNNXBMFYSA-N 251.370 2.451 10 10 CECE C[C@@H](O)c1ccc(N(C)CC2CN(C)C2)c(Cl)c1 692223775 ROVOXHNOMAMAHL-SNVBAGLBSA-N 268.788 2.391 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)[C@@](C)(CO)C2)c(F)c1 694638781 YNOHQDVRWXQKEL-ZIBATOQPSA-N 266.360 2.300 10 10 CECE CNCc1cc(F)c(N2[C@H]3CC[C@H]2COC3)c(F)c1 695040822 ZDFSUXLXTORBHH-QWRGUYRKSA-N 268.307 2.052 10 10 CECE O=C(O)CC[C@@H]1CCCN(Cc2ccc(O)cc2O)C1 86809348 HMBABOXQZVGUDW-NSHDSACASA-N 279.336 2.175 10 10 CECE Nc1ccc(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(Cl)c1 697303299 ZEGXWTHPECDMCO-AOOOYVTPSA-N 276.723 2.378 10 10 CECE C[C@H](CNC(=O)Cc1ccc(N)cc1)CC(F)F 697427864 SEJPRXJRMOYZDP-VIFPVBQESA-N 256.296 2.219 10 10 CECE CN(C[C@H]1C[C@@H]2C[C@@H]2C1)C(=O)COc1ccc(N)cc1 698058731 MQICQRAZHLDDOW-CLLJXQQHSA-N 274.364 2.152 10 10 CECE O=C(NCc1c(O)cccc1O)c1nc(Cl)ccc1F 1156886116 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Cc1c(CN[C@@H]2[C@@H]3CCO[C@H]32)n(C)c2ccccc12 2119894481 KDTVAQQQKXVTTF-APHBMKBZSA-N 256.349 2.364 10 10 CECE CN(CCCCCC(=O)O)Cc1ccc(O)c(O)c1 2127806368 PASFWKDIRKWKKY-UHFFFAOYSA-N 267.325 2.175 10 10 CECE CN(CC1(CO)CC1)c1ccc2c(c1)CCC[C@@H]2O 2128274882 RKSCRWWIPWOQMT-HNNXBMFYSA-N 261.365 2.265 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(CC)CCF)ccc21 2128266579 KPJLDSJMTZJTPU-ZDUSSCGKSA-N 265.332 2.085 10 10 CECE CC[C@]1(O)CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128274333 NYTWNTWWJOURTE-HOTGVXAUSA-N 260.381 2.374 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@@](C)(CO)C3)ccc21 2128309062 NJKIPHKSDRNKLU-HZPDHXFCSA-N 260.381 2.102 10 10 CECE CN(C)CCC1CN(c2ccc3c(c2)CC[C@@H]3N)C1 2128327026 LFMFZTNUQSFIBY-INIZCTEOSA-N 259.397 2.021 10 10 CECE Oc1ccc(CNCCC2CC(F)(F)C2)c(O)c1O 2131105327 YYPHHZCGGGNVLD-UHFFFAOYSA-N 273.279 2.328 10 10 CECE C[C@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)C[C@@H](C)S1 2132055665 VQTWFRZVPIGAQG-AOOOYVTPSA-N 282.365 2.417 10 10 CECE COCCNCc1ccc(OC[C@H]2C[C@@H]2F)c(C)c1 2131828168 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1912210336 IDWCJHNTRRZMMK-NNYUYHANSA-N 284.385 2.280 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H](O)[C@@H]3CC[C@H]32)c(F)c1 2133738594 YUYZRFWWMLOIOU-YYWQGFNFSA-N 264.344 2.195 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3ccc(O)c(O)c3)C[C@@H]21 2133899840 XPYZWUHNNCZJJH-OZTPJHRESA-N 263.337 2.001 10 10 CECE Nc1ccc(NC(=O)[C@@H]2CCCCC[C@@H]2C(=O)O)cc1 1916158692 VZRNROBKDTVMII-OLZOCXBDSA-N 276.336 2.488 10 10 CECE CNCc1ccc(N2CC[C@@H](O)[C@H]2C)c(C(F)(F)F)c1 1914258326 VUCMSCAWGQTQOI-NOZJJQNGSA-N 288.313 2.384 10 10 CECE NCc1ccc(N2CC[C@@](F)(CO)C2)c(C(F)(F)F)c1 1917101673 XPYLBAVXMCALIN-LBPRGKRZSA-N 292.276 2.075 10 10 CECE Nc1ccc(NC(=O)N2CC[C@]3(CCC[C@@H]3O)C2)cc1 1918901885 MGMLFWLZKWTZRB-DZGCQCFKSA-N 275.352 2.038 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@@H](O)C2)cc1O 225208126 OVYNMSLJKOHSNV-DGCLKSJQSA-N 264.369 2.024 10 10 CECE CCCN[C@H](c1ccccc1O)c1nnn(C)c1CC 1923651893 QBSRMDHDYYWXAF-CQSZACIVSA-N 274.368 2.172 10 10 CECE CCCc1c([C@H](N)c2ccccc2O)nnn1CC 1923636383 DVDLFUWPJBBZRY-CYBMUJFWSA-N 260.341 2.004 10 10 CECE C[C@H]1C(=O)CCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1558649506 LQNQEJABESEODV-VIFPVBQESA-N 288.307 2.043 10 10 CECE COc1ccc(N2C[C@@H](O)CC(C)(C)C2)c([N+](=O)[O-])c1 1923160839 IPTZCSMIEQKMAY-JTQLQIEISA-N 280.324 2.201 10 10 CECE O[C@H]1CN(c2ccc(CNC3CC3)cc2)C12CCC2 2136738781 JJIIAIWRVNRAPQ-HNNXBMFYSA-N 258.365 2.042 10 10 CECE C[C@@H](C(=O)NCc1ccc(O)cc1O)c1cccc(O)c1 1639444384 JVODCFBLBMKHOX-SNVBAGLBSA-N 287.315 2.223 10 10 CECE CCC[C@H]1CCN(C[C@@H](O)COc2ccc(N)cc2)C1 228662715 KJJMKTHJECYRKH-DZGCQCFKSA-N 278.396 2.131 10 10 CECE Cc1nccc(C(=O)NCc2cc(Cl)ccc2O)n1 1644590986 YACQXHYFPSRNPT-UHFFFAOYSA-N 277.711 2.074 10 10 CECE C[C@H](NC(=O)NCc1cccnc1O)c1ccccc1O 1637423525 ASNPKYQPPAJMIZ-JTQLQIEISA-N 287.319 2.053 10 10 CECE COc1cc(Cl)cc(CN(C)[C@H](C)CC(=O)O)c1O 1926940068 UDIZZSRUCGYCSK-MRVPVSSYSA-N 287.743 2.349 10 10 CECE COc1cc(C(=O)N[C@H](C)c2ccccc2O)ccn1 1643738480 CQTZWUSAJIGJTK-SNVBAGLBSA-N 272.304 2.287 10 10 CECE OCC[C@@H]1CCN(c2ccc(CNC3CC3)cc2F)C1 123742452 GBILJTOZZPSTPE-LBPRGKRZSA-N 278.371 2.286 10 10 CECE C[C@H]1COCCN1c1ccc(CN)cc1Br 169174021 QERBLAHYFAHILN-VIFPVBQESA-N 285.185 2.133 10 10 CECE Cc1cc(C)c(O)c(CN2CCC(n3cncn3)CC2)c1 164362731 GIMBLXFFVRNPMR-UHFFFAOYSA-N 286.379 2.438 10 10 CECE CNCc1cc(F)c(N(C)CCSC)c(F)c1 167823690 QGGTXAJWHCKWCA-UHFFFAOYSA-N 260.353 2.483 10 10 CECE Cc1c(O)cccc1C(=O)NCCc1ccc(O)c(O)c1 159822453 JDACROQJZRYNGQ-UHFFFAOYSA-N 287.315 2.084 10 10 CECE C[C@H]1CCC[C@H](C)N1CC(=O)Nc1ccc(N)cc1 22210355 BBMOBDAHEWUPFC-RYUDHWBXSA-N 261.369 2.470 10 10 CECE CN(c1ccc2c(c1)OCO2)[C@H]1CCNC(C)(C)C1 258768355 JXGSPPSACYRLFH-LBPRGKRZSA-N 262.353 2.382 10 10 CECE CN[C@H]1CCN(c2ccc(OC)cc2OC)C1(C)C 259459253 PXHFVYQDBWVLPD-AWEZNQCLSA-N 264.369 2.281 10 10 CECE O=C(c1sccc1O)N1CCC[C@@]2(CCCNC2)C1 31989955 VXAKQMWPKKUGAH-CQSZACIVSA-N 280.393 2.060 10 10 CECE CO[C@@H]1C[C@H](C)CN(c2ccc(CCN)c(C)c2)C1 2141003328 OYKZPYAHKXGGHQ-BLLLJJGKSA-N 262.397 2.357 10 10 CECE Cc1ccc(N(C)c2ccnc(C[C@H](C)N)c2)cn1 2140749380 RZOMPCALPUQFCV-NSHDSACASA-N 256.353 2.443 10 10 CECE COC[C@]1(F)CCN(Cc2cccc(F)c2O)C1 1875796890 RFEPVDLYFNRMJC-ZDUSSCGKSA-N 257.280 2.092 10 10 CECE CCCOc1cc(N2CCC[C@H](NC)C2)ccc1N 1876314581 CYMQYONGZSRZDB-LBPRGKRZSA-N 263.385 2.246 10 10 CECE C[C@@H]1CC[C@H](CNCc2ccc(O)cc2O)S1 1946331157 XUMIRACHUJLNNQ-BXKDBHETSA-N 253.367 2.472 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](C)[C@](C)(O)C2)cc1O 1876950857 XNDHYUKOWVZFRX-ZIBATOQPSA-N 264.369 2.009 10 10 CECE CCOc1ccc(S(=O)(=O)N=[N+]=[N-])cc1OCC 34669680 NBSJSANPEKRTLU-UHFFFAOYSA-N 271.298 2.483 10 10 CECE CCNCc1ccc(N2C[C@@H]3COCC[C@@H]32)cc1C 1878823345 FQXWCMKORXNXEY-ZBFHGGJFSA-N 260.381 2.330 10 10 CECE C[C@@H]1COCCN(c2c(F)cc([C@@H](C)N)cc2F)C1 1880926166 ZSHOKWDLJZBFJZ-VHSXEESVSA-N 270.323 2.457 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@H](O)[C@H]2C)c(F)c1 1880960048 FVUDRXFJBVWJII-RWEMILLDSA-N 270.323 2.334 10 10 CECE CCN(CCCO)c1c(F)cc([C@@H](C)NC)cc1F 1880961210 UTLUFLSDNSQHCA-SNVBAGLBSA-N 272.339 2.454 10 10 CECE 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CN(C)c1ccc(O[C@]2(C(=O)O)CCOC2(C)C)cc1 2237681308 YPYKGOYYVBUMOD-HNNXBMFYSA-N 279.336 2.154 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2C[C@H]3CC[C@H]2O3)cc1O 2228079580 COWXNVWGVYQYQF-ZTYOMDHBSA-N 262.353 2.168 10 10 CECE CC/C=C\CCOC[C@H](O)COc1ccc(N)cc1 2228238040 NXUWBIOLEPYVJZ-NQHOJNORSA-N 265.353 2.381 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[C@@H]2OCCO[C@@H]2C1 2240843217 BDUKDFFJLKDCRD-VBNZEHGJSA-N 277.364 2.042 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCNC(=O)[C@H]1C(C)C 2240842985 ZBRBLNKVUUFBDP-SWLSCSKDSA-N 276.380 2.009 10 10 CECE CNC(=O)[C@H]1CCCCN1c1ccc([C@H](C)O)c(C)c1 2285168649 ATRUWMQIACMQRX-SWLSCSKDSA-N 276.380 2.153 10 10 CECE CSc1ncc(CNC[C@@H]2NCC[C@H]2C2CC2)s1 2257132561 DLHDBIWXGQZBTD-RYUDHWBXSA-N 283.466 2.343 10 10 CECE NCc1ccc(N2CCn3cncc3C2)cc1Cl 2258568239 LJZQPVZCMURFQN-UHFFFAOYSA-N 262.744 2.015 10 10 CECE C[C@@H]1[C@H](CCNCc2ccc(O)c(O)c2O)[C@@H]1C 2260464538 MHCJMSZLKNIQGT-DOFRTFSJSA-N 251.326 2.185 10 10 CECE C[C@@H](CCNCc1cccc(O)c1O)OC(F)F 2261330438 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COc1cc(OC)c(N2CCCC[C@H]2CO)cc1OC 2289332057 ROUGIQWIYJWRAP-NSHDSACASA-N 281.352 2.064 10 10 CECE Nc1cc(Cl)c(N2C(=O)[C@H]3CC[C@@H]3C2=O)c(Cl)c1 2317917210 GYKJZBHVSOJXJO-BQBZGAKWSA-N 285.130 2.475 10 10 CECE CN[C@@](CSc1nccs1)(C(=O)O)[C@@H]1CC1(C)C 2318458206 CDCFMCJFIHZRJA-PRHODGIISA-N 286.422 2.324 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@H]1SC 2328063452 JFPGATRDEMTXQH-KOLCDFICSA-N 272.374 2.104 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NC[C@@H]1C[C@H]1CO 2330472793 HFJAZDCJPGOFMQ-ZDEQEGDKSA-N 261.365 2.467 10 10 CECE CSc1ncc(CNC[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2CO)s1 2334411452 ZWNGJYHPRVORJC-DNIRFERGSA-N 296.461 2.385 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C[C@H](CC(=O)O)C1CC1 2337776061 ISCLJOLURKFSKK-SNVBAGLBSA-N 268.317 2.036 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC[C@@H](N(C)C)C2)c1C 2340859444 KCZGWAFQKGOYOY-ZIAGYGMSSA-N 261.413 2.463 10 10 CECE Nc1ccc(Cn2cc3c(cc2=O)CCCC3)cc1 2342729677 MTZMIVDTORDMGR-UHFFFAOYSA-N 254.333 2.358 10 10 CECE C[C@H]1SCC[C@@]1(C(=O)O)N(C)Cc1ccccc1O 2345562390 KUTYJVHPIXMGST-QMTHXVAHSA-N 281.377 2.173 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@H]2CC[C@H]1[C@H](O)C2 2349991804 ABAOFGUJHCXODE-GUYJKWIASA-N 261.365 2.398 10 10 CECE CSc1cc(N2CC(CCN(C)C)C2)ccc1CN 2353854280 QUGGYYRZBJPTFY-UHFFFAOYSA-N 279.453 2.255 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]32)cc1O 2353893348 QPBOODFWVKZVKX-CVMIBZJCSA-N 277.364 2.185 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)c(Cl)c2)[C@@H]2COC[C@@H]21 2354359840 QEWQELWBIODKCN-GGZSPTBLSA-N 296.798 2.210 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C[C@H](C)O)c(F)c1 250296692 PCPIBPQKBVRAAF-QWRGUYRKSA-N 254.349 2.313 10 10 CECE COn1cc(CNC(=S)SC)c2ccccc21 6019397 KFZBENSULWNJKD-UHFFFAOYSA-N 266.391 2.437 10 10 CECE endogenous,in-man CCOC(=O)[C@@H]1CCCN1c1ccc(OC)cc1[N+](=O)[O-] 50086152 FZJHAQUUGTWYQX-LBPRGKRZSA-N 294.307 2.135 10 10 CECE O=C(Nc1ccc(F)c(F)c1F)c1cc(O)nc(O)c1 170223571 MCMCUNYICWAOBK-UHFFFAOYSA-N 284.193 2.162 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)C(=O)NCCC(F)(F)F 170030901 HYACTNFZBDIEEH-MRVPVSSYSA-N 291.269 2.345 10 10 CECE O=C(N[C@H]1CCC[C@@H]2CC[C@H]12)c1cc(O)c(O)c(O)c1 2356974892 GFZBWRWGOFLXAY-MIMYLULJSA-N 277.320 2.112 10 10 CECE COc1ccc(N(C)Cc2cccnc2NN)cc1 52720545 JFNLBZDLHQOQLU-UHFFFAOYSA-N 258.325 2.012 10 10 CECE CC(C)(C)OC(=O)N[C@H](CN)c1ccc(F)cc1O 1951471006 AQGRWNRRWREWQX-SNVBAGLBSA-N 270.304 2.056 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@H]1CCCO1 300443387 WGASYCITHCCUJZ-GHMZBOCLSA-N 251.326 2.270 10 10 CECE COc1ccc(N2CCCC[C@H]2CN(C)C)c(N)c1 404858252 BGEJJRRSELRLBY-LBPRGKRZSA-N 263.385 2.198 10 10 CECE Cc1ccc([C@@H](C)NC[C@@H](O)CN2CCCCC2)c(O)c1 185115420 XKTIDHWIFPVGBX-HUUCEWRRSA-N 292.423 2.198 10 10 CECE Cc1cc(S(=O)(=O)NCCN=[N+]=[N-])sc1Cl 231811415 PQWFSGCETXZVKY-UHFFFAOYSA-N 280.762 2.299 10 10 CECE COC(=O)[C@@]1(C)CCCN1Cc1cc(C)ccc1O 189994722 MLWBWGYWPJXZJI-OAHLLOKOSA-N 263.337 2.228 10 10 CECE CCOC(=O)[C@@](C)(N)Cc1cccc2c1ccn2C 1951795851 RMGLXMCHTLKWIW-HNNXBMFYSA-N 260.337 2.001 10 10 CECE CCCN1C(=O)CC[C@@H](N)[C@@H]1c1ccc2c(c1)CCN2C 70986290 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CN1CCCc2cc([C@H](O)[C@]34CCNC[C@H]3C4)ccc21 2163098772 XXKHPHGVDDTRMF-PVAVHDDUSA-N 272.392 2.102 10 10 CECE CO[C@@H]1C[C@]2([C@H](N)c3ccc4c(c3)CCCN4C)C[C@H]12 2163104059 ARDWDWJDMZNNRW-MWQQHZPXSA-N 272.392 2.494 10 10 CECE CN1CCc2cc([C@H](Cc3ccccc3)NN)ccc21 2163138881 RRKMPCQBMLZBKV-INIZCTEOSA-N 267.376 2.426 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H](O)c3cncs3)ccc21 2163141675 XBPFCPKHLHEVGM-CABCVRRESA-N 289.404 2.259 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)[C@H](OC)C(C)C 2163146546 UXOZJICSIAPUMK-BZUAXINKSA-N 280.412 2.045 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H]1CC2(CC2)CO1 2166401489 KNUPHIBBNFIWDI-OAHLLOKOSA-N 276.380 2.149 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](CO)[C@@H](C(F)(F)F)C2)cc1 2163287815 FVVCSBFKSVXBCO-CDMKHQONSA-N 288.313 2.313 10 10 CECE CC(C)Oc1ccc(N(C)C)c(C(=O)N(C)C)c1 725441485 DDIZMGISWLCKJD-UHFFFAOYSA-N 250.342 2.242 10 10 CECE Oc1ccc(CNC[C@H]2CC[C@H](C(F)(F)F)O2)cc1O 722397462 GGINBEQKRGZSJX-BXKDBHETSA-N 291.269 2.297 10 10 CECE 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10 10 CECE COc1ccc(N(C)CCN(C)C(=O)C(C)(C)OC)cc1 844855223 ZZFOMDSGWHZOOH-UHFFFAOYSA-N 294.395 2.015 10 10 CECE CO[C@@]1(CO)CCCN(Cc2ccc(N(C)C)c(C)c2)C1 852408503 BJNNDRYUKXMFMY-KRWDZBQOSA-N 292.423 2.034 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)N3CCCC3)C2)cc1 853818662 YQKHPHKXYWTHER-ZDUSSCGKSA-N 289.379 2.079 10 10 CECE Oc1ccc(Cl)c(F)c1CNCC12CC(CN1)C2 853246523 MGOMLIBOFWWENK-UHFFFAOYSA-N 270.735 2.026 10 10 CECE COc1ccc([C@H](C)NCC(=O)OC(C)(C)C)c(O)c1 164128658 APNKAFPQYCBDCI-JTQLQIEISA-N 281.352 2.393 10 10 CECE CC(C)(C)OC(=O)NC1(C2CN(CCN=[N+]=[N-])C2)CC1 1954206306 DQFGCMBYQJZPJL-UHFFFAOYSA-N 281.360 2.286 10 10 CECE CCc1cccc(CN2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1O 862526468 BKOSWHNIVMHMHZ-SIFCLUCFSA-N 293.432 2.440 10 10 CECE CCNC[C@@H]1CCN(c2ccc(OC)c(OC)c2)C1 53011208 SHKXHEYXKUYASK-LBPRGKRZSA-N 264.369 2.140 10 10 CECE CN(C)c1ccc([C@@](C)(N)CNC(=O)OC(C)(C)C)cc1 1955951161 BPCAPJQKWYDSGW-INIZCTEOSA-N 293.411 2.451 10 10 CECE CCOc1ccc(O)c(CN2CCSC[C@@H]2CCO)c1 770306621 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CC[C@@H]1CC[C@H](C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)O1 2136709305 NLTBCUYPFDUNDS-QJPTWQEYSA-N 266.345 2.493 10 10 CECE Oc1ccccc1CN[C@@H]1CCC[C@H]1[C@@H]1CCCN1 228408115 AUQWQPZTTNVZHY-SOUVJXGZSA-N 260.381 2.403 10 10 CECE CC1(C)C[C@@H](N)CN1Cc1cc(Br)ccc1O 1925245352 DEGNBSOXYBJZIE-LLVKDONJSA-N 299.212 2.466 10 10 CECE Cc1ccc(O)c([C@H](C)NCC(=O)N2CCCCC2)c1 228804156 JLHOHELDDQKXLN-ZDUSSCGKSA-N 276.380 2.364 10 10 CECE CN[C@H](C)c1ccc(N2CC(=O)N(C)[C@H](C)C2)c(Cl)c1 1925984992 UFIIIMZRWDVIAR-GHMZBOCLSA-N 295.814 2.287 10 10 CECE Cc1cccc(O)c1CNC[C@]12CO[C@](CF)(C1)C2 2137991805 FHGRNHSWTINRGW-GASCZTMLSA-N 265.328 2.309 10 10 CECE CCCN(CCc1cnn(C)c1)c1ccc(CN)cc1 230749267 MYTGJWNHQUBGFW-UHFFFAOYSA-N 272.396 2.338 10 10 CECE COc1ccc(CN[C@H]2CCO[C@@H]2C2CC2)c(O)c1 230316059 GXUYBNVAMLBXTJ-DZGCQCFKSA-N 263.337 2.058 10 10 CECE O=Cc1ccc(CC(=O)NCc2c(O)cccc2F)cc1 1596917158 WTNFSGRVBHYFBV-UHFFFAOYSA-N 287.290 2.203 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1nc(C)cs1 162666339 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CECE C[C@@H](c1c(O)cccc1O)N1CCC2(CCNC2)CC1 2143827752 AUZQIFFCTPAUKK-LBPRGKRZSA-N 276.380 2.234 10 10 CECE COc1ccc([C@H](C)N[C@H]2CCCC[C@H]2O)c(O)c1 251503831 GNAPIBAGIFMDJL-LEWSCRJBSA-N 265.353 2.355 10 10 CECE Oc1ccccc1CN1C[C@@]23CCC[C@]2(COC3)C1 1967849394 HTKOQGYDDZBDMU-HZPDHXFCSA-N 259.349 2.395 10 10 CECE O=C(O)[C@@H]1C=CCN(Cc2ccc(Cl)cc2O)C1 1968223628 MRFOAORMMXGCAG-SNVBAGLBSA-N 267.712 2.118 10 10 CECE CN1CCc2cc(CN[C@@H]3COC[C@H]3C3CC3)ccc21 2144659158 BAAJERLMECRNTO-JKSUJKDBSA-N 272.392 2.194 10 10 CECE Oc1c(CN2CCOC[C@@H]2C(F)F)ccc(F)c1F 1971849351 ZJVAGRMPVAOXBM-SECBINFHSA-N 279.233 2.136 10 10 CECE COC[C@@H](NCc1cccc(F)c1O)C(F)(F)F 1973151558 LVTDVHCJTQHZQG-SECBINFHSA-N 267.222 2.198 10 10 CECE Nc1ccc(OC[C@@H](O)CSC[C@H]2CCCOC2)cc1 2145508405 JSNUDLSJDYUHLO-GXTWGEPZSA-N 297.420 2.168 10 10 CECE Cn1nc(CN2CCC[C@@H](N=[N+]=[N-])C2)cc1Br 2002883638 QVCSLKBZIKGSJH-MRVPVSSYSA-N 299.176 2.457 10 10 CECE C[C@@H](NCc1nccn1C1CC1)c1c(O)cccc1O 2148838301 UICBVPSEKCWVLR-SNVBAGLBSA-N 273.336 2.480 10 10 CECE CC(C)(C)NCc1cc(F)c(N2CC(CO)C2)c(F)c1 2148961519 HOGHCBJORZQYFL-UHFFFAOYSA-N 284.350 2.281 10 10 CECE CO[C@@H]1CN(c2ccc(C=CC(=O)O)cc2C)C[C@H]1F 2146472907 DXECCIRRVXDUGT-TZMCWYRMSA-N 279.311 2.266 10 10 CECE CC(C)N1CCC(NCc2cccc(F)c2O)CC1 158680365 HQDJVCWRTLHZBW-UHFFFAOYSA-N 266.360 2.494 10 10 CECE CN(C)CC1(NCc2ccc(N3CCCC3)cc2)CC1 2146536564 IBVDWDJNXNAWGZ-UHFFFAOYSA-N 273.424 2.471 10 10 CECE CCN[C@H](C)c1ccc(N2CC(=O)NC(C)(C)C2)cc1 2150470823 VOXOCJIDJLFMCX-GFCCVEGCSA-N 275.396 2.072 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@H](O)C[C@@H]2C)cc1O 2149518495 HPWXRWPANQCDDH-UUIJZJDISA-N 278.396 2.268 10 10 CECE C[C@H](c1ccccc1O)N(C)S(=O)(=O)c1cccnc1 38089835 XAORKPRZCDGEDP-LLVKDONJSA-N 292.360 2.169 10 10 CECE C[C@@H]1CNCCCN1Cc1c(O)cccc1Cl 1996995620 LUZMADYJUZYESB-SNVBAGLBSA-N 254.761 2.229 10 10 CECE C[C@H](N(C)C(=O)[C@@H]1CNc2ccccc2N1)C(F)(F)F 2151714581 SWSMKNGRICHOST-KWQFWETISA-N 287.285 2.302 10 10 CECE Cc1nc(CNC(=O)COc2ccc(N)cc2)c(C)s1 2152814696 UEIINRGQDDDVQB-UHFFFAOYSA-N 291.376 2.037 10 10 CECE Nc1ccc(O)c(CN2CC[C@@H]([C@@H]3CCCCO3)C2)c1 2153045292 KLJZSAGVQRJIKA-WBMJQRKESA-N 276.380 2.365 10 10 CECE C[C@H]1CCC[C@H]1S(=O)(=O)Nc1ccc(O)cc1 2006762852 BXNNXHACTZGGST-JOYOIKCWSA-N 255.339 2.323 10 10 CECE CN1CCc2cc(CNCc3cc(Cl)n(C)n3)ccc21 2153825977 SXTRBLKAIVQJAF-UHFFFAOYSA-N 290.798 2.356 10 10 CECE C[C@H](NC[C@@H]1CCCN(C)C1)c1cc(O)ccc1O 44534895 PGWPTMDHJCQNDH-RYUDHWBXSA-N 264.369 2.090 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2COCCCO2)c(F)c1 2154006940 KXRFEMGULKAEPB-DGCLKSJQSA-N 283.343 2.121 10 10 CECE COc1ncsc1C(=O)[C@H](O)c1ccc(N(C)C)cc1 2154031002 CECSCOMBSLXZBG-LLVKDONJSA-N 292.360 2.134 10 10 CECE COc1ccc([C@@](C)(N)c2ccc(N(C)C)cc2)cn1 2154682640 HDELPZILRFTFSQ-INIZCTEOSA-N 271.364 2.378 10 10 CECE CCOCCOC(=O)N(Cc1ccc(N)cc1)C1CC1 2154696285 WYFVPZPSYOFYLL-UHFFFAOYSA-N 278.352 2.406 10 10 CECE CC[C@H]1CCN(c2ccc(OC)c(OC)c2)CCN1 49661048 FZTWGEMCCOFJTM-LBPRGKRZSA-N 264.369 2.282 10 10 CECE CCCN1CC[C@@H](CNCc2ccc(F)cc2O)C1 294466962 ZEMSTQMFIVDGST-LBPRGKRZSA-N 266.360 2.353 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@@]12CCOC2 2156726618 YKXRPARUXAKBHY-GDBMZVCRSA-N 274.364 2.044 10 10 CECE C[C@]1(C(=O)NCc2cc(N)ccc2O)C[C@@H]1C(F)(F)F 2156884515 BJSBFVBKLBAIAL-JQWIXIFHSA-N 288.269 2.179 10 10 CECE C[C@@H](N(C)CCCc1ccc(N)cc1)C(C)(C)O 2030158217 SRZZFOUUNXVDOO-GFCCVEGCSA-N 250.386 2.293 10 10 CECE Oc1ccc(Cl)cc1CN1CC=CCC12CNC2 2032549249 NVHJVFLEFKAPMZ-UHFFFAOYSA-N 264.756 2.150 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1CC[C@@H](F)C1 2032985392 STKCHTNMVWQMGY-VXGBXAGGSA-N 250.317 2.365 10 10 CECE C[C@@H]1CCOC[C@@H]1N(C)c1ccc(CN)cc1F 2035131187 HQAZRFNVNLKMJT-YGRLFVJLSA-N 252.333 2.146 10 10 CECE C[C@@H]1CCO[C@H]1CC[C@@H](NN)c1ccc(N(C)C)cc1 2157347074 WIPANPANQFLKFZ-WQVCFCJDSA-N 277.412 2.462 10 10 CECE CNCc1ccc(N2C[C@H](O)CC2(C)C)cc1Cl 2037339750 GMMREDZLBAZDBV-GFCCVEGCSA-N 268.788 2.409 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1 300506977 ARMMHICTTUDUQU-UKMLZYKCSA-N 260.381 2.304 10 10 CECE CCOC(=O)[C@@H]1C[C@H]1CNCc1ccc(N(C)C)cc1 2160467711 LFLAGMBEFQGCBE-DZGCQCFKSA-N 276.380 2.041 10 10 CECE COc1ccc(CN(C)[C@@H]2CC[C@H](C)OC2)c(O)c1 401541797 UVPZDHRKKHHQAM-WCQYABFASA-N 265.353 2.400 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CC[C@@H]3C[C@H]3C2)cc1 403287258 SLKNKYHNASLTDD-MBNYWOFBSA-N 274.364 2.343 10 10 CECE C[C@H](CCN[C@H]1CCc2cccc(O)c21)[S@](C)=O 311044811 HDAOXAYXFHDZQA-MYFIVHGGSA-N 267.394 2.126 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CN3CCC2CC3)cc1 312467626 WTOZBLSWNNAABG-DYVFJYSZSA-N 273.424 2.497 10 10 CECE CC[C@H](N)c1ccc(N2CCC[C@H](S(C)(=O)=O)C2)cc1 312849449 QECWIZOAVWJGFV-GJZGRUSLSA-N 296.436 2.110 10 10 CECE C[C@@]1(NC(=O)COc2ccc(N)cc2)C[C@H]1C(F)(F)F 2158614344 VEFLXONBZDMMGE-ZYHUDNBSSA-N 288.269 2.105 10 10 CECE C[C@@H](NC1CC(O)(C(F)(F)F)C1)c1c(O)cccc1O 2158822138 DONPANAACTWQPA-OQNPIJIBSA-N 291.269 2.204 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCC[S@](=O)CC2)c1 321847193 BJKQIHOUKPQWMT-XIKOKIGWSA-N 267.394 2.216 10 10 CECE CCOC(=O)[C@@H](NCC(F)(F)F)c1c(O)cccc1F 2160772752 QWGKUOAVNAXSEH-JTQLQIEISA-N 295.232 2.287 10 10 CECE O=C(O)[C@]12CCCN(Cc3c(O)cccc3F)C[C@H]1C2 2160780335 SJPWQCWDHRTVHU-BMIGLBTASA-N 279.311 2.218 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H]3CC[C@@]2(CO)C3)c1 2161029873 BPNQVFYRORBLQV-LYRGGWFBSA-N 277.364 2.042 10 10 CECE C[C@@H]1CCN(c2ccc(CO)c(Cl)c2)C[C@H]1CO 700397586 DBRVWCDKRLXPKI-PWSUYJOCSA-N 269.772 2.287 10 10 CECE CNCc1ccc(N2CCO[C@H](CCF)C2)c(C)c1 700575317 OZAMHTFFQATTGN-CQSZACIVSA-N 266.360 2.279 10 10 CECE CC1(C)CC[C@@H](CO)N(c2c(F)cc(CO)cc2F)C1 701598160 WZURPEBZTCWVOT-NSHDSACASA-N 285.334 2.444 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1CC12CC2 705201809 AKUCIKHJYZAFCA-UWVGGRQHSA-N 252.318 2.008 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@H](COC)C2)c(Cl)c1 705792252 BZDBLWWIYZGFLO-AAEUAGOBSA-N 298.814 2.472 10 10 CECE C[C@@H]1C[C@@H](N)CCN1Cc1c(O)cccc1Br 706855890 ZQHAADGJGBMCRS-ZJUUUORDSA-N 299.212 2.466 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H]2CCC[C@H]21 707730057 DDVJXRVUPRNFOX-LOWVWBTDSA-N 266.345 2.398 10 10 CECE O=C(O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cc(F)cc(F)c1O 708216435 SQICRCFTCDXQSI-CKYFFXLPSA-N 283.274 2.108 10 10 CECE N[C@@H]1CC[C@]12C[C@H]2[C@@H](O)c1ccc(N2CCCC2)cc1 2172516404 CMKJDWSZPLLPJJ-VVLHAWIVSA-N 272.392 2.448 10 10 CECE Cc1ccoc1CN(C)C(=O)Cc1ccc(N)cc1 388984953 ZWHNWWGWYFKXBB-UHFFFAOYSA-N 258.321 2.371 10 10 CECE CC(=O)c1ccc(O)c(CN2CCO[C@H](C)[C@@H]2C)c1 380370028 SMHQNVYHIVDTKR-CMPLNLGQSA-N 263.337 2.204 10 10 CECE COC[C@@]1(C)CCN(CCOc2ccc(N)cc2)C1 381616733 QJOYFFIDGHUBIW-HNNXBMFYSA-N 264.369 2.006 10 10 CECE CCNCc1ccc(N2CC(N(C)C3CC3)C2)c(C)c1 2172992448 HACJDGAFBAXZSX-UHFFFAOYSA-N 273.424 2.387 10 10 CECE Cc1cc(N2CC(N(C)C3CC3)C2)ccc1C[C@@H](C)N 2172992805 KSGLJLCHSQOYFK-CYBMUJFWSA-N 273.424 2.168 10 10 CECE C[C@@H]1C[C@H](O)CN1c1c(F)cc(CNC2CC2)cc1F 384806500 ZZJFCLQSTQNLOE-SKDRFNHKSA-N 282.334 2.176 10 10 CECE CCNCc1ccc(N2CC[C@H](CO)[C@@H]2C)c(C)c1 385666633 GZIPNMSZPIXBNR-DZGCQCFKSA-N 262.397 2.312 10 10 CECE CNCc1cc(F)c(N2C[C@H](C)C[C@@H](CO)C2)c(F)c1 398892328 ZQXXNXRHIUFYIU-ZYHUDNBSSA-N 284.350 2.139 10 10 CECE C[C@@H]1C[C@@H](C(=O)O)CN([C@H](C)c2ccccc2O)C1 398839735 JTNZQXQLJCKEKX-IJLUTSLNSA-N 263.337 2.496 10 10 CECE CNCc1ccc(N2C[C@@H](O)C3(CCCC3)C2)cc1C 2174372621 ZRXIPFFBNVFJPT-MRXNPFEDSA-N 274.408 2.456 10 10 CECE FC1(F)Oc2ccc(N3C[C@H]4CCNC[C@@H]4C3)cc2O1 2168776127 WQOILMYVNYAMML-NXEZZACHSA-N 282.290 2.054 10 10 CECE CN1CCCc2cc(CNC[C@H]3OCC[C@@H]3F)ccc21 2179085507 WTZUFCZFOPMOIU-GOEBONIOSA-N 278.371 2.286 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)[C@@H]1[C@H]2CCC(F)(F)[C@H]21 2175966054 RUFHSNXOAOCYKN-DKTYCGPESA-N 283.318 2.305 10 10 CECE CNCc1ccc(N2CCc3ncn(C)c3C2)c(Cl)c1 2170694292 DCLAADVBISRKCO-UHFFFAOYSA-N 290.798 2.356 10 10 CECE CCc1nn(Cc2ccc(OC)cc2O)c(N)c1C 2079604056 ZUAGEQIUFWOLAC-UHFFFAOYSA-N 261.325 2.099 10 10 CECE Cc1nnc2cc(CN3CCC[C@H]3CN=[N+]=[N-])ccn12 2188210337 MZHLQXUSZYNZCC-LBPRGKRZSA-N 271.328 2.312 10 10 CECE CCN(Cc1cnnn1C)c1ccc([C@H](C)N)cc1F 2196702992 AZTUZIDJRBRMMI-JTQLQIEISA-N 277.347 2.000 10 10 CECE CN(c1ccc(CN)c(F)c1)C1CC(n2ccnc2)C1 2182198716 FWVOQQXZMXSVBQ-UHFFFAOYSA-N 274.343 2.321 10 10 CECE NC[C@@]12CCC[C@@H]1CCN2Cc1cc(F)cc(F)c1O 2197354357 ZDPZNKCLOPCBAY-ABAIWWIYSA-N 282.334 2.374 10 10 CECE COC(=O)c1cnc(S[C@@H]2CCC[C@H](O)C2)s1 1909175793 DBKIDIKMSLOYED-JGVFFNPUSA-N 273.379 2.325 10 10 CECE N[C@]12CCC[C@]1(F)CN(c1ccc3c(c1)COCC3)C2 2198082972 KLXWRTILEVCTME-HOTGVXAUSA-N 276.355 2.169 10 10 CECE Nc1ccc(NC(=O)N2[C@H]3CC[C@@H]2C[C@H](CO)C3)cc1 2184584585 ZPOVUPBQYZJLAY-ZOZIMZAQSA-N 275.352 2.036 10 10 CECE CN1CCC[C@@H]2[C@H]1CCN2c1ccc2c(c1)CC[C@@H]2N 2184742295 VTEVSISHENNBJE-GVDBMIGSSA-N 271.408 2.306 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@H](N3CCC3)C2)c(F)c1 2194510475 IHFMUHBSSTXBNX-CMPLNLGQSA-N 282.334 2.303 10 10 CECE COc1cc(N)c(N2C[C@@H](F)C[C@H]2C)cc1OC 2042194554 COUWIPAZLMFDEX-BDAKNGLRSA-N 254.305 2.223 10 10 CECE Cc1nc([C@@H](NCCCN=[N+]=[N-])C(=O)O)c(C)s1 2042390586 HOUAGOYQOBSXOX-SECBINFHSA-N 269.330 2.176 10 10 CECE C[C@H](NOCCCN(C)C)c1ccc(F)cc1O 2044580865 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10 10 CECE CCN1CCc2cc([C@@]3(N)CCOC3(C)C)ccc21 2106787982 LXDGCIUFDPHEER-INIZCTEOSA-N 260.381 2.422 10 10 CECE CN1CCC[C@H]([C@@H](O)c2ccc3c(c2)CCN3C)C1 2106795560 ICURRRIWHRNSFL-HOCLYGCPSA-N 260.381 2.054 10 10 CECE CN(C)c1ccc([C@@H](N)[C@H]2CN3CCC2CC3)cc1 2106796241 OWPPEHNSKOLTFV-JKSUJKDBSA-N 259.397 2.094 10 10 CECE CCN(CC)c1ccc([C@@H](N)c2cccnn2)cc1 2106829821 AERGPNDFGXUCBO-OAHLLOKOSA-N 256.353 2.371 10 10 CECE CN1CCCc2cc([C@@H](O)[C@]3(C)CCCN3)ccc21 2106822425 FSDZYDOXFGFWHU-CVEARBPZSA-N 260.381 2.245 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)c1ncccn1 2106827482 CZPGNRONUVCLBZ-AWEZNQCLSA-N 255.321 2.159 10 10 CECE C[C@@H](C(=O)O)N(C1CC1)[C@H](C)c1c(O)cccc1O 2087125860 VJQJRRFZDMKKOV-BDAKNGLRSA-N 265.309 2.096 10 10 CECE Nc1ccc(NC(=O)CN2C[C@H]3CCC[C@H]2C3)cc1 2089623338 LQQZUXJLONCCFC-FZMZJTMJSA-N 259.353 2.082 10 10 CECE CC1(C)CO[C@H](C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)C1 2109966064 WMECZPRBNNTNHD-MNOVXSKESA-N 266.345 2.350 10 10 CECE CCCN[C@H](Cc1cnn(C)c1)c1ccccc1O 2090035601 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CC[C@@H](NCc1ccc(N(C)C)cc1)[C@@H](O)C(F)F 294972033 FUPRPSJYJNTSLK-CHWSQXEVSA-N 272.339 2.247 10 10 CECE Cc1ccoc1[C@@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2163136371 SEWAMRZVBQNVGG-CABCVRRESA-N 272.348 2.314 10 10 CECE CCc1nc(C(=O)[C@H](O)c2ccc(N(C)C)cc2)ns1 2163482792 LZNWJUOZAIXLAG-GFCCVEGCSA-N 291.376 2.083 10 10 CECE CC[C@@H](Oc1ccccc1Cl)C(=O)OCC(=O)C(C)=O 808545316 WLCLZPDOGZNAIK-GFCCVEGCSA-N 298.722 2.199 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CCCC(F)F)ccc21 2166575112 DDEGFSPDKAMQOU-ZDUSSCGKSA-N 283.322 2.381 10 10 CECE CCN[C@H](c1ccc2c(c1)CCCN2C)[C@H]1C=CCN1 2164252949 UETMEWOEXUILJC-NVXWUHKLSA-N 271.408 2.248 10 10 CECE CO[C@@H]1CC(N(C)c2ccc(CO)c(C)c2)C[C@H]1OC 2166100760 ATRNHZHEWBUSNP-HZPDHXFCSA-N 279.380 2.116 10 10 CECE O=C(O)C=Cc1ccc(N2CC=C(F)C2)c([N+](=O)[O-])c1 2164645408 WMJJKVIESQMRAU-UHFFFAOYSA-N 278.239 2.366 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](O)CC[C@H]2C)cc1O 713711129 NPOSCAHLRXLXMD-MDZLAQPJSA-N 264.369 2.022 10 10 CECE C[C@H](OC[C@H](O)COc1ccc(N)cc1)C1CCC1 719738923 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277.364 2.448 10 10 CECE Cc1ncsc1[C@H](NN)c1ccc(N(C)C)cc1 698552958 RNJKRUAWKVJTRH-GFCCVEGCSA-N 262.382 2.070 10 10 CECE CC(C)(C)OC(=O)NCC1CN(CCCN=[N+]=[N-])C1 1953752290 RUMYVJYEOBKHEO-UHFFFAOYSA-N 269.349 2.143 10 10 CECE C[C@H](N[C@H]1CCCN(C)C1)c1cc([N+](=O)[O-])ccc1O 756447435 WRCDYHGLHNHMPZ-QWRGUYRKSA-N 279.340 2.045 10 10 CECE c1cc(N2CC[C@H]3COC[C@H]32)ccc1CNC1CC1 1899148279 MBABLPBBHLEZDW-XJKSGUPXSA-N 258.365 2.164 10 10 CECE O=C(NCC[C@H]1CC1(F)F)NCc1ccccc1O 856853144 NMOCAXRJKAVXLG-JTQLQIEISA-N 270.279 2.237 10 10 CECE COc1cc(Cl)cc(CN[C@H]2CC[C@@H](C)NC2)c1O 863485236 WZAIUOALSRAKTD-SKDRFNHKSA-N 284.787 2.284 10 10 CECE CCCOCOc1ccc(N(C)C)c(C(=O)OC)c1 865395349 PDVLMHRTBHQZQA-UHFFFAOYSA-N 267.325 2.302 10 10 CECE CCOc1ccc(O)c(CN[C@@H]2CC=C(C(=O)OC)C2)c1 862464688 GEUWQAZYSHCHET-CYBMUJFWSA-N 291.347 2.142 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cnn3c2C[C@H](C)CC3)c1 862754334 ALBYPZLPLBZRHU-GFCCVEGCSA-N 299.374 2.409 10 10 CECE C[C@@H](CN[C@H](C)c1ccc(N(C)C)cc1)CS(C)(=O)=O 775826776 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2256940233 MRWFAHKNJUAAOT-UHFFFAOYSA-N 296.364 2.153 10 10 CECE CC[C@H]1CCNC[C@@H]1NCc1cnc(SC)s1 2248705271 NPCDUKIOTWLLPD-ONGXEEELSA-N 271.455 2.343 10 10 CECE CCc1cnnc([C@H](N)c2ccc(N(C)C)cc2)c1 2272942650 OHRDJZUGBIFTNY-OAHLLOKOSA-N 256.353 2.153 10 10 CECE Cc1cc(CO)ccc1N1CCC2(CC1)CN(C)C2 2265184155 DUUDJIUQRAQPGJ-UHFFFAOYSA-N 260.381 2.019 10 10 CECE CCP1(=O)CCC(NCCCN=[N+]=[N-])(C(=O)O)CC1 2268308424 MSOZFVSJSUKOHA-UHFFFAOYSA-N 288.288 2.277 10 10 CECE COc1ccc(N(C)[C@@H]2CCO[C@]3(CCOC3)C2)cc1 2279053664 IWYJFAMZYMLFAW-GDBMZVCRSA-N 277.364 2.470 10 10 CECE CCOC1CC(NC(=O)N2CCC[C@H](N=[N+]=[N-])CC2)C1 2280142976 FWHIKKYFDWUTBZ-UNXYVOJBSA-N 281.360 2.428 10 10 CECE C[C@@H](N)c1ccc(N2CC=C[C@@H]2C(=O)N(C)C)c(Cl)c1 2280247877 SCGITXSCAVJHFW-QMTHXVAHSA-N 293.798 2.193 10 10 CECE C[C@H](N)c1ccc(N2CC=C[C@H]2C(=O)N(C)C)cc1Cl 2280320134 SXWUKJJSDXONPN-HZMBPMFUSA-N 293.798 2.193 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@@]23CC[C@@](CF)(C2)OC3)C1 2290498799 DHXLJBZPGJNTLF-DRZSPHRISA-N 282.319 2.197 10 10 CECE O=C(N[C@@H]1CC(F)(F)C12CCC2)c1ccc(O)c(O)c1 2280899974 MODQYEDYYLICTL-LLVKDONJSA-N 283.274 2.406 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@@H]2C(N)=O)cc1C 2285144531 UCCSVFNIBKEELS-IUODEOHRSA-N 275.396 2.120 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2C=Cc1ccncc1 2296004772 IUEQHZIQIKVCKY-CQSZACIVSA-N 268.316 2.393 10 10 CECE CN1CC[C@](C)(COCCCOc2ccc(N)cc2)C1 2296398437 CMZHHFYIBMPFMH-INIZCTEOSA-N 278.396 2.396 10 10 CECE C[C@@]1(O)C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(F)cc1O 2296827465 PXCBKBOIPSTFKD-TZQJONAQSA-N 265.328 2.170 10 10 CECE CSc1ncc(CNC2(C(=O)O)CCCC2)s1 2305316831 PMFYBOMKDCCAAI-UHFFFAOYSA-N 272.395 2.352 10 10 CECE CC(C)[C@H](O)C(C)(C)NCc1cc(F)ccc1O 2318072244 PURINDXDSFRNII-ZDUSSCGKSA-N 255.333 2.416 10 10 CECE Cc1ccc(CNC[C@@]2(O)CCCSC2)c(O)c1 2320597081 QGVDKMCFTCREDU-AWEZNQCLSA-N 267.394 2.048 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@H](N)C1(C)C 2327382109 LQAVBXQHNMVRJN-NOZJJQNGSA-N 252.333 2.404 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H]3CC[C@H]2C[C@H]3N)c1O 2334458886 BJHAFWXZTHLXQM-VIRABCJISA-N 260.381 2.306 10 10 CECE O[C@H]1CCCc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)ccc21 2331548303 UULXHOOFRSJSQS-PHKINGBFSA-N 259.349 2.016 10 10 CECE Oc1cccc(F)c1CN[C@@H]1C[C@@H]2[C@@H]1[C@@H]1CC[C@H]2O1 2331829205 MKYCJRGWONYVMH-VVESTZELSA-N 263.312 2.187 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H]2C[C@H]3CO)ccc1[C@@H](C)N 2334468633 DSXXOFUHIDUGSJ-FIRUKDTASA-N 260.381 2.364 10 10 CECE CC1(C)CN[C@@H]1c1cncn1Cc1ccccc1O 2335614976 ZGYKJPKQTVCYNB-CQSZACIVSA-N 257.337 2.308 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCC2CC1(CO)C2 2336462477 DPFVZSUYZCSUNF-FUJMWEONSA-N 260.381 2.366 10 10 CECE Cc1cc(N2C[C@@]3(CO)CC[C@H]2C3)ccc1[C@@H](C)O 2336483892 KUIULYLGETXNOV-IVMMDQJWSA-N 261.365 2.400 10 10 CECE COC[C@@H](N[C@@H](C)c1ccc(O)cc1O)C(F)(F)F 2336565010 VPXALVYVXRGIPZ-WRWORJQWSA-N 279.258 2.326 10 10 CECE CO[C@@H](C)CCSC[C@H](O)COc1ccc(N)cc1 2336904611 NPFOMBOYDLPSPQ-WCQYABFASA-N 285.409 2.167 10 10 CECE COC[C@@H]1CCN(c2ccc(CN)c(C3CC3)c2)C1 2339143020 GFLOPTXOAKSKMB-GFCCVEGCSA-N 260.381 2.495 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CN)c(C2CC2)c1 2339154778 BCKSMCVYFWVBRP-BZNIZROVSA-N 260.381 2.372 10 10 CECE NCc1ccc(N2C[C@H]3COCC[C@@H]32)cc1C1CC1 2339160986 PVIYNNYJFRFMJY-BBRMVZONSA-N 258.365 2.248 10 10 CECE CN(c1ccc(CO)c(C2CC2)c1)[C@@H]1CCC[C@H]1O 2339167239 USQYZPMBQXWFFX-HZPDHXFCSA-N 261.365 2.406 10 10 CECE Oc1cc2c(cc1O)CN(CCc1ccns1)CC2 2341214666 NHIVAUXBSMDLEJ-UHFFFAOYSA-N 276.361 2.155 10 10 CECE C[C@H]1CC2CC(C(=O)N3CC[C@H](CN=[N+]=[N-])C3)(C2)O1 2342229996 MVYGPCSDYTTWMN-KIENENRBSA-N 264.329 2.103 10 10 CECE CC1(C)C[C@@H](COCc2ccc(N)cc2)OC(=O)N1 2343110023 IDIUUBSTVPJVNK-LBPRGKRZSA-N 264.325 2.063 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2cnc(C(F)(F)F)o2)C1 2343726985 HSSWBKTYHAIDFP-RXMQYKEDSA-N 275.190 2.218 10 10 CECE CSc1cc(N2C[C@@H](C)[C@@H](N(C)C)C2)ccc1CN 2353855528 MIDOFJXEOIIHQB-RISCZKNCSA-N 279.453 2.254 10 10 CECE OCc1c(Sc2nccs2)nc2ccccn12 104297425 OHZXROSIJNCIDZ-UHFFFAOYSA-N 263.347 2.434 10 10 CECE Cn1ncc([C@H](CO)N=[N+]=[N-])c1NC(=O)OC(C)(C)C 1951601716 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HLMAOZYEMWCPFU-GFCCVEGCSA-N 299.212 2.339 10 10 CECE C[C@H](N)c1ccc(N2CCOCC2)cc1Br 235511157 XWOSDKJMMMMGCA-VIFPVBQESA-N 285.185 2.305 10 10 CECE C[C@H](NCCCC(=O)NC1CC1)c1ccc(N(C)C)cc1 92987123 FSMQIYRIYVOOOP-ZDUSSCGKSA-N 289.423 2.462 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCS[C@H]1C 233707572 RZXFRJOAVWDVIE-GXSJLCMTSA-N 272.374 2.104 10 10 CECE O[C@@H]1CCCCC[C@H]1Oc1ccc(N2CCNCC2)cc1 148437117 QIHLALFQKLZYAY-IAGOWNOFSA-N 290.407 2.169 10 10 CECE Nc1oncc1-c1c(F)cc(O)c(O)c1Br 258433967 FCRRYWHMRCCKDB-UHFFFAOYSA-N 289.060 2.237 10 10 CECE CC[C@H]1CN(Cc2cccc(C)c2O)C[C@@]2(CCOC2)O1 370210472 QEFFUGOZUBLGDK-DOTOQJQBSA-N 291.391 2.471 10 10 CECE Cc1cc(Cl)cc(CN[C@@H](C)C(=O)N2CCCC2)c1O 281192408 IMSXFUHVWXIDMW-NSHDSACASA-N 296.798 2.455 10 10 CECE Cc1cc(CNC(C)(C)C)ccc1N(C)CCC(N)=O 381985776 FQNVAORKDQITKL-UHFFFAOYSA-N 277.412 2.195 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C1CC2(CCC2)C1 2164912169 KEQBQHPYPLCVPN-UHFFFAOYSA-N 273.380 2.472 10 10 CECE Nc1ccc(CCN2CCC[C@@H]3CC[C@H](O)C[C@@H]32)cc1 2167013863 YFLBKXVRWPYSLG-PVAVHDDUSA-N 274.408 2.437 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1C[C@]2(N)c1ccc2c(c1)CCN2C 2163070311 HLOCCLWEZRIOIY-YVVXQTMVSA-N 272.392 2.278 10 10 CECE C[C@H]1C[C@@H](C)NC[C@@H]1[C@H](O)c1ccc2c(c1)CCN2C 2163070292 HHYHGCYPPQOXAL-IUPKNAOTSA-N 274.408 2.346 10 10 CECE O[C@@H](c1ccc(N2CCCCC2)cc1)[C@H]1[C@H]2CNC[C@H]21 2163102014 HBTKGDSFZILQGE-YVSFHVDLSA-N 272.392 2.176 10 10 CECE CN1CCCc2cc(N3CC[C@H](N)C(F)(F)C3)ccc21 2163114108 SDSXJRLIJISFGS-AWEZNQCLSA-N 281.350 2.242 10 10 CECE CN(Cc1ccc(Cl)cc1O)C[C@@H]1C[C@@H]2OCC[C@H]2O1 2163204904 UCYPIGRYJHUBHZ-CFVMTHIKSA-N 297.782 2.424 10 10 CECE Nc1ccc(CS(=O)(=O)N2CCC23CCCC3)cc1 707228549 MSNJJYJTXRHENK-UHFFFAOYSA-N 280.393 2.117 10 10 CECE C[C@@H](CCNC(=O)[C@@H]1CNc2ccccc2N1)C(F)F 2166590217 WUKXCVBCTHJRNB-CABZTGNLSA-N 283.322 2.300 10 10 CECE COc1cc(N)c(N(C)[C@@H]2[C@H]3C[C@@H]3[C@H]3C[C@H]32)cc1OC 2166607404 SEEJFJJIMWHRBX-SZJUNAICSA-N 274.364 2.377 10 10 CECE C[C@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)C[C@@H](C)O1 724651736 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Cc1ccc([C@@H](C)NCCCc2ncn(C)n2)c(O)c1C 842905317 XSEXHGGFRHEGAG-CYBMUJFWSA-N 288.395 2.421 10 10 CECE CN(C)c1ccc(/C=C\CN[C@@H](CO)CCF)cc1 846095537 AZCJWYMMSXNCJD-VQTKUKTRSA-N 266.360 2.076 10 10 CECE COc1cccc(O)c1CN1CCO[C@]2(CCSC2)C1 843417541 HOZCWMXPRBGNFJ-OAHLLOKOSA-N 295.404 2.109 10 10 CECE C[C@H]1COC[C@H](C)C1NCc1ccc2c(c1)CCO2 924900071 IZTIYQQDKWLTEB-RYUDHWBXSA-N 261.365 2.382 10 10 CECE COC(=O)c1cc(OCC[C@H]2CCOC2)ccc1N(C)C 1261890133 VLSPROJGJDKJLS-GFCCVEGCSA-N 293.363 2.345 10 10 CECE CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2C)[C@H]1OC 1334955393 COIVNRAXSAGNMQ-BRWVUGGUSA-N 292.423 2.343 10 10 CECE CC[C@@H](CSC)NC(=O)CCOc1ccc(N)cc1 131865869 LLOMOYKLWJEWEK-LBPRGKRZSA-N 282.409 2.296 10 10 CECE Cc1ccc(O)c(CNC(=O)[C@@H](C)C2CCOCC2)c1 862758241 UDMAMTGDANDPCY-LBPRGKRZSA-N 277.364 2.380 10 10 CECE CCCNC[C@H]1CCN(c2ccc3c(c2)OCO3)C1 53013010 XJTJWRHYQCZGIA-GFCCVEGCSA-N 262.353 2.241 10 10 CECE Nc1ccc(CC(=O)NC2([C@@H]3CCCCO3)CC2)cc1 1358362087 CSDGKYJRBMQGOR-AWEZNQCLSA-N 274.364 2.029 10 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CC(C)(CNCc1ccc(F)cc1O)N1CCCC1 2139882848 WIXAFPHRZKLMPK-UHFFFAOYSA-N 266.360 2.495 10 10 CECE CN(Cc1ccc(F)cc1O)C[C@@]1(C)CCCN1C 2139803559 HLTDPTOMXCNUFV-OAHLLOKOSA-N 266.360 2.447 10 10 CECE COC(=O)c1ccc(=Nc2cc(Cl)c(C)cc2O)[nH]n1 1859510097 URSLGPPBYXPLOE-UHFFFAOYSA-N 293.710 2.096 10 10 CECE CCOC(=O)c1ccc(=Nc2cc(C)c(C)cc2O)[nH]n1 1859510465 LBCFVDYGNOOJFP-UHFFFAOYSA-N 287.319 2.141 10 10 CECE CN1CCc2c(oc(N)c2-c2nc3ccccc3n2C)C1 106519643 VHXPNRWXPWGYEO-UHFFFAOYSA-N 282.347 2.403 10 10 CECE CNCc1ccc(N(C)C2(CCO)CCC2)c(F)c1 2140964538 HZCYATCNXIVGJV-UHFFFAOYSA-N 266.360 2.286 10 10 CECE C[C@@H](Cc1ccccc1)NC(=O)c1cccc(O)c1O 126400072 SPWZIVOIYDRAJB-NSHDSACASA-N 271.316 2.459 10 10 CECE CC[C@H](NCCCCC(N)=O)c1ccccc1O 234041373 LQOFIQGEYAWZPB-LBPRGKRZSA-N 250.342 2.089 10 10 CECE CC[C@H]1OCC[C@@H]1CNCc1cc2c(cc1O)OCO2 234189765 QUGNJNFVEMLYQT-ZWNOBZJWSA-N 279.336 2.026 10 10 CECE COc1ccc(NCCOc2ccc(N)cc2)nc1 234979776 IXCMBGGSGBWEJO-UHFFFAOYSA-N 259.309 2.163 10 10 CECE 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C[C@H](N)c1ccc(N2CCN(C)CC2)c(Cl)c1 58826255 BSCPDVJVKYETSE-JTQLQIEISA-N 253.777 2.112 10 10 CECE CC1(C)CC[C@@H](NS(=O)(=O)Cc2ccc(N)cc2)C1 130597663 UXPXTVUWNQDYNN-CYBMUJFWSA-N 282.409 2.267 10 10 CECE COc1ccc(CN[C@@H]2C[C@@H]3[C@H]4CC[C@H](O4)[C@H]32)c(O)c1 2356930967 KGQGDXLTMVQNIF-LKAFINOVSA-N 275.348 2.056 10 10 CECE COCCN(C(C)C)[C@H](CN)c1ccc2c(c1)CCN2C 122709958 KUONNYHGCSMUKD-QGZVFWFLSA-N 291.439 2.036 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2C[C@@H]3[C@H]4CC[C@H](C4)[C@H]23)cc1 2357251280 TZXYXKLGERTTEJ-KDIDBREGSA-N 270.376 2.362 10 10 CECE C[C@H]1CN(c2c(F)cc(CN)cc2F)C[C@@H](C)O1 62709098 YSPONTRENDUKFL-DTORHVGOSA-N 256.296 2.037 10 10 CECE CC(C)(O)[C@@H](N)c1cc(Br)cc(F)c1O 1951519046 VDIMMBLWZVYLLJ-VIFPVBQESA-N 278.121 2.065 10 10 CECE CCN(CC)C(=O)CCN[C@H](C)c1ccc(OC)cc1O 37752642 WDRVMSDPADTYRL-GFCCVEGCSA-N 294.395 2.310 10 10 CECE C[C@@H](NC[C@@H](O)CN1CCCCC1)c1ccc(F)cc1O 185114958 MRLUALLZLQWTKW-TZMCWYRMSA-N 296.386 2.029 10 10 CECE C[C@H](O)c1cc(Br)c(F)c(O)c1O 218037791 LFFVHJKNDYDVSS-VKHMYHEASA-N 251.051 2.053 10 10 CECE NCc1ccc(N2CCC3(CCOCC3)C2)c(F)c1F 312878501 PKDCHRVNKSJERR-UHFFFAOYSA-N 282.334 2.430 10 10 CECE CNCc1cc(F)c(N2CCCO[C@@H](C)C2)c(F)c1 62719257 KTLYZMBTPUMPIY-JTQLQIEISA-N 270.323 2.299 10 10 CECE Cn1ccnc1CNCc1cccc(Br)c1O 71140807 DNJXDVIARNBKQD-UHFFFAOYSA-N 296.168 2.178 10 10 CECE CC[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 131415631 RBXFYZKVMTVFJN-SECBINFHSA-N 291.307 2.162 10 10 CECE Nc1ccc(CCCN2CCC[C@H](CCO)C2)cc1 227401725 JNWRHXQXSWKTKY-OAHLLOKOSA-N 262.397 2.296 10 10 CECE Nc1ccc(CCC(=O)N(CCO)C2CCCCC2)cc1 42271360 SQRHUNLPHDHWEJ-UHFFFAOYSA-N 290.407 2.355 10 10 CECE CC(C)OCCOC(=O)c1ccn(-c2ccc(N)cc2)n1 41087567 FHEXBZAEJIIBKU-UHFFFAOYSA-N 289.335 2.036 10 10 CECE CN(C)Cc1cc(CC2CC(C(=O)O)C2)ccc1O 1952122222 VXZFXZYFQVUQPG-UHFFFAOYSA-N 263.337 2.107 10 10 CECE CN[C@H](C)c1ccc(N(CCO)C(C)C)c(F)c1 42479759 PQIKIELIRJQOIX-LLVKDONJSA-N 254.349 2.313 10 10 CECE COc1ccc(N2CCCN(Cc3cocn3)CC2)cc1 191936237 ZLUFBOZNDWTSEE-UHFFFAOYSA-N 287.363 2.396 10 10 CECE Oc1c(Cl)cc(Br)cc1[C@@H]1COCCN1 95719067 ZJEKTILODPCYNU-VIFPVBQESA-N 292.560 2.469 10 10 CECE CCCN1CCC(CNC(=O)Cc2ccc(N)cc2)CC1 236770466 GBXDRLFTDQJEFO-UHFFFAOYSA-N 289.423 2.050 10 10 CECE COCCCC(=O)N(C)[C@@H](C)c1ccccc1O 95036214 MCLHUTQZVKAOPR-NSHDSACASA-N 251.326 2.338 10 10 CECE CC[C@](C)(O)CN1CCOc2cc(N(C)C)ccc21 162137721 KLYKKJRVFOZMLC-HNNXBMFYSA-N 264.369 2.112 10 10 CECE C[C@@H](N)c1cc(Br)c(F)c(F)c1O 95717664 UDMBIRXVNDKVJL-GSVOUGTGSA-N 252.058 2.453 10 10 CECE C[C@H](NCc1nnc2ccccn12)c1cc(F)ccc1O 94616967 PJCMYYQZDCANSV-JTQLQIEISA-N 286.310 2.425 10 10 CECE CCNCc1cc(F)c(N2CCN3CCC[C@@H]3C2)c(F)c1 94462778 JFBPWMJXMKVFPK-CYBMUJFWSA-N 295.377 2.359 10 10 CECE CC(C)(C)OC(=O)N1CCc2cccc(O)c2[C@H]1C(=O)O 259692802 JMTYMHSXZGFZFJ-LBPRGKRZSA-N 293.319 2.311 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CC[C@H]1C1CC(F)(F)C1 2165952618 BAEGAZJPDJTVRW-JTQLQIEISA-N 283.274 2.358 10 10 CECE CCN1CCc2cc([C@@H](NC)c3cn(C)cn3)ccc21 2163069366 PMFIHOCNDONYJP-MRXNPFEDSA-N 270.380 2.111 10 10 CECE CCOC[C@@H](N)[C@H](O)c1ccc(N2CCCCC2)cc1 2163095738 UBQMSEYSYUTORX-HZPDHXFCSA-N 278.396 2.074 10 10 CECE CCc1nc([C@H](NN)c2ccc(N(C)C)cc2)c(C)o1 2163094534 MHZLQRRHWARIDN-OAHLLOKOSA-N 274.368 2.164 10 10 CECE Cc1nnccc1[C@H](N)c1ccc2c(c1)CCCN2C 2163095224 RLSQBBFEZDFKQN-MRXNPFEDSA-N 268.364 2.216 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@@H]3COCC[C@@H]3C2)c(O)c1 723647774 RBXDLSJOCRDBIJ-MRVWCRGKSA-N 277.364 2.393 10 10 CECE O=C1NCCC[C@@]12CCN(Cc1cc(Cl)ccc1O)C2 2163265444 QLKIZHCUWGJKCQ-HNNXBMFYSA-N 294.782 2.148 10 10 CECE CC(=O)C(=O)COC(=O)c1[nH]c2ccccc2c1Cl 808503564 QPDPFDJUXXGEGV-UHFFFAOYSA-N 279.679 2.136 10 10 CECE Nc1ccc(CCN=c2ncc(C(F)(F)F)c[nH]2)cc1 2163294405 CAHPLTGSVPDPOC-UHFFFAOYSA-N 282.269 2.154 10 10 CECE CCC[C@@H]1CCOCC[C@]1(NCCN=[N+]=[N-])C(=O)OC 2165350747 RBWAJCFAOCOHMQ-DGCLKSJQSA-N 284.360 2.025 10 10 CECE CN(CCCN=[N+]=[N-])C1C[C@@H]2CCC[C@H](C1)S2(=O)=O 2129847300 XKLTXZGHNRQZOO-YOGCLGLASA-N 286.401 2.117 10 10 CECE Oc1cccc2c1[C@H](NCC13CCN(CC1)C3)CC2 716152577 YPCKKBBEJAZSBF-CYBMUJFWSA-N 258.365 2.065 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N(C)C3(C)CCCC3)cc21 720353829 DUIQSNZYJIUKQV-CQSZACIVSA-N 274.364 2.465 10 10 CECE CCCN[C@@H](C)c1ccc(N(CCC)CC(N)=O)cc1 723167285 KVGQMLZNMKRBNE-ZDUSSCGKSA-N 277.412 2.449 10 10 CECE Oc1cccc(CN[C@@H]2CC[C@@H]3COCC[C@@H]3C2)c1O 723648585 VWNPVBAAWZZDDV-MRVWCRGKSA-N 277.364 2.393 10 10 CECE C/C=C\[C@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 900404862 OSKOVCVIDNZBPB-SKKUGFDVSA-N 288.391 2.230 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@H]3C[C@@H](N)C[C@H]2C3)c1O 903850416 QDFXOWIARSDNJL-ZLKJLUDKSA-N 292.354 2.046 10 10 CECE CCOc1ccc(CNCC[C@@H]2CNC[C@H]2C)c(O)c1 903974450 NCLHLSQMVSYOGN-CHWSQXEVSA-N 278.396 2.126 10 10 CECE CN(C)c1ccc(/C=C\CNCCCn2cncn2)cc1 835038897 UWTFKSHPLFWYMA-HYXAFXHYSA-N 285.395 2.037 10 10 CECE CCN(c1ccc(/C=C\C(=O)O)cc1)[C@@H]1CCN(C)C1 693438435 BPTPGCCHURUOJD-WUKHSURWSA-N 274.364 2.315 10 10 CECE Nc1ccc(CC(=O)Nc2ccnn2C2CCC2)cc1 1342961923 ZHINAHUJZTZENJ-UHFFFAOYSA-N 270.336 2.372 10 10 CECE C[C@@H]1C[C@H]1c1noc(C(=O)N2Cc3cccc(O)c3C2)n1 866100145 JTYAFTFVYZRGKJ-PSASIEDQSA-N 285.303 2.055 10 10 CECE O=C(NCc1ccccc1O)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 869045676 GZIHQKSQLWWUGK-VQJWOFKYSA-N 286.375 2.484 10 10 CECE CCO[C@@H](C(=O)N(C)Cc1ccccc1O)C(C)C 860048495 WQVGXBKVUUTYFK-CQSZACIVSA-N 265.353 2.412 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@@H]1CCCC[C@@H]1O 131908212 VWPMXEVSHUXUMJ-OLZOCXBDSA-N 263.341 2.036 10 10 CECE CCO[C@@H](C(=O)NCc1ccc(OC)cc1O)C(C)C 861489882 KZPGKSFEGSQKON-CQSZACIVSA-N 281.352 2.078 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1CCN1c1ccc(N)cc1 1954672376 XAVBPKNGOGTVGS-CYBMUJFWSA-N 277.368 2.372 10 10 CECE CSC[C@H](C)C(=O)N1Cc2cccc(O)c2C1 871203344 YCEODDRRCAZITI-VIFPVBQESA-N 251.351 2.234 10 10 CECE Nc1ccc(CNC(=O)CCOCc2ccccc2)cc1 1955496739 GBLVAIXIYMERQQ-UHFFFAOYSA-N 284.359 2.492 10 10 CECE CN(C)c1ncccc1C(=O)N1Cc2cccc(O)c2C1 871198008 DATUYAIVPQHEDP-UHFFFAOYSA-N 283.331 2.009 10 10 CECE Nc1ccc(CSCC(=O)NCc2ccco2)cc1 58236356 GVNMTLLCPDBPJX-UHFFFAOYSA-N 276.361 2.411 10 10 CECE Cc1ccc2c(c1)CCN2C(=O)/C=C\c1cnccn1 773743251 UJQIAXKPHGJYCC-HYXAFXHYSA-N 265.316 2.388 10 10 CECE C[C@H](C[C@@](C)(NC1CC1)C(N)=O)Sc1nccs1 84351677 DIWJZMRNZRFGTM-PRHODGIISA-N 285.438 2.010 10 10 CECE O=C(O)C1CN(Cc2cc(Cl)cc(Cl)c2O)C1 86811074 IKARMIMEOHIDIY-UHFFFAOYSA-N 276.119 2.215 10 10 CECE Nc1ccc(-n2c(CO)nc3cc(F)ccc32)cc1 76079155 IVHMEDMQSQGOMD-UHFFFAOYSA-N 257.268 2.239 10 10 CECE NC(=O)N=Nc1ccc(C(=O)Nc2cnoc2)cc1 1136569022 ALHCNZSQTOFZDW-UHFFFAOYSA-N 259.225 2.089 10 10 CECE CC[C@H]1CCCC[C@@]1(NCCN=[N+]=[N-])C(=O)OC 90257023 CDMJWWOQWUEOMI-JQWIXIFHSA-N 254.334 2.398 10 10 CECE Oc1cc2c(cc1O)[C@@H]([C@H]1C[C@@H]3C=C[C@H]1C3)NCC2 83724214 MJQMTVGHHVDTAU-XPQXIITISA-N 257.333 2.497 10 10 CECE CNCc1ccc(OC)c(C[S@](=O)CC(C)C)c1 84034129 TZTVCRATLUUTCK-SFHVURJKSA-N 269.410 2.319 10 10 CECE Oc1cc(Br)ccc1CNCc1ncc[nH]1 701044203 OXQWOEMKEHIKAN-UHFFFAOYSA-N 282.141 2.168 10 10 CECE CO[C@@H](CNCc1ccc(F)c(F)c1O)C1CC1 703341316 NTKSVFMKXSAWBS-NSHDSACASA-N 257.280 2.185 10 10 CECE Oc1ccc(F)cc1CNCC12CCCN(CCC1)C2 705799533 DGMJMORRNCWKDD-UHFFFAOYSA-N 278.371 2.497 10 10 CECE CC1(C)CCN1CCCC(=O)Nc1ccc(N)cc1 706732765 MGIZIIKOAPVPAJ-UHFFFAOYSA-N 261.369 2.472 10 10 CECE C[C@H]1CCN(Cc2c(O)cccc2Br)C[C@H]1N 706861327 JFUIFWKZONXGBE-JOYOIKCWSA-N 299.212 2.324 10 10 CECE CC[C@]1(C)COCCN1c1c(F)cc(CO)cc1F 708289046 IMEISAWVFWNOEO-CQSZACIVSA-N 271.307 2.462 10 10 CECE Oc1cccc2c1[C@@H](N[C@H]1CCCC13OCCO3)CC2 715637639 YOSXPSAXKFOQRA-JSGCOSHPSA-N 275.348 2.265 10 10 CECE COc1ccc(O)c(CNCCCOC2CCC2)c1 717344582 KHJSXKSSFGGOON-UHFFFAOYSA-N 265.353 2.450 10 10 CECE Oc1c(Cl)cccc1CN1C[C@@H]2COC[C@H]2C1 718263464 CCGMOHIUEKBDJC-GHMZBOCLSA-N 253.729 2.124 10 10 CECE CCOC(=O)[C@](C)(C[C@H]1CCCO1)NCCCN=[N+]=[N-] 689833701 XAVDYJVQKQJYOV-YPMHNXCESA-N 284.360 2.167 10 10 CECE CC(C)N(CC(C)(C)O)c1ccc([C@@H](C)N)c(O)c1 690020796 FPVPPTNIPBHZDS-LLVKDONJSA-N 266.385 2.398 10 10 CECE COc1ccc(CNC[C@H]2CCOC2(C)C)c(O)c1 693078655 LOPBPNONXXYOMC-GFCCVEGCSA-N 265.353 2.306 10 10 CECE Clc1cc(N2CC3(COC3)C2)ccc1CNC1CC1 697110259 HAXQAYIARULZNQ-UHFFFAOYSA-N 278.783 2.429 10 10 CECE CN(C)c1ccc([C@@H](Cc2ccccc2)NN)cc1 97685516 VUMPTICVOWALNX-MRXNPFEDSA-N 255.365 2.500 10 10 CECE C[C@](O)(C(=O)NCc1ccccc1O)c1ccc(F)cc1 1150537216 YCSKVIJYTULHGX-MRXNPFEDSA-N 289.306 2.055 10 10 CECE C[C@H](N)c1ccc(N2CCC3(CC2)COC3)cc1O 2121070549 ONWBBQKDOUCGQQ-NSHDSACASA-N 262.353 2.029 10 10 CECE CCN(CC)c1ccc(CNCCc2ncno2)cc1 227954475 AUQYTGGDZLTRKX-UHFFFAOYSA-N 274.368 2.248 10 10 CECE CN(c1ccc(CO)cc1F)[C@H](CCO)C(F)(F)F 2121996841 UEIRDVGGZNHBFR-LLVKDONJSA-N 281.249 2.068 10 10 CECE CCNCc1ccc(N2CC[S@](=O)C[C@H]2C)c(C)c1 2115327109 YBNVPYDPVRTELC-YJYMSZOUSA-N 280.437 2.062 10 10 CECE CN(CCc1ccc(N)cc1)[C@@H]1CCCCC[C@H]1O 2115914788 NRXLXCPCZKFSDP-HZPDHXFCSA-N 262.397 2.437 10 10 CECE CCCC[C@@H](O)CCC(=O)NCc1c(O)cccc1F 1178413007 KHFGVHIYQLBBTA-LLVKDONJSA-N 283.343 2.479 10 10 CECE FC(F)[C@H]1CNCCN1Cc1ccc(N2CCCC2)cc1 1328412183 FWZONTXDAAKWSJ-OAHLLOKOSA-N 295.377 2.326 10 10 CECE 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CN1C(=O)[C@H](O)c2ccc(N3CC(C)(C)C3(C)C)cc21 690278254 WYWGBZKQUXNBOT-CYBMUJFWSA-N 274.364 2.321 10 10 CECE COc1ccc([C@@H](C)NCc2ncc(C)[nH]2)c(O)c1 693479840 UUJVZWAXHWSWBQ-SNVBAGLBSA-N 261.325 2.283 10 10 CECE Nc1ccc(NC(=O)CN2CCC[C@H]3CCC[C@@H]32)cc1 87767369 FIQIJNCTLWDCCQ-DOMZBBRYSA-N 273.380 2.472 10 10 CECE Nc1ccc(CCC(=O)Nc2ccc(F)cn2)cc1 88247978 RLXFHTKXMRTUSN-UHFFFAOYSA-N 259.284 2.374 10 10 CECE Oc1ccc(CNCCSCC(F)(F)F)c(O)c1 698887295 XLNWZKGFPSEPHK-UHFFFAOYSA-N 281.299 2.483 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1cccc2cccnc12 90256513 MFQLSBZXYIJPHL-LBPRGKRZSA-N 271.280 2.260 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H]2CNC[C@@H]2F)cc1 2120672145 LPGCVPKXZKXOTE-ILXRZTDVSA-N 266.360 2.124 10 10 CECE CN(C)[C@@]1(C)CCN(c2cc(Cl)c(CN)cc2F)C1 2120883883 GULLPDDVRIKICK-AWEZNQCLSA-N 285.794 2.468 10 10 CECE Cc1cccc(CN[C@H]2C[C@H]3C[C@H]2C[C@]3(C)O)c1O 2121705451 FBXZBOGSAPTGRW-FQLMCAECSA-N 261.365 2.340 10 10 CECE C[C@H](N(C)c1ccc2c(c1)NC(=O)[C@@H]2N)C(C)(F)F 2122319907 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[N-]=[N+]=NC[C@H]1CCN(C[C@H]2COC3(CCCC3)O2)C1 1912189161 SJZUCFICLPZWLB-NEPJUHHUSA-N 266.345 2.304 10 10 CECE Cc1cc(N2C[C@@H]3COC[C@H]3C2)ccc1C=CC(=O)O 1912136645 IDNHAIXCSUHDKL-ZIAGYGMSSA-N 273.332 2.175 10 10 CECE COC(=O)C[C@H](C)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912166762 BMSKWYFVOUCWAK-QWRGUYRKSA-N 254.334 2.350 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1ccc(C)c(O)c1 1912168563 DUVBJLCITVOXOW-GFCCVEGCSA-N 278.312 2.205 10 10 CECE CC1CCN(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)CC1 1912199898 ZDFAFJVZMARAOV-LLVKDONJSA-N 251.334 2.471 10 10 CECE CO[C@@H]1CCN(c2c(F)cc(C=CC(=O)O)cc2F)C1 1911798055 PJPLLIMMKYTUIF-SNVBAGLBSA-N 283.274 2.288 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@@H]2C)cc1Cl 1908491752 HCHWFNUZPIOOPW-MWODSPESSA-N 255.745 2.353 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])C1CC(F)(F)C1 1912209943 DKWLYPQRYIJYIJ-SNVBAGLBSA-N 276.287 2.253 10 10 CECE CN1CCc2cc([C@@H](O)C(=O)CCCF)ccc21 1913256462 UCQXMSPPHXAGMR-CQSZACIVSA-N 251.301 2.031 10 10 CECE COCCNCc1ccc(N2CC[C@H](O)[C@@H]2C)c(Cl)c1 1914255127 LVEKDHSEHOEMPU-NHYWBVRUSA-N 298.814 2.036 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](CO)C3(CCC3)C2)cc1O 1914523574 HCSPHSFHBORWAK-VXGBXAGGSA-N 277.364 2.044 10 10 CECE C[C@@H](O)c1ccc(N(C)C2CC(O)C2)cc1Cl 1914572523 BVOXLBARMZIVEG-MFAVDMRSSA-N 255.745 2.353 10 10 CECE Cc1nc(CCN[C@H](C)c2ccc(N(C)C)cc2)no1 225788325 AORMBAIDCKDKBB-LLVKDONJSA-N 274.368 2.337 10 10 CECE Cc1cnc([C@H](C)NCc2ccc(O)c(O)c2O)s1 226759936 AWTZMFMJVZHVNS-QMMMGPOBSA-N 280.349 2.419 10 10 CECE CN1CCC12CC(CNCc1cc(F)ccc1O)C2 1875868018 GJXWPXRAIHYHBG-UHFFFAOYSA-N 264.344 2.105 10 10 CECE CC[C@@]1(F)CCN([C@H](C)C(=O)Nc2ccc(N)cc2)C1 1925590036 WHAQIFYDSIVZJS-IAQYHMDHSA-N 279.359 2.420 10 10 CECE COc1cccc(CNC(=O)c2c[nH]c3nccc-3c2)c1O 1630366429 POWDEJRLSYFFRD-UHFFFAOYSA-N 297.314 2.159 10 10 CECE COc1ccc(O)c([C@H](C)N(C)[C@H](C)CC(=O)O)c1 1926934033 LDQYQVHCUHTNNG-ZJUUUORDSA-N 267.325 2.257 10 10 CECE CO[C@@]1(C)CCCN(C(=O)Cc2ccc(O)c(O)c2)CC1 1640122029 GBFOEJSXEPSAGP-INIZCTEOSA-N 293.363 2.058 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H]2C)c(F)c1 35776787 QJBCXHYJRVFXEK-WDEREUQCSA-N 252.333 2.331 10 10 CECE CCS[C@@H](C(=O)NCc1c(O)cccc1O)C(C)C 1645360880 NFIVBNSVSZIMFG-CYBMUJFWSA-N 283.393 2.492 10 10 CECE C[C@@H](NC[C@]12CO[C@](C)(C1)C2)c1cc(O)ccc1O 2137999970 ALAJRNQFGROQNI-KMUNFCNLSA-N 263.337 2.318 10 10 CECE COc1cc(N2CC[C@@H]2CF)ccc1CNC1CC1 2139682731 LMURZVINFHHQEZ-CQSZACIVSA-N 264.344 2.495 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)c1O 2139758773 DQENTLFXJWPYGP-RKQHYHRCSA-N 257.333 2.219 10 10 CECE Cc1cccc(O)c1CN[C@@H]1C[C@H]2CC[C@H]1[C@@H](O)C2 2139751321 AJGPPPKSHDNFNT-NCZKRNLISA-N 261.365 2.340 10 10 CECE COc1cc(N2CC[C@@H](OC)[C@@H](C)C2)ccc1CO 2139701770 XFNVPJLFZQLGNW-SMDDNHRTSA-N 265.353 2.049 10 10 CECE CC(=O)C(=O)[C@@H](O)c1sc(Br)cc1C 1935206089 FDHWLGCFXICJPV-MRVPVSSYSA-N 277.139 2.011 10 10 CECE Nc1ccc(OCC(=O)O[C@@H]2CCC[C@@H]3C[C@@H]32)cc1 2141902417 IQHMOPAVMSZOLD-DDTOSNHZSA-N 261.321 2.379 10 10 CECE OC[C@H](CC1CC1)NCc1c(O)cccc1Cl 1942813758 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CECE C[C@H](CCC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1885563174 QISOOSACBBLKRV-SECBINFHSA-N 297.359 2.201 10 10 CECE CN(Cc1ccccc1O)C[C@H]1CNCC12CCC2 1886916824 PNAMBNNADJDLAI-CQSZACIVSA-N 260.381 2.214 10 10 CECE C[C@@H]1C[C@@H](NC(=O)CCOc2ccc(N)cc2)CCS1 2143740211 YYKLXLJXAXXUQY-YPMHNXCESA-N 294.420 2.438 10 10 CECE C[C@H](NC(=O)c1cccs1)C(=O)Nc1ccc(N)cc1 237448542 QUSWFDWTQWWTQP-VIFPVBQESA-N 289.360 2.087 10 10 CECE OC[C@@]1(CNCc2ccc(F)cc2O)CC12CCC2 1964613462 FDQYJPMFZARPGJ-HNNXBMFYSA-N 265.328 2.174 10 10 CECE C=COCCCNCc1ccc(N2CCOCC2)cc1 20197715 HRXUASRURAHKPG-UHFFFAOYSA-N 276.380 2.163 10 10 CECE O=C(N[C@H]1CC[C@H]2CC[C@H]1C2)c1cccc(O)c1O 1965148624 FBSOZRXFEUMPID-SCVCMEIPSA-N 261.321 2.406 10 10 CECE O=C(c1cccc(O)c1O)N1CCS[C@@H]2CCC[C@H]21 1970217803 KLWFIDDOCWHSBF-ZYHUDNBSSA-N 279.361 2.208 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](O)[C@H](C)C2)cc1 166507066 PGWRGKUISFIRKM-CJNGLKHVSA-N 262.397 2.392 10 10 CECE COc1ccc(O)c(CN2CCCC[C@H](C(=O)O)C2)c1 1972882613 JGNNRPSKMWAESP-NSHDSACASA-N 279.336 2.088 10 10 CECE CO[C@]1(CNCc2c(O)cccc2Cl)CCCOC1 1974256339 XYLSUSLGIBVUNX-AWEZNQCLSA-N 285.771 2.331 10 10 CECE COCCOCCSc1ncc(C(C)=O)s1 1976526503 VXJLVPDSUHEQQZ-UHFFFAOYSA-N 261.368 2.101 10 10 CECE CCN[C@H](C1=COCC1)[C@H](O)c1ccc(N(C)C)cc1 2148575524 WKQCPEQOVIXALL-HZPDHXFCSA-N 276.380 2.068 10 10 CECE Cc1ccc(CN(C)c2ccc([C@H](C)N)c(O)c2)nn1 2145799868 XFQJDERTAQNRGK-NSHDSACASA-N 272.352 2.147 10 10 CECE C[C@@H](N)c1ccc(N2CCCCC2(CO)CO)c(Cl)c1 2146072803 NLIFVVZCLSQTKE-LLVKDONJSA-N 298.814 2.073 10 10 CECE Cc1cccc2nc(N(C)Cc3ccc(N)cc3)nn12 2148897129 RQDVADSNAGQOHQ-UHFFFAOYSA-N 267.336 2.256 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](CO)C(F)(F)C2)c(F)c1 2146389073 UOCYLQNZOLZGTP-KOLCDFICSA-N 289.297 2.333 10 10 CECE Oc1ccc(CNCc2cc(C(F)(F)F)no2)c(O)c1 2150709940 YQDPHOGEBGWJJQ-UHFFFAOYSA-N 288.225 2.394 10 10 CECE COc1c(CN[C@H](C)c2ccccc2O)c(C)nn1C 162387564 VXSLDFUPNILYJV-SNVBAGLBSA-N 275.352 2.294 10 10 CECE C[C@@H](N)c1ccc(N2CCNC(=O)C(C)(C)C2)c(Cl)c1 2150402114 CCRLIYKCXVTZGG-SNVBAGLBSA-N 295.814 2.322 10 10 CECE CON(CC(=O)O)Cc1cc(Cl)cc(Cl)c1O 1996498784 GQUHCFZDVIPBOW-UHFFFAOYSA-N 280.107 2.147 10 10 CECE CC[C@H](NC)c1ccc(N2CC[C@@H]3[C@H](CO)[C@@H]3C2)cc1 2149519192 MQFNYWYIVZIHQC-YVSFHVDLSA-N 274.408 2.422 10 10 CECE CSCC1CN(c2c(F)cc(CN)cc2F)C1 1998205485 JOMABUFARCPXDO-UHFFFAOYSA-N 258.337 2.223 10 10 CECE CN(CCN=[N+]=[N-])C(=O)C1(CC(F)(F)F)CC1 2007730231 CNSXUHMDUZDFFC-UHFFFAOYSA-N 250.224 2.488 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCC(CN)CC2)c1 44511615 ZPJWUAILGQTYCM-LLVKDONJSA-N 264.369 2.133 10 10 CECE CN1CCc2cc(CN3CCNCC34CCC4)ccc21 2153345729 DUNGOEPILPANJM-UHFFFAOYSA-N 271.408 2.007 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CC[C@H]2CO)CC3)cc1O 2154156736 RILHGCMTOZMNRH-YPMHNXCESA-N 277.364 2.187 10 10 CECE Nc1ccc(OCC(=O)NC[C@H]2CCC3(CC3)C2)cc1 2156172228 SFDWOFORRQVCBT-LBPRGKRZSA-N 274.364 2.344 10 10 CECE CC[C@H](CNCc1cc(F)cc(F)c1O)COC 2027330971 FTWUQWLFDMWDCS-SECBINFHSA-N 259.296 2.433 10 10 CECE 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10 CECE CCNCc1ccc(N2CC[C@@H](CN(C)C)C2)c(C)c1 688499097 HKZNNEGIBCRXTA-INIZCTEOSA-N 275.440 2.492 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC[C@@H]2C(C)(C)O)c1 708289104 GMVWADNOXOVGGG-OAHLLOKOSA-N 277.364 2.330 10 10 CECE CN(CCC1CCC1)c1ccc2c(c1)NC(=O)[C@@H]2O 688687127 HCTNTVRSWDAHTN-CQSZACIVSA-N 260.337 2.299 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@@H]1CCCSC1 709722615 BRUXMEZRDAOQLC-GFCCVEGCSA-N 280.393 2.002 10 10 CECE CN(Cc1c(O)ccc(Cl)c1F)[C@@H]1CCOC1 792167655 NWFVTDSFSRAJBC-MRVPVSSYSA-N 259.708 2.405 10 10 CECE Cc1cc(N2CC[C@H](N3CCCC3)C2)ccc1CN 62981826 VCKSIHPDAAWPCW-INIZCTEOSA-N 259.397 2.128 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1CN(C)C(=O)Cc1ccc(N)cc1 686382587 QFMXKRURQLRREI-DYEKYZERSA-N 276.380 2.083 10 10 CECE CN(C)[C@@H]1CCC[C@@H](NCc2ccc(O)c(O)c2)C1 715524771 FLZWYXVEZPBSRN-CHWSQXEVSA-N 264.369 2.060 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)NN2CCC2)c1 686778988 HFRIUIDUNAJKEI-NSHDSACASA-N 277.368 2.402 10 10 CECE Nc1ccc(N2C(=O)CCCNC2=O)cc1C(F)(F)F 690587345 WGADMHNEBHRWIJ-UHFFFAOYSA-N 287.241 2.124 10 10 CECE COCCN(CCF)c1ccc(CO)c(Cl)c1 697306731 YUXJLFZORFTKTH-UHFFFAOYSA-N 261.724 2.255 10 10 CECE CC[C@H]1CN(Cc2cc(OC)ccc2O)C[C@@H](C)O1 245838644 JEUQCFWQYVHOTK-YPMHNXCESA-N 265.353 2.400 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2C[C@@]23CC3(F)F)cc1 2115387315 ZAIRJEMUCHCMIQ-QPUJVOFHSA-N 267.279 2.436 10 10 CECE CC[C@H](N)CN(CC)c1ccc(OC)cc1[N+](=O)[O-] 2116672796 WGMWAFUOQVUNAI-JTQLQIEISA-N 267.329 2.167 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@H]2CC23CCOCC3)CC1 2117727146 FWMXJHUYSUWGEZ-SNVBAGLBSA-N 264.329 2.010 10 10 CECE CCO[C@@H]1CC[C@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2118209404 DQFRZYVVZDLOLX-QJPTWQEYSA-N 266.345 2.493 10 10 CECE CCON(C1CNC1)[C@@H](C)c1ccc(N(C)C)cc1 2118324137 GXMTZOOAFLVSRW-LBPRGKRZSA-N 263.385 2.039 10 10 CECE CNCc1ccc(N2CCOC[C@@H]2C(F)F)c(C)c1 2119016141 CLXBLFAYHOUWIG-CYBMUJFWSA-N 270.323 2.185 10 10 CECE NCc1cc(F)c(N2CC[C@@H]3[C@H](CO)[C@H]3C2)cc1Cl 2120883961 HDGGAJYCPNZOKK-DCAQKATOSA-N 284.762 2.002 10 10 CECE NCc1cc(F)c(N2C[C@H](O)CC23CCC3)cc1Cl 2120885634 YDQTZXBUFPRYSW-SNVBAGLBSA-N 284.762 2.432 10 10 CECE CC1(C)CCCN(Cc2ccc(O)c(O)c2)[C@@H]1CN 2127922032 HPKANSUBXAVJDK-CQSZACIVSA-N 264.369 2.047 10 10 CECE CN[C@H]1CCCc2cc(N3CC[C@@H](CO)C3)ccc21 2128279616 REXFJEXBZGYXAP-WBMJQRKESA-N 260.381 2.102 10 10 CECE O[C@H]1CCc2cc(N3CC4(CCOCC4)C3)ccc21 2128321898 NLVCURDOYMAMMJ-HNNXBMFYSA-N 259.349 2.283 10 10 CECE CC(C)(O)[C@@H]1CCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128316985 LUAYVJQKQLRGLK-DOMZBBRYSA-N 261.365 2.263 10 10 CECE OC[C@@H]1[C@H]2CC[C@H](C2)N1c1ccc2c(c1)CC[C@H]2O 2128320755 FFFUGFIGXGXZEA-UAXWRAGISA-N 259.349 2.016 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@@H]4COC[C@@H]4C3)ccc21 2128310534 ISRHDFIKCRQBQT-DVOMOZLQSA-N 258.365 2.105 10 10 CECE CN(CC1CCOCC1)c1ccc2c(c1)CC[C@H]2N 2128310515 ILXRIMIQQCKMNH-MRXNPFEDSA-N 260.381 2.495 10 10 CECE OCC1CCN(c2ccc(CN=c3cc[nH]cc3)cc2)CC1 1330405412 QGGQZNBLYUKAOL-UHFFFAOYSA-N 297.402 2.324 10 10 CECE C[C@H](NC(=O)[C@@H]1Cc2cccnc2C1)c1ccccc1O 1348992332 ABCVYPGLAGGMON-WCQYABFASA-N 282.343 2.379 10 10 CECE CCN1CCN(c2ccc(C=CC(=O)O)cc2C)CC1 1911921431 NCIXMZFJOQEMSV-UHFFFAOYSA-N 274.364 2.235 10 10 CECE Cc1cc(N2CC[C@H](CO)C23CCC3)ccc1CN 2133813598 VAOXQTJIDSEIEJ-CQSZACIVSA-N 260.381 2.195 10 10 CECE CN1CCC[C@H](CCN2CC[C@H](CN=[N+]=[N-])C2)C1 1912186878 HEYQHFPSSOSIGJ-CHWSQXEVSA-N 251.378 2.351 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1ccc2c(c1)COCC2 1912168621 FJHWVVJJDMMZAP-UHFFFAOYSA-N 260.297 2.142 10 10 CECE Cc1cccc(C)c1S(=O)(=O)N1CC[C@@H](N=[N+]=[N-])C1 1912193529 OVPBLWADKPDKES-LLVKDONJSA-N 280.353 2.377 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CCCc2ncno2)C1 1912196632 WUOPNISHIDQYKI-LLVKDONJSA-N 264.333 2.415 10 10 CECE CCc1ccc(S(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)s1 1912171734 OVEPDRCIAYDIRI-QMMMGPOBSA-N 286.382 2.384 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H]2C[C@@H]2C1 1912180492 BNAYMMQFQAZLFN-FOGDFJRCSA-N 252.318 2.008 10 10 CECE COC(=O)[C@H](CN(C)CCN=[N+]=[N-])c1ccccc1 1912145146 CRDYUBKYSOMKOI-GFCCVEGCSA-N 262.313 2.185 10 10 CECE CC(C)(C)OC(=O)CN1CCC[C@@H](CN=[N+]=[N-])C1 1912187182 IJBSZLOVBIXLDY-JTQLQIEISA-N 254.334 2.350 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C[C@H](O)C(F)(F)F)C1 1912203723 RZDDRLHPMAFSNW-BDAKNGLRSA-N 266.267 2.322 10 10 CECE COCC(COC)CN(C)c1ccc(CN)c(Cl)c1 1910162529 RTKZPYVSMCNAKW-UHFFFAOYSA-N 286.803 2.144 10 10 CECE COCc1cccnc1C(=O)Cc1ccc(N)cc1 1910314879 PIMCTGMPGIBUDX-UHFFFAOYSA-N 256.305 2.236 10 10 CECE C[C@H](N(C)C[C@@H](O)COc1ccc(N)cc1)C(C)(C)C 218307899 NSSQVSNAZQBPSP-GXTWGEPZSA-N 280.412 2.375 10 10 CECE CO[C@@H]1CCN(C(=O)CCc2ccc(N)cc2)C1(C)C 1914258096 WNMDVCDMJMHAAH-CQSZACIVSA-N 276.380 2.227 10 10 CECE O=C(NCc1cccc(O)c1O)c1cccnc1C(F)F 1455316952 RNYCNHWACQTVPD-UHFFFAOYSA-N 294.257 2.360 10 10 CECE CC=C1CCN(c2cc3c(cc2Cl)[C@@H](N)C(=O)N3)C1 1915344082 ZQHVWXZTPYXYJG-CYBMUJFWSA-N 277.755 2.448 10 10 CECE C/C(=C\C(=O)N[C@H](C)c1ccccc1O)c1cnccn1 1454803824 GUQHLQCMYVPPLG-LMMOQWNQSA-N 283.331 2.463 10 10 CECE [N-]=[N+]=N[C@H](CO)c1c(O)cccc1Br 1536061042 VOJNLEVFVXMFKN-ZCFIWIBFSA-N 258.075 2.498 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@]3(CCC[C@H]3O)C2)cc1 1918993146 POGMKBMTNFIIRN-MAZHCROVSA-N 261.365 2.481 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@]3(CCC[C@@H]3O)C2)cc1O 1918965073 VNTUUHUCWCEAAB-UVBJJODRSA-N 276.380 2.153 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC=CC[C@H]1C(=O)O 2136363715 KIRDQKIRDOAGFJ-CABZTGNLSA-N 265.284 2.307 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C(N)=O)CC[C@@H]2C)cc1Cl 226856192 HIMZPYODJAWGNL-GARJFASQSA-N 295.814 2.450 10 10 CECE CC[C@@H](C)NCc1ccc(N2CCN(C)CC2)c(OC)c1 212673990 WLNTXJMCJYQMED-CQSZACIVSA-N 291.439 2.335 10 10 CECE Nc1ccc(NC(=O)c2cccc3nccnc23)cc1 228267976 BBALIQDABROGSB-UHFFFAOYSA-N 264.288 2.464 10 10 CECE COc1ccc(N(C)[C@@H](C)CCN)c(OC)c1C 260275314 XQUNCXVZZLOPJY-JTQLQIEISA-N 252.358 2.186 10 10 CECE CC[C@]1(F)CCN(CCOc2ccc(N)cc2)C1 1925576408 RPDCAPBWOBEZTP-AWEZNQCLSA-N 252.333 2.472 10 10 CECE Cc1c(F)cccc1C(=O)NCc1ccc(O)c(O)c1 1635959397 IICRBDORFUZBEE-UHFFFAOYSA-N 275.279 2.475 10 10 CECE CO[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)C(C)C 1566057605 GBOKLQBSDGIYHU-GFCCVEGCSA-N 292.339 2.250 10 10 CECE O=C(c1c(F)ccc(O)c1O)N1Cc2ccccc2C1 1641246422 DOKQPYKHQSGCDM-UHFFFAOYSA-N 273.263 2.393 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](NC(C)=O)C2)cc1 229789945 SCAUTEYWPVHGKV-IUODEOHRSA-N 275.396 2.072 10 10 CECE Cc1cnc(CNC(=O)c2cc(O)cs2)c(C)c1 1651566873 JYHFMOMBZFYWHY-UHFFFAOYSA-N 262.334 2.396 10 10 CECE COc1cc(N2C[C@@H](OC)CC[C@@H]2C)ccc1CN 2139696499 IKKKJDFGZMDRTE-FZMZJTMJSA-N 264.369 2.158 10 10 CECE COc1cc(C(=O)N(C)Cc2ccccc2O)ccc1N 164661139 VXNWPEXJFJAEJL-UHFFFAOYSA-N 286.331 2.255 10 10 CECE Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(N)cc2)n1 19260226 CWHCYKJOISFNNI-LLVKDONJSA-N 258.325 2.282 10 10 CECE CNC(=O)CN(C)c1ccc(CNCC(C)C)c(Cl)c1 234364320 IQJFLFMDHMLREJ-UHFFFAOYSA-N 297.830 2.268 10 10 CECE CC(C)(C)c1nc(C(=O)NCc2ccc(N)cc2)co1 1122535991 OAJUQSURWHYIIF-UHFFFAOYSA-N 273.336 2.484 10 10 CECE NCc1ccc(N2CCCCC[C@@H]2CO)c(F)c1F 236209132 HMDLQCPVDZHHBK-LLVKDONJSA-N 270.323 2.165 10 10 CECE Cc1c[nH]nc1CNCc1ccc(Cl)cc1O 1942490896 CGGRNMRAIVQMHL-UHFFFAOYSA-N 251.717 2.367 10 10 CECE C[C@H](O)[C@H](C)SCCCC(=O)Nc1ccc(N)cc1 235580969 FKFSTKFKUVZYSQ-QWRGUYRKSA-N 282.409 2.490 10 10 CECE C[C@H](NC[C@@H]1CCCN(C)C1)c1c(O)cccc1O 235529390 BMETWPDEIJJTPU-RYUDHWBXSA-N 264.369 2.090 10 10 CECE NCc1ccc(N2C[C@H]3CO[C@@H](C3)C2)cc1Cl 1946936100 DGRFLHBPSCCURV-CABZTGNLSA-N 252.745 2.024 10 10 CECE Nc1ccc(OCC(=O)OC[C@@H]2CC3CC2C3)cc1 1876919595 VSTDDYPULIKSFV-MCIGGMRASA-N 261.321 2.237 10 10 CECE C[C@H](Nc1ncccc1C(N)=O)c1ccccc1O 1877587565 OZGFBKGWMZOGTE-VIFPVBQESA-N 257.293 2.059 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3CNC(C)(C)C3)ccc21 1878966395 XACBCNKIMGOLJM-DZGCQCFKSA-N 259.397 2.067 10 10 CECE Cc1cccc(O)c1CNCCn1cc(Cl)cn1 1963064017 LNHFIGRLKLJDEY-UHFFFAOYSA-N 265.744 2.340 10 10 CECE CCN(c1c(F)cc([C@@H](C)O)cc1F)C1CN(C)C1 1880489847 ZXGRWUGWWTXMTE-SECBINFHSA-N 270.323 2.158 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(F)c2)[C@@H]1C1CC1 1882981786 MNJBAZINBPEOCL-LSDHHAIUSA-N 264.344 2.288 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC([C@H]2CCNC2)C1 1886865909 MRXCQARBTXHTMV-MNOVXSKESA-N 264.344 2.134 10 10 CECE Oc1c(CNC[C@@H]2C[C@H]3O[C@H]2[C@@H]2C[C@H]32)ccc(F)c1F 2144077706 NTMBJRCTVLHCOT-BCLHGEQCSA-N 281.302 2.183 10 10 CECE O[C@H]1CC[C@@H]1NCc1ccc(N2CCCCC2)cc1 1964067966 JUPKXDQJZSTVAQ-HOTGVXAUSA-N 260.381 2.290 10 10 CECE CCN1CC[C@H](CN[C@H](C)c2cc(OC)ccc2O)C1 249384346 XEGHISNCAZAXPC-CHWSQXEVSA-N 278.396 2.393 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CCC[C@H](OC)CC1 2148160894 KNCOYLKLURWHHO-APHBMKBZSA-N 279.380 2.363 10 10 CECE COCCOCCCN(C)c1ccc(OC)cc1 1964110063 OLQZQSNLXQOKDU-UHFFFAOYSA-N 253.342 2.185 10 10 CECE CO[C@@H](CNCc1cc(F)ccc1O)[C@H]1CCCOC1 1967749020 XFDIUJOKQJXDAN-NHYWBVRUSA-N 283.343 2.063 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCCC[C@H]1CC(=O)O 252661186 RVELTHLOZCYAJJ-MNOVXSKESA-N 279.336 2.488 10 10 CECE C[C@H]1C[C@H]1N(CCO)c1ccc(CN)c(Cl)c1 2002031129 IPRUAGFMXRPIAO-TVQRCGJNSA-N 254.761 2.006 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]([C@H](C)O)C2)c(F)c1 252761045 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CCOC(=O)CC(C)(C)c1c(F)ccc(O)c1O 260128681 BXKHKPVXTGXCMJ-UHFFFAOYSA-N 256.273 2.468 10 10 CECE CNCc1ccc(N2CCN(C(C)C)CC2)c(F)c1 36190600 ROFMKPMLNQDUIZ-UHFFFAOYSA-N 265.376 2.076 10 10 CECE Oc1ccc(CNCc2cccc3nccn23)cc1O 2151748746 GMBKYIZKKJPKRL-UHFFFAOYSA-N 269.304 2.035 10 10 CECE Cc1ccc(NC(=O)CCOc2ccc(N)cc2)cn1 164523314 OBBDGWJNNCQPIM-UHFFFAOYSA-N 271.320 2.380 10 10 CECE Cc1cccc(O)c1CN1CCC[C@]2(C[C@@H]2C(=O)O)C1 2160786019 KGVYZYCGNJXAPZ-CJNGLKHVSA-N 275.348 2.387 10 10 CECE Cn1cc(CN2CCC[C@@H]2CN=[N+]=[N-])c(Br)n1 2009445647 QKVDOQAHVNBGGU-SECBINFHSA-N 299.176 2.457 10 10 CECE C[C@@H](c1cscn1)N(C)CC(=O)Nc1ccc(N)cc1 2155708830 YFHAGPSCMYPEMY-JTQLQIEISA-N 290.392 2.357 10 10 CECE C[C@@H]1SCCC[C@@H]1NCc1ccc(O)c(O)c1 2020607010 HKCMZVWTRPSBJW-ONGXEEELSA-N 253.367 2.472 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](CO)C[C@@H]2C)c(F)c1 2038884730 LCTGAUBVQNPXSQ-GARJFASQSA-N 253.317 2.086 10 10 CECE O=S(=O)(Nc1ccc(O)cc1)C1[C@H]2CCCC[C@H]12 2033545137 CDQVEKLODVEVOQ-RYUDHWBXSA-N 267.350 2.323 10 10 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C[C@@H]1CCN(S(=O)(=O)Cc2ccc(N)cc2)CC1(C)C 2170981446 RVMFSAHNFVLSRY-GFCCVEGCSA-N 296.436 2.467 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C[C@@H]1CC2(CCOCC2)CO1 2179605355 ZIEYUYNTYCQKNX-STQMWFEESA-N 280.372 2.347 10 10 CECE CN1CCN(c2ccc3c(c2)CCC[C@@H]3O)CC12CC2 2188415431 IXGDKCYPWAQORR-INIZCTEOSA-N 272.392 2.341 10 10 CECE N[C@H]1CCCc2cc(N(CC(F)F)C3COC3)ccc21 2196629394 SWLISBIVXDLKSY-AWEZNQCLSA-N 282.334 2.493 10 10 CECE COc1cccc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)n1 2181787351 FHIXMBNKOWXMLP-SNVBAGLBSA-N 275.312 2.395 10 10 CECE OCc1ccc(N2C[C@H]3COCC[C@H]32)cc1C(F)(F)F 2193276750 WPACAZCPKYYALO-GXFFZTMASA-N 287.281 2.423 10 10 CECE Cc1cc(N(C)C2CC(n3ccnc3)C2)ccc1CN 2182199048 KEVDXUVPIDXUDS-UHFFFAOYSA-N 270.380 2.490 10 10 CECE CCC[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 2182913924 PLHXIGJCAPORJN-QWRGUYRKSA-N 279.336 2.175 10 10 CECE OC1[C@H]2CC[C@H]1CN(c1ccc3c(c1)CCC[C@H]3O)C2 2184690852 HSVVZOQQGHXGBT-HEHGZKQESA-N 273.376 2.263 10 10 CECE COCC[C@H](COC)N(C)c1ccc2c(c1)CC[C@@H]2N 2184735632 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CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)c(F)c1 2185188880 HKPNNHRLJYKSBD-DEQVHRJGSA-N 278.371 2.313 10 10 CECE NCC(F)(F)[C@H]1CCCCN1Cc1ccc(O)c(O)c1 2185149083 FWKCEAIDEWYGPH-CYBMUJFWSA-N 286.322 2.046 10 10 CECE Nc1ccc(OCCOC[C@H]2CC23CCOCC3)cc1 2198364558 ZBOIJOZOPCDJPJ-CYBMUJFWSA-N 277.364 2.481 10 10 CECE Cc1nc([C@](C)(N)c2ccc(N(C)C)cc2)ns1 2045063996 WVUSGJLPSWJVTO-CYBMUJFWSA-N 262.382 2.135 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H]3CC(O)C[C@H]3C2)c(F)c1 2194703288 GIKXSDMLBHTELT-LSJOCFKGSA-N 282.334 2.192 10 10 CECE CCC[C@H]1C[C@](CN)(N(C)c2ccc(OC)cc2)CO1 2185599795 WLWAJTUIXLRHRV-JKSUJKDBSA-N 278.396 2.418 10 10 CECE CC[C@@H](N)CN(CC)[C@@H](C)c1cc(O)ccc1O 2053095474 GDGMYCGZBPZUEU-WDEREUQCSA-N 252.358 2.218 10 10 CECE C[C@]1(C(F)F)CC(=O)N(C(=O)Nc2ccc(N)cc2)C1 2191537956 AXCBIHBEURJFDK-ZDUSSCGKSA-N 283.278 2.304 10 10 CECE Nc1ccc(NC(=O)N2CC[C@@H](N)CC23CCC3)cc1 2191516491 IAEUNQOUFBQOSR-GFCCVEGCSA-N 274.368 2.147 10 10 CECE CCCOc1cc(N2CC(C)(C(=O)OC)C2)ccc1N 2191895759 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CCNCc1ccc(N2CCO[C@H]3COC[C@H]32)cc1Cl 2192679427 OSILQICEBWMWLB-CABCVRRESA-N 296.798 2.054 10 10 CECE C[C@H](NO[C@H]1CCOC1)c1ccc(N(C)C)cc1 2072972060 AFQDJONKFRTDQF-FZMZJTMJSA-N 250.342 2.124 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3COCC[C@H]32)c(F)c1 2073008498 MJGGSFKUVSHIKC-XHVZSJERSA-N 251.301 2.104 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@H]2[C@@H](C)O)c(F)c1 2073333987 VVZDTQWDZSSVJN-BREBYQMCSA-N 253.317 2.229 10 10 CECE CN1CC[C@](C)(CNCc2cccc(Cl)c2O)C1 2073435850 ANWSDEJEJKSJJW-CQSZACIVSA-N 268.788 2.477 10 10 CECE CC12CC(C(=O)N3CCC[C@H](CN=[N+]=[N-])C3)(CO1)C2 2100448544 VFQKEFQXMIKQLN-QFWMXSHPSA-N 264.329 2.104 10 10 CECE CN[C@@H](C)c1ccc(N2CC=C[C@@H]2CF)cc1O 2082866977 VEEORJYDZWHQST-CMPLNLGQSA-N 250.317 2.387 10 10 CECE Nc1ccc(NC(=O)C2=S=Nc3ccccc32)cc1 2103698505 CPCIJMNKNDDFNV-UHFFFAOYSA-N 269.329 2.339 10 10 CECE COc1cccc(O)c1CNC[C@@H](O)c1ccsc1 2104438329 JZBYYZXWNFXVJN-CYBMUJFWSA-N 279.361 2.286 10 10 CECE COc1cccc(O)c1CN1CCC[C@@H]2COC[C@H]21 2104439398 OWRYLMRNJKJFPY-DGCLKSJQSA-N 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CNCc1ccc(OC[C@H]2CCCCNC2=O)c(C)c1 2155016509 GRNADXAUZFNAGX-CQSZACIVSA-N 276.380 2.010 10 10 CECE CN(Cc1ccno1)c1ccc(CO)cc1Cl 2023780349 RIYKEDWPEXBMQG-UHFFFAOYSA-N 252.701 2.457 10 10 CECE COc1ccc([C@@H](C)NCCN(C)C(C)C)c(O)c1 54111043 WEUKHSYDFNJFSO-GFCCVEGCSA-N 266.385 2.392 10 10 CECE CC1CC(CS(=O)(=O)Nc2ccc(O)cc2F)C1 2027596175 PTHHHORYKIYUFS-UHFFFAOYSA-N 273.329 2.319 10 10 CECE CC[C@H](C)[C@@H](O)CN[C@@H](C)c1cc(O)ccc1O 2030006782 NSOOCDJSZCTOJD-BHDSKKPTSA-N 253.342 2.155 10 10 CECE Oc1ccc(Cl)cc1CN1CC[C@@H](C2CNC2)C1 2032547783 AAZQEHXCLYRPQC-SNVBAGLBSA-N 266.772 2.087 10 10 CECE CCCn1nncc1CN(C)c1ccc([C@@H](C)O)cc1 2156484950 UZUXRSXQRHGQLH-GFCCVEGCSA-N 274.368 2.378 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](O)C(F)(F)C2)c(Cl)c1 2034596745 ZTYRQRZDZSXAMC-WRWORJQWSA-N 277.698 2.210 10 10 CECE C[C@@H](N)c1ccc(N2CC(N3CCC3)C2)c(Cl)c1 2034797475 KDGLMZLYKFZKEE-SNVBAGLBSA-N 265.788 2.254 10 10 CECE OCc1cnc(Sc2nnc3n2CCCCC3)s1 2037778475 VJENVEPBLPIYIH-UHFFFAOYSA-N 282.394 2.105 10 10 CECE 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10 10 CECE CCCc1noc(CNCc2ccc(N(C)C)cc2)n1 2160480854 OYBNSYOLUZYPMD-UHFFFAOYSA-N 274.368 2.378 10 10 CECE CN(C(=O)CN(C)[C@H]1CCC[C@@H]1F)c1ccc(N)cc1 2175591986 FPZLTMGXLYAHGD-KBPBESRZSA-N 279.359 2.054 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CC2(CO)CCOCC2)C1 2161319792 BZYBRHXXEWZCNQ-CYBMUJFWSA-N 282.388 2.188 10 10 CECE COc1ccc(Cl)cc1CC(=O)NCCN=[N+]=[N-] 701322539 BMWIBTYSVUGDOK-UHFFFAOYSA-N 268.704 2.318 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)CC3CC=CC3)ccc21 2162048693 DAGDDUWPOPKWGI-OAHLLOKOSA-N 271.364 2.302 10 10 CECE C[C@@H]1CN2CCC[C@H]2CN1Cc1ccc(F)c(F)c1O 703457315 CNZPWXQEOSMULM-PWSUYJOCSA-N 282.334 2.339 10 10 CECE Cc1cc(N2CC[C@@H]3[C@@H](O)C[C@H]32)ccc1CNC(C)C 2178160376 NXYQYSPDZUCWSP-BBWFWOEESA-N 274.408 2.453 10 10 CECE C[C@@H](O)c1ccc(N2CCc3ncn(C)c3C2)c(F)c1 2170669290 MRKYZEFTPIFMBM-SNVBAGLBSA-N 275.327 2.175 10 10 CECE CCC1(O)CCN(C(=O)Nc2ccc(N)cc2)CC1 707460019 LPOQIVLRXWUTCR-UHFFFAOYSA-N 263.341 2.038 10 10 CECE CNCc1ccc(N2CC(OCC(F)(F)F)C2)cc1C 707611383 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CN(C)C[C@H](NCc1ccc(N(C)C)cc1)C(F)(F)F 2177718850 HHYWFLHGKUJXTN-ZDUSSCGKSA-N 289.345 2.335 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@H]4CC[C@H]3C4)ccc21 2168813402 CFHYCPRQUCXCEV-JRPNMDOOSA-N 271.364 2.278 10 10 CECE Nc1ccc(C[C@H](O)c2ncc3ccccc3n2)cc1 2177988757 WECIYRHCASRURG-HNNXBMFYSA-N 265.316 2.488 10 10 CECE C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2179619370 RRWLCYFGKKXGBO-AVGNSLFASA-N 279.388 2.456 10 10 CECE CCO[C@]1(CN(C)c2ccc(CO)cc2C)CCOC1 2188190228 XQDUKBYEZXODDH-INIZCTEOSA-N 279.380 2.119 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](c3nncs3)C2)cc1O 2196551926 PEMDPTJKXXYJKX-ZJUUUORDSA-N 291.376 2.291 10 10 CECE CO[C@H]1CN(Cc2c(O)cccc2F)CC[C@H]1C 2042599640 PLCIFDPJBAWHBI-YGRLFVJLSA-N 253.317 2.388 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](O)[C@H]4CC[C@@H]43)ccc21 2190261120 LTGFURHVAPGTME-YVSFHVDLSA-N 272.392 2.243 10 10 CECE CCNCc1ccc(N2CC[C@H](CO)C23CC3)c(F)c1 2190359262 JECMZAGAUUDQLL-CYBMUJFWSA-N 278.371 2.286 10 10 CECE Cc1nc(CN(C)CCN=[N+]=[N-])ccc1[N+](=O)[O-] 2048568811 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[N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2C[C@@]23CCCOC3)CC1 2198144116 RUIDYDZRPNAVHT-YRGRVCCFSA-N 278.356 2.495 10 10 CECE CCc1cccc(CN[C@@H]2CCOC[C@H]2F)c1O 2066710723 FYORXUUAUKILGF-CHWSQXEVSA-N 253.317 2.171 10 10 CECE CC[C@@H](O)CN(C)c1c(F)cc([C@@H](C)N)cc1F 2074213149 GQHCCPLYJJBDFA-PSASIEDQSA-N 258.312 2.192 10 10 CECE CO[C@@H]1[C@H](N[C@@H](C)c2ccc(F)cc2O)COC1(C)C 2199469930 ZZROAIFXHQSCQH-MRCXROJRSA-N 283.343 2.374 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@H]1C[C@@]12CCCOC2 2077420742 WBJNOXJTOXEEGG-CMPLNLGQSA-N 252.318 2.010 10 10 CECE COCC1(C(=O)N(C)[C@H](C)c2ccccc2O)CC1 2101664516 BJWMCGILSYKNJB-LLVKDONJSA-N 263.337 2.338 10 10 CECE CCN(CC(=O)NC)[C@H](C)c1ccc(Cl)cc1O 2083093565 PBQRPOOPBFDTOP-SECBINFHSA-N 270.760 2.175 10 10 CECE CSCC[C@H](O)CCNCc1ccc(C)cc1O 2084080646 UDOZEVOCORULIU-CYBMUJFWSA-N 269.410 2.294 10 10 CECE COc1cc(N2CCCC[C@@H](F)C2)ccc1CN 2084013869 LCVJVXBWEYHTMI-GFCCVEGCSA-N 252.333 2.482 10 10 CECE OC[C@@H]1CCCC[C@H]1NCc1ccc(F)cc1O 2084167569 CAHWODRUYOEOAX-WCQYABFASA-N 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265.353 2.325 10 10 CECE CCCC[C@H](COC)NC(=O)/C=C\c1ccc(O)c(O)c1 588407146 HCZQZVULTFINTF-FNOHHLHBSA-N 293.363 2.432 10 10 CECE CCCNC(=O)CCNC/C=C/c1ccc(N(C)C)cc1 835036807 RLNVLQOXNUYAHV-AATRIKPKSA-N 289.423 2.272 10 10 CECE C[C@@H](NC[C@H]1CN(C2CC2)C(=O)O1)c1ccc(F)cc1O 848569130 CDTHTLSARJDQON-SKDRFNHKSA-N 294.326 2.165 10 10 CECE Cn1c2c(ccc1=O)[C@H](NCc1ccccc1O)CCC2 846108095 NPHXQRLHHWLFMW-CQSZACIVSA-N 284.359 2.258 10 10 CECE Nc1ccc(CCNC(=O)NCCCc2ccccn2)cc1 841862300 IYPWCSQRZZIPNF-UHFFFAOYSA-N 298.390 2.138 10 10 CECE CO[C@](C)(CO)CN[C@@H](C)c1cc(Cl)cc(C)c1O 848556433 XQOUSSMAVCHTFO-HZMBPMFUSA-N 287.787 2.402 10 10 CECE CCOCc1cc(CN[C@@H]2CCCN(C)C2)ccc1OC 747853688 AQEZPNKTVHSBNL-MRXNPFEDSA-N 292.423 2.416 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@H](N)C2CC2)cc1 841051623 SVVAYTBAEWVNOF-CWDCEQMOSA-N 259.397 2.093 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CN(C)C3)CCCN1 689404775 GVOHGACBBDJPJP-CYBMUJFWSA-N 259.397 2.210 10 10 CECE CC(C)(C)OC(=O)[C@@H]1C[C@@]1(N)c1cccc(F)c1O 1952777205 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285.771 2.281 10 10 CECE Nc1ccc(CCN2CC3(CCCC3)C[C@H]2CO)cc1 1912777211 RCUVOQCNOCNBCT-INIZCTEOSA-N 274.408 2.438 10 10 CECE CN(CC1(C)COC1)c1ccc(C=CC(=O)O)cc1F 1911984412 VRTGTPVTJVXQBB-UHFFFAOYSA-N 279.311 2.396 10 10 CECE CC(C)n1ccc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)n1 1912158462 XNOHLUQSLDJMOV-JTQLQIEISA-N 262.317 2.379 10 10 CECE Cc1ccc(F)cc1NC(=O)CN1CC[C@@H](N=[N+]=[N-])C1 1912144005 NDKHIDGVBZVXHA-LLVKDONJSA-N 277.303 2.457 10 10 CECE Cc1csc(=O)n1CCN1CCC[C@@H](CN=[N+]=[N-])C1 1912172329 SVMYXABIIRZLHK-NSHDSACASA-N 281.385 2.241 10 10 CECE COc1ccc(C(=O)N(C)CCCN=[N+]=[N-])c(O)c1 1912180061 VPUAHWXTXJBKEU-UHFFFAOYSA-N 264.285 2.173 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@@H]2CCCS2)CC1 1912189157 SHVOMCONDLRVKB-JTQLQIEISA-N 254.359 2.431 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@@H]2CC[C@H]3C[C@H]2CO3)CC1 1912203014 AUZJFMYSHZUKTE-RWMBFGLXSA-N 278.356 2.350 10 10 CECE Cc1c[nH]nc1[C@H](N)c1ccc2c(c1)CCCN2C 2134209223 NBMRNLMSKYKMCO-CQSZACIVSA-N 256.353 2.149 10 10 CECE 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10 10 CECE Cc1cccc2nnc(CCc3ccc(N)cc3)n12 703546069 BPXQXKBYPOHHHN-UHFFFAOYSA-N 252.321 2.405 10 10 CECE CO[C@H]([C@H]1CCCOC1)[C@H](O)c1ccc(N(C)C)cc1 2163066019 HQZCVEBZPDTVAO-NUEKZKHPSA-N 279.380 2.228 10 10 CECE CCN1CCc2cc([C@H](O)c3c(C)n[nH]c3C)ccc21 2163072661 CHJJXCJAMDKEBL-INIZCTEOSA-N 271.364 2.491 10 10 CECE CCC[C@@H](N)[C@H](N)c1ccc(Br)cc1O 396689449 ZVPJKOILEJYQJR-MWLCHTKSSA-N 273.174 2.282 10 10 CECE COC[C@@]12C[C@H]1CN(c1ccc(CNC3CC3)cc1)C2 2165468311 QYFMVASUOTYFHE-YOEHRIQHSA-N 272.392 2.411 10 10 CECE CN(C[C@@H]1CCN1C)c1ccc(CNC2CC2)cc1 2129894917 PTPMOTLPHBKOOD-INIZCTEOSA-N 259.397 2.079 10 10 CECE COc1cc(Cl)cc(CN2CC[C@H]3CN(C)C[C@@H]32)c1O 814172893 CTZLYCAHPNIHJV-GWCFXTLKSA-N 296.798 2.190 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H](O)C1CCC1 575249188 CEMHZXOTOYECRJ-CVEARBPZSA-N 260.381 2.448 10 10 CECE CN[C@@H](C)c1ccc(N2C3CCC2(CO)CC3)cc1 722982866 PYAWRXPRXPVEHZ-JQRITLKVSA-N 260.381 2.461 10 10 CECE CCOC(=O)CN(Cc1ccccc1O)C[C@@H](C)COC 822512018 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C[C@H](N[C@H](C)C(C)(C)O)c1cc([N+](=O)[O-])ccc1O 756818844 PZKPSDWOAOFCJI-DTWKUNHWSA-N 268.313 2.110 10 10 CECE Cc1ccc(O)c(CNC(=O)CCN(C)c2ccncc2)c1 862757075 GUMBOIBTHPOISV-UHFFFAOYSA-N 299.374 2.238 10 10 CECE CCOc1cccc(CN[C@@H]2CC=C(C(=O)OC)C2)c1O 862464706 GPGDJUDFPPQHFQ-CYBMUJFWSA-N 291.347 2.142 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCOC[C@@H]1C 766683271 CRXIZLKGEOCHQU-BBRMVZONSA-N 290.407 2.350 10 10 CECE Nc1ccc(Cn2ccc3ccc(N)cc3c2=O)cc1 76750783 OMIYZJSWLVMVBA-UHFFFAOYSA-N 265.316 2.214 10 10 CECE CCN(Cc1cn(C)nn1)Cc1cc(Cl)ccc1O 781928810 FIOUZAQJWKYUSI-UHFFFAOYSA-N 280.759 2.196 10 10 CECE CN1C[C@H]2[C@@H](NCc3cccc(Cl)c3O)CC[C@H]2C1 1474756617 JUVFKYMFIRRWJH-SCRDCRAPSA-N 280.799 2.475 10 10 CECE CCc1sc([C@@H](N)c2ccc(O)cc2O)nc1C 83478614 JOCPDJCZEGYVMN-LBPRGKRZSA-N 264.350 2.473 10 10 CECE COc1cccc([C@@H]2NCCc3ccc(O)cc32)c1O 83595312 DDBVGWXRAOYRGQ-HNNXBMFYSA-N 271.316 2.342 10 10 CECE CC(C)[C@@H]1CN[C@@H](C)CN1c1ccc2c(c1)OCCO2 83548536 HMRLIAAYZQKVSV-JSGCOSHPSA-N 276.380 2.281 10 10 CECE CN[C@H]1CN(C(C)C)c2cc(OC)c(OC)cc21 84797904 MOAXRFWWWYURPE-NSHDSACASA-N 250.342 2.193 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCSC[C@H]1C 70219226 KGVJWNGEQCWTNM-MNOVXSKESA-N 279.409 2.033 10 10 CECE CCOC[C@@H]1CN([C@H](C)c2ccc(F)cc2O)CCO1 705854302 SVJYKSLESQLVBG-YPMHNXCESA-N 283.343 2.330 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3COC[C@@H]3C2)cc1 690293031 VDDHXTDTOBLWHW-YUELXQCFSA-N 260.381 2.440 10 10 CECE Nc1ccc(OCC(=O)N[C@@]23CCCC[C@H]2C3)cc1 710528285 HEEDHSYPBCCMGU-XHDPSFHLSA-N 260.337 2.097 10 10 CECE COC(C)(CCN[C@H](C)c1c(O)cccc1O)OC 711034038 CFOFMNOTYUWMDC-SNVBAGLBSA-N 269.341 2.148 10 10 CECE Cc1nn(C)cc1CN(C)c1ccc(CN)c(F)c1F 716404909 DHXGRZNEZRUCBZ-UHFFFAOYSA-N 280.322 2.102 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC1CC(C(N)=O)C1 716687859 SUNQVFNTJILVDF-YYJSSNLHSA-N 274.364 2.102 10 10 CECE CN(C[C@]1(C)CCOC1)c1ccc(CN)c(F)c1 687498793 KVJCJNFQNCVQOO-AWEZNQCLSA-N 252.333 2.147 10 10 CECE NCc1ccc(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1Cl 718256370 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CC1(C)CCC[C@](O)(C(=O)NCc2cc(O)ccc2O)C1 1176755756 VFUDCBJTRKRZGP-MRXNPFEDSA-N 293.363 2.045 10 10 CECE C[C@@]12CC[C@@](C(=O)N3CCC[C@H](N=[N+]=[N-])C3)(CO1)C2 2121863693 AKPGAALQWDLQJY-DRZSPHRISA-N 264.329 2.247 10 10 CECE O[C@H]1CCCc2cc(N3[C@H]4CC[C@H]3COC4)ccc21 2128274204 ZWEBGFZHRZZJAN-DZKIICNBSA-N 259.349 2.424 10 10 CECE N[C@H]1CCc2cc(N3CCO[C@H](CCF)C3)ccc21 2128327009 LDLDKJQFYLXORA-HIFRSBDPSA-N 264.344 2.197 10 10 CECE CCNCc1ccc(N2CC[C@H]3CCO[C@H]3C2)cc1 2128435708 NQAUZDBRTMHQDP-HOCLYGCPSA-N 260.381 2.411 10 10 CECE CC[C@@]1(C)C[C@H](NCc2cccc(OC)c2O)CO1 2132920396 GFBCTUWBNLXELP-WFASDCNBSA-N 265.353 2.448 10 10 CECE C[C@@H](O)c1ccc(N2CCN(C)C3(CC3)C2)c(F)c1 2131872544 RCHDBMIDCKHLTG-LLVKDONJSA-N 264.344 2.163 10 10 CECE COC[C@H](C)OC(=O)N1CCC(CN=[N+]=[N-])CC1 1912199092 OLEYEZSSFPFFCY-VIFPVBQESA-N 256.306 2.180 10 10 CECE COC[C@@H](C)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1912164256 UQHSLFMYXQQGFH-WDEREUQCSA-N 254.334 2.208 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)C(F)(F)C(F)F)CC1 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O=C(NCc1ccc(O)c(O)c1)c1onc2ccccc12 1566359811 OMJSIEIZDQFTPV-UHFFFAOYSA-N 284.271 2.169 10 10 CECE O=C(c1cnc2ccccc2n1)N1Cc2cccc(O)c2C1 1644088287 NLERXHIVEAYBAW-UHFFFAOYSA-N 291.310 2.491 10 10 CECE C[C@@]1(O)CCCN(c2c(F)cc(CN)cc2F)CC1 230345333 HHBDXJGIIYITDX-CQSZACIVSA-N 270.323 2.165 10 10 CECE Cc1cccc(CN[C@H]2CCC23CCNCC3)c1O 2139758509 SCUZDRXQGSDVLL-AWEZNQCLSA-N 260.381 2.322 10 10 CECE Oc1cc(F)ccc1CN[C@H]1CO[C@H](C(F)(F)F)C1 2139880594 GLCCINDZWBQUOW-KOLCDFICSA-N 279.233 2.341 10 10 CECE CC1(C)C(O)C(C)(C)C1NCc1ccc(F)cc1O 2139880482 WYDZLRPNYCVQSM-UHFFFAOYSA-N 267.344 2.416 10 10 CECE NC(=O)COc1cccc(NCc2cccc(F)c2O)c1 164983658 ZUKPYXRNZKWWOO-UHFFFAOYSA-N 290.294 2.008 10 10 CECE COc1cc(CN(C)CC(=O)NC(C)(C)C)c(O)cc1C 159511827 ROSNMPSBGCHLRX-UHFFFAOYSA-N 294.395 2.056 10 10 CECE CN(C)c1ccc(CN2CCC[C@H](O)C2(C)C)cc1 258838626 PRFHZCMEKVNEHD-HNNXBMFYSA-N 262.397 2.488 10 10 CECE CNC[C@@H]1CCN(c2ccc(OC)cc2OC)[C@@H]1C 259194401 ILLMOEUSXKZFPF-NEPJUHHUSA-N 264.369 2.138 10 10 CECE CN(c1ccc(N)cc1)c1ccc2oc(=O)[nH]c2c1 259634560 CJVXXLXQBVPRAQ-UHFFFAOYSA-N 255.277 2.471 10 10 CECE CCC[C@](C)(N)c1nc(-c2ccc(O)c(O)c2)no1 233371666 YYSBUPQDYSMWJK-ZDUSSCGKSA-N 263.297 2.122 10 10 CECE CNCc1ccc(N(C)CC(=O)NCC(C)C)cc1Cl 234400176 ZHFKUOANXCTQGM-UHFFFAOYSA-N 297.830 2.268 10 10 CECE CN1CC(CCNCc2cccc(Br)c2O)C1 1941431135 XMQUVSSNEKEJQT-UHFFFAOYSA-N 299.212 2.196 10 10 CECE CCOc1cccc(CNCC(=O)O[C@@H](C)CC)c1O 1857872449 MQDOHRRMBZIPQQ-NSHDSACASA-N 281.352 2.222 10 10 CECE Nc1ccc(CC[C@H](O)C[C@H]2C[C@]23CCOC3)cc1 1894835038 LAHOEKQXHYFUPK-BPUTZDHNSA-N 261.365 2.379 10 10 CECE Nc1ccc(OCC(=O)Nc2cnccc2Cl)cc1 129288105 TVDILPPXSCXQRC-UHFFFAOYSA-N 277.711 2.335 10 10 CECE OC[C@@]12CCC[C@@]1(CNCc1ccc(F)cc1O)C2 2143034397 CUQNQFLOVAQPJS-GJZGRUSLSA-N 265.328 2.174 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H](C)[C@@H](C)OC 1876459517 QGXHAEGAEFUPFM-VHSXEESVSA-N 266.341 2.281 10 10 CECE Cc1cc(O)nc(N[C@H](C)c2c(O)cccc2O)n1 1877935875 KWTQZZRWOZYRNR-MRVPVSSYSA-N 261.281 2.075 10 10 CECE 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2258274326 VGQMVJOCUOUKNS-CQSZACIVSA-N 265.293 2.478 10 10 CECE CSc1ncc(CN[C@@H](C)C[C@H]2CCCN2)s1 2248711609 PWHQARBCWQPKKE-VHSXEESVSA-N 271.455 2.485 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@@H]2C[C@H](C1)[C@@]2(C)O 2270721457 RJWIQXJJBOQPES-ZIEJDFEHSA-N 260.381 2.222 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)[C@H]2CNCC23CC3)c1 2271434254 RLRHIQIREAPYFG-DOMZBBRYSA-N 260.381 2.445 10 10 CECE COc1cc(OC)c(N2C[C@H](N)CC[C@H]2C)cc1OC 2289398555 LFEXFEHHAXYNOI-GHMZBOCLSA-N 280.368 2.028 10 10 CECE CC1(C)COc2ccc(N3C[C@H]4C[C@@]4(CN)C3)cc21 2272655776 QOGLIWSQVAAXCG-BDJLRTHQSA-N 258.365 2.142 10 10 CECE COc1ccc(N2CCN[C@H]3C[C@@H]32)c2ccccc12 2277506623 JJPAHSOGUVSRGF-ZFWWWQNUSA-N 254.333 2.399 10 10 CECE CCOC(=O)c1c[nH]c(=NCc2cnc(SC)s2)o1 2269092074 DFIMYMYLWOVXRJ-UHFFFAOYSA-N 299.377 2.064 10 10 CECE COC[C@@]1(C)C=CCN1CCCc1ccc(N)cc1 2269098442 LDDMHNXWKHFUFX-MRXNPFEDSA-N 260.381 2.478 10 10 CECE Cc1cc(N2C[C@]3(C)C[C@]3(CO)C2)ccc1[C@@H](C)O 2269684991 CEJJVBRSTRUQQL-UHOFOFEASA-N 261.365 2.257 10 10 CECE CCO[C@H]1C[C@H](NC(=O)NCc2cccc(C)c2O)C1 2280171122 IWHZJEYWBLKVPN-JOCQHMNTSA-N 278.352 2.067 10 10 CECE COC1([C@@H](NN)c2ccc(N(C)C)cc2)CC(CF)C1 2281141589 LPGAGICOSODSKW-WPBUFGDCSA-N 281.375 2.022 10 10 CECE CN(Cc1nncs1)c1ccc(C=CC(=O)O)cc1F 2281356311 PJGUVAYHCCCQFR-UHFFFAOYSA-N 293.323 2.411 10 10 CECE C[C@H](NCC1(CO)CC(F)(F)C1)c1c(O)cccc1O 2281678880 VFONDBBXOYVDGG-VIFPVBQESA-N 287.306 2.156 10 10 CECE COc1ccc(N2CCOC[C@@H]2C[C@@H](C)O)c(C)c1C 2284599842 SNSMSQVOGTVIRO-RISCZKNCSA-N 279.380 2.288 10 10 CECE C[C@H]1C[C@H](CC(=O)O)CN1Cc1cc(F)cc(F)c1O 2285684704 HWWJXALDFRIVNR-DTWKUNHWSA-N 285.290 2.356 10 10 CECE COc1cc(OC)c(N(CCO)CC(C)C)cc1OC 2289450414 QYNXMUKBVCLJFN-UHFFFAOYSA-N 283.368 2.167 10 10 CECE Nc1ccc(Nc2ccc(N3CCNCC3)cc2)cc1 1159456688 ZBNKXPUCLJUYEZ-UHFFFAOYSA-N 268.364 2.422 10 10 CECE CCN(C)c1ccc(C=C2SC(=S)N(C)C2=O)cn1 2311519269 VRJRYNUNJUUIRC-UHFFFAOYSA-N 293.417 2.369 10 10 CECE Cc1cc(N(C)[C@@H](CO)C(C)C)ccc1[C@H](C)N 2318840817 PNVUOSHJNALKSM-WFASDCNBSA-N 250.386 2.468 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)C[C@@H]1CCC[C@H]1C 2315991957 FMPFWJGDAJAUIB-MNOVXSKESA-N 274.390 2.385 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(SC)c2)[C@@H]1C 2328546642 PDAFMDUOHDVYIM-MFKMUULPSA-N 266.410 2.481 10 10 CECE CCc1cccc(CNC[C@H]2C[C@@H]3C[C@@H]3CO2)c1O 2331058877 VHLXAJCUAZZSNK-RRFJBIMHSA-N 261.365 2.469 10 10 CECE OC[C@@H]1C[C@@H]2CC[C@H]1N2c1ccc2c(c1)CC[C@H]2O 2331551591 NUMBMOLXFAAFSK-DDUYRFODSA-N 259.349 2.016 10 10 CECE CN(C)c1ccc([C@]2(N)C[C@H]3[C@@H]2[C@@H]2CC[C@H]3O2)cc1 2331805795 JYFUOQMJPMWHOF-IBEHDNSVSA-N 258.365 2.104 10 10 CECE CCN1[C@H]2CC[C@@H]1CN(c1ccc(CN)cc1Cl)C2 2335518691 KUHCBMCIWRRCEH-BETUJISGSA-N 279.815 2.472 10 10 CECE C[C@H](NC[C@@H]1COCC1(C)C)c1cc(O)ccc1O 2336146803 WGDMAOPQCIGBGC-WDEREUQCSA-N 265.353 2.421 10 10 CECE C[C@H]1Cc2cc(N3CC(F)(F)[C@](C)(N)C3)ccc2O1 2336874532 PQQMEXZBVJVDHI-TVQRCGJNSA-N 268.307 2.183 10 10 CECE Cc1c([C@@H](C)N)ccc(N(C)Cc2ncno2)c1C 2340851086 OGHINIJOBAXHQX-LLVKDONJSA-N 260.341 2.343 10 10 CECE 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2.445 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H]1[C@H]2CCC[C@H]21 2167424189 JAFNUKUMWIWLOQ-ZHCJQAHYSA-N 274.408 2.420 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](C)CCCc1ccccc1 808533013 DRMCDOCKPULGMU-LBPRGKRZSA-N 276.332 2.347 10 10 CECE Cc1nc(N(C)Cc2ccc(N)cc2)ccc1C(=O)O 2162820857 LWIRWBCVHLMFKA-UHFFFAOYSA-N 271.320 2.307 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@H](C(N)=O)C2)cc1 723176074 LFGWVWQFIHSTPS-OCCSQVGLSA-N 275.396 2.059 10 10 CECE CC(C)[C@@H](N)[C@@H](N)c1ccc(Br)cc1O 396692793 GOCDZKYWXSBODQ-MNOVXSKESA-N 273.174 2.138 10 10 CECE Cc1nn(C)cc1[C@H](O)c1ccc(N2CCCC2)cc1 2163110989 NOCKSLOQDWDKBX-MRXNPFEDSA-N 271.364 2.410 10 10 CECE CCn1cnc([C@@H](NC)c2ccc3c(c2)CCN3C)c1 2163129727 AHPRVKXMRKDUNS-INIZCTEOSA-N 270.380 2.204 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@](O)(COC)C(C)C 2163139793 ZREQOFHWLJVTAZ-JKSUJKDBSA-N 280.412 2.047 10 10 CECE CC(C)NC(=O)C1CN(c2ccc([C@H](C)N)c(Cl)c2)C1 2168046490 FFOSVATWUGYEES-JTQLQIEISA-N 295.814 2.321 10 10 CECE Nc1cc(F)cc([C@H](N2CCOCC2)C(F)(F)F)c1O 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10 CECE Oc1cccc([C@@H]2NCCc3ccc(O)c(O)c32)c1 83620889 HIFRWVHHSRQSPM-AWEZNQCLSA-N 257.289 2.039 10 10 CECE Oc1cc2c(c(O)c1O)CCN[C@@H]2c1cccc(F)c1 83658242 CVVAUYAFYZFJLP-CYBMUJFWSA-N 275.279 2.178 10 10 CECE COc1ccc(N2CCC[C@@H](C)[C@H]2CN)c([N+](=O)[O-])c1 70178445 AZHNUADXZRKYIX-QMTHXVAHSA-N 279.340 2.167 10 10 CECE C[C@@H]1CSCCN1C(=O)CCOc1ccc(N)cc1 70218912 NAOISJWWQXBLRT-LLVKDONJSA-N 280.393 2.002 10 10 CECE C[C@H]1CN(Cc2ccc(F)c(F)c2O)[C@H](C)CO1 703586939 VLJVYVXAKHFVPW-BDAKNGLRSA-N 257.280 2.280 10 10 CECE CN(C)c1ccc(CNC(=O)N2CC(C)(F)C2)cc1F 792058287 LEQNAULYOMVPDB-UHFFFAOYSA-N 283.322 2.145 10 10 CECE CCN[C@@H](CC)c1ccc(N(CC(N)=O)C(C)C)cc1 705782544 VHULQGKDZFAWLG-HNNXBMFYSA-N 277.412 2.447 10 10 CECE C[C@H](O)c1ccc(N2CC(n3cncn3)C2)c(Cl)c1 707643571 IRALOILAMPWFTO-VIFPVBQESA-N 278.743 2.046 10 10 CECE CNCc1ccc(N2C[C@@H](CO)[C@@H](C)C2)cc1Cl 708163311 SABCBWGOIUFNKQ-JQWIXIFHSA-N 268.788 2.124 10 10 CECE COc1cc(NS(=O)(=O)c2cc(C)oc2C)ccc1O 797820347 SNDCBCQHCOOOAS-UHFFFAOYSA-N 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272.348 2.202 10 10 CECE Cc1cnc([C@@H](O)c2ccc(N3CCCC3)cc2)nc1 2163107773 QDHIONGAHQQAQW-HNNXBMFYSA-N 269.348 2.467 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)[C@]3(C)CCCS3)ccc21 2163142749 DGFTVVCRLZMGHS-JYJNAYRXSA-N 292.448 2.325 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2CSCCO2)cc1 2163144350 MIYYDCZEBNSTQY-GJZGRUSLSA-N 295.452 2.169 10 10 CECE N[C@@H](c1ccc(N2CCCC2)cc1)[C@@H](O)c1cscn1 2163245488 WXXKGIKKBXPODK-GJZGRUSLSA-N 289.404 2.477 10 10 CECE O=C1NCCC[C@@]12CCN(Cc1ccc(Cl)cc1O)C2 2163264622 XAPBHKYZRKGXNI-HNNXBMFYSA-N 294.782 2.148 10 10 CECE COc1cccc(CN[C@H]2CC[C@H](C(=O)O)CC2)c1O 709939794 UYSRBOMXUWXVDF-UMSPYCQHSA-N 279.336 2.134 10 10 CECE C[C@H](N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21)[C@@H](C)N 817977259 FSKZVCVYUOPYIY-REIXXSIJSA-N 252.333 2.405 10 10 CECE Cc1cc(N2C[C@@H]3COC[C@H]3C2)ccc1/C=C/C(=O)O 718635055 IDNHAIXCSUHDKL-KBUVRSHFSA-N 273.332 2.175 10 10 CECE COc1nscc1C[C@@H](O)c1ccc(N(C)C)cc1 711540337 RFHPKIMTDAHHNG-CYBMUJFWSA-N 278.377 2.494 10 10 CECE CCCCN(CC(N)=O)c1ccc([C@H](C)N)c(Cl)c1 723200765 YKOFNZDIUPDGHM-JTQLQIEISA-N 283.803 2.452 10 10 CECE CCOc1ccc(CN2CCc3nccnc3C2)c(O)c1 827692914 SENKRUFIDIVPSY-UHFFFAOYSA-N 285.347 2.139 10 10 CECE CNC(=O)[C@]1(C)CCN(c2ccc([C@H](C)N)cc2Cl)C1 723197873 HATBUFIMDNFFLJ-ZUZCIYMTSA-N 295.814 2.322 10 10 CECE CCOc1ccc(CNCc2cc(N)ccn2)c(O)c1 903950055 HQXFCXGGMOMJIO-UHFFFAOYSA-N 273.336 2.058 10 10 CECE O=C(c1cc(O)c(O)c(O)c1)N1CCCc2ccccc21 586735637 XGBLVXYPYQCNQT-UHFFFAOYSA-N 285.299 2.396 10 10 CECE COC(=O)c1cc(COC(=O)c2cc(O)cs2)c(C)o1 732353985 XPHQEEOMKGPPAG-UHFFFAOYSA-N 296.300 2.499 10 10 CECE Nc1ccc(CCNC(=O)NCCc2ccsc2)cc1 841700421 TYAKOFGVYKIPLP-UHFFFAOYSA-N 289.404 2.415 10 10 CECE COC(C)(C)[C@@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 928600076 RWKHZBNZGGZEKF-BJPMOSCESA-N 279.336 2.041 10 10 CECE Oc1cc2c(cc1CN1CC[C@@H]3COC[C@H]3C1)CCC2 853586893 ZAFLHQLTIPQVJY-GDBMZVCRSA-N 273.376 2.349 10 10 CECE O=C(c1cc(O)cs1)N1C[C@]23CCCC[C@]2(COC3)C1 856426001 MSWOIDPCHNYPGI-GASCZTMLSA-N 293.388 2.487 10 10 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129444392 VAEPDSDXQPHHKT-HZPDHXFCSA-N 274.408 2.318 10 10 CECE CO[C@@H]1CCCCC[C@H]1Nc1c(N)cccc1C(N)=O 2144481195 HJHHGRBEDFOAGB-CHWSQXEVSA-N 277.368 2.127 10 10 CECE COC12CCC(C(=O)NCc3ccccc3O)(CC1)C2 1964890085 PTRNRLCXUMAALF-UHFFFAOYSA-N 275.348 2.358 10 10 CECE C[C@]12CCCC[C@H]1C(=O)N(c1ccc(N)cc1)C(=O)N2 2144773139 DDRCQJUTNWZHHN-WFASDCNBSA-N 273.336 2.274 10 10 CECE C[C@@H](NCc1nnn(C)c1C(F)F)c1ccccc1O 1967548131 WPJQIHKGPLGPMU-MRVPVSSYSA-N 282.294 2.309 10 10 CECE Nc1ccc(CN2C[C@@]34CCC[C@]3(COC4)C2)cc1 1968002359 VXMYJDSPOHJCRJ-HZPDHXFCSA-N 258.365 2.271 10 10 CECE C[C@@]1(C(F)F)C[C@H]1C(=O)NCc1ccc(N)cc1 1968570706 UEXGLCJNGCIXMB-GXFFZTMASA-N 254.280 2.176 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCCC[C@H]1CCN 252463764 BJMGMICVGJSVIO-NEPJUHHUSA-N 264.369 2.362 10 10 CECE CN1C[C@H](CN)C[C@H]1c1c(O)ccc2ccccc12 258471347 VFXCXLZNDRZIDU-FZMZJTMJSA-N 256.349 2.497 10 10 CECE CCNCc1ccc(N2CC[C@H]3[C@H](C2)[C@@H]3CO)c(C)c1 2149504627 DHIWQSBMKKWYAL-HRCADAONSA-N 274.408 2.169 10 10 CECE CN1C(=O)[C@@H](O)c2ccc(N3CCC[C@](C)(F)C3)cc21 2152232179 QZYIFQRSHLMLBP-ZFWWWQNUSA-N 278.327 2.025 10 10 CECE CC(C)C[C@@H](N)Cc1nc(-c2ccc(O)c(O)c2)no1 2152376143 GGOAXFQRLBVZCU-SNVBAGLBSA-N 277.324 2.064 10 10 CECE C[C@H]1C[C@@H](C)[C@@H](C(=O)O)CN1Cc1cc(F)ccc1O 2153735585 ODCNXLKSNNTSCZ-NRUUGDAUSA-N 281.327 2.462 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CCOCC(F)(F)F 2009445158 MKSZQBLBIXBRRQ-MRVPVSSYSA-N 252.240 2.340 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2O)[C@@H]1CCC[C@H]2C[C@@H]21 2155396892 ZBMPUCWGINGCEW-JQWOWJDXSA-N 272.348 2.297 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1CCC=C1Br 2020062657 UAOXVCFRSIPURU-SNVBAGLBSA-N 296.168 2.221 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3COC[C@H]2C3)c(Cl)c1 2021449239 QTTGBXPPXUMFCV-FBIMIBRVSA-N 252.745 2.337 10 10 CECE CC[C@@]1(C(F)(F)F)NC(=O)N(c2ccc(N)cc2)C1=O 2156610022 BSYYATGVIDMSDP-LLVKDONJSA-N 287.241 2.036 10 10 CECE CCOC(=O)[C@](N)(CSc1nccs1)C(C)C 2026512939 IPJXFVAGXOXXDI-NSHDSACASA-N 274.411 2.152 10 10 CECE CCCN1CC[C@H](CNCc2ccc(F)cc2O)C1 294466960 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KMEWUZHJVIMSFB-UHFFFAOYSA-N 278.396 2.222 10 10 CECE CC[C@H](O)[C@@H](CC)N[C@H](C)c1ccc(O)cc1O 313097476 DXECAWMTPISUQQ-WQAKAFBOSA-N 253.342 2.298 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCCC[C@@H]1CC(=O)O 86775327 RVELTHLOZCYAJJ-WDEREUQCSA-N 279.336 2.488 10 10 CECE CC1(C)[C@@H]2[C@H](CCN2c2c(F)cc(CO)cc2F)[C@H]1O 2178158669 DCKWLXDNWJCEPU-QCZZGDTMSA-N 283.318 2.053 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@@H]2C[C@H](C1)C2O 2172930111 YDXNIBNBZKIIEX-VMZNBEPHSA-N 272.392 2.064 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2CN(C)C3)c(C)c1 687242901 CFTYYNIXUAQUHL-HOTGVXAUSA-N 273.424 2.387 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)c(F)c1 709854303 BWDAWYQBPISDHS-MCIONIFRSA-N 278.371 2.285 10 10 CECE CCN[C@@H]1CCN(C)[C@]1(C)c1ccc(N(C)C)cc1 712140555 GXISSUHLXNNUND-HZPDHXFCSA-N 261.413 2.281 10 10 CECE CCN1CC(CN(C)c2ccc(CNC)c(C)c2)C1 692253595 MOOBULIHQFYSMF-UHFFFAOYSA-N 261.413 2.102 10 10 CECE Cc1cc(N2CCC[C@H]3[C@H]2C(C)(C)[C@@H]3O)ccc1CO 693082519 XLGUQVJRCZPFGQ-HRCADAONSA-N 275.392 2.473 10 10 CECE C[C@@H]1CCN([C@H](C)c2c(O)cccc2O)C[C@@H]1C(=O)O 693433044 VJYJKLSSIYIPFW-MXWKQRLJSA-N 279.336 2.201 10 10 CECE C[C@@H]1CN(Cc2cccc(F)c2O)CC[C@H]1N(C)C 693644757 OCHGOWOQONIYLQ-BXUZGUMPSA-N 266.360 2.303 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)CC(F)(F)F 695092680 IJHVQSMYGFRBJW-UHFFFAOYSA-N 269.244 2.005 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@@H](C)O[C@H]2C)c(N)c1 384521719 BDRIMWRUQPAWCV-ISTVAULSSA-N 250.342 2.280 10 10 CECE O=C(NCC[C@@H]1CC[C@H]2C[C@H]12)c1cccc(O)c1O 717157610 SFRZXCZBCZSBGF-JBLDHEPKSA-N 261.321 2.264 10 10 CECE C[C@@H]1CNCCN([C@H](C)c2ccc(F)cc2O)C1 385309978 VFZYSZRAFFHXAD-GHMZBOCLSA-N 252.333 2.134 10 10 CECE CC1(C)CC[C@H]1NC(=O)CCOc1ccc(N)cc1 389416964 MQGJEOPTSSOIGL-CYBMUJFWSA-N 262.353 2.343 10 10 CECE C[C@H](NCc1ccnc(O)c1)c1cc(O)ccc1O 392765147 SFMNHGNSZKADKT-VIFPVBQESA-N 260.293 2.049 10 10 CECE Oc1cccc(Br)c1CN[C@H]1CC12CC(O)C2 725002377 VCNNEWGQSDPDAV-CXJYDNQRSA-N 298.180 2.158 10 10 CECE CC1(C)C[C@@H](O)CCN(C(=O)Nc2ccc(N)cc2)C1 395430261 FIMQOLKHBWQNGA-ZDUSSCGKSA-N 277.368 2.284 10 10 CECE CCNCc1ccc(N2C[C@H](O)CC[C@H]2C)c(C)c1 399325958 LJDXXEZWPFZWEW-UKRRQHHQSA-N 262.397 2.454 10 10 CECE COc1cccc(O)c1CNCC[C@H]1CCCO1 886315516 QBNSACOAXQWZBV-LLVKDONJSA-N 251.326 2.060 10 10 CECE CCO[C@@H]1CC[C@H]([C@@H](NN)c2ccc(N(C)C)cc2)C1 2174832737 OFMHFRFGQXGGNM-IMJJTQAJSA-N 277.412 2.462 10 10 CECE CO[C@@H]1CC(CN(C)c2ccc(CO)cc2)C[C@H]1OC 2174859229 SKEXGJIMVJAVAV-HZPDHXFCSA-N 279.380 2.055 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@@H]2CO[C@@]3(CCOC3)C2)cc1 2179019248 MIENBOUKETZQAM-KCXAZCMYSA-N 277.364 2.124 10 10 CECE CN1CCCc2cc([C@H](N)C3(O)CC(CF)C3)ccc21 2174964757 FSPVYXMXZLFHLC-AJQRCPHMSA-N 278.371 2.179 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@@H](O)C1CCCC1 2167583558 KGMXNCHEOFCRII-MRXNPFEDSA-N 278.396 2.131 10 10 CECE COc1nn(C)cc1CN(C)c1ccc([C@H](C)O)cc1 2167966636 NMUPDDJYKJKPRQ-NSHDSACASA-N 275.352 2.118 10 10 CECE Cc1cc(N)c(NCCc2ccc(O)c(O)c2)nc1C 2181740138 WOUKEMMESQKIBO-UHFFFAOYSA-N 273.336 2.346 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1CC[C@@H](O)CC1 895511743 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COc1cccc(CNC[C@@]23CC[C@@H](C2)[C@@H](C)O3)c1O 2198687034 LEPDWHQINNOZIS-BFQNTYOBSA-N 277.364 2.448 10 10 CECE CCN[C@@H]1CCc2cc(N3CC[C@H](CO)[C@H]3C)ccc21 2184729207 GVFXLOMVESGAHF-SUYBPPKGSA-N 274.408 2.491 10 10 CECE CCN[C@@H]1CCc2cc(N3CC4(CN(C)C4)C3)ccc21 2184727960 SUULLDGOECAVFW-MRXNPFEDSA-N 271.408 2.035 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H](O)C3(CCC3)C2)c(F)c1 2194709114 LKYCBBWSZGCRTC-ZANVPECISA-N 282.334 2.336 10 10 CECE C[C@@H]1C[C@H](F)CN1CCCOc1ccc(N)cc1 2042198660 QPZOVZLBBGKLSG-NEPJUHHUSA-N 252.333 2.470 10 10 CECE N[C@@H](c1ccccc1O)c1ncoc1C(F)(F)F 2042242046 BCIYQNNYWQWQLR-QMMMGPOBSA-N 258.199 2.447 10 10 CECE CCN(Cc1c(O)cccc1F)C[C@H]1CCCN1 2042632735 KGBMJISKUNOFCA-LLVKDONJSA-N 252.333 2.105 10 10 CECE CN(C)c1ccc([C@@H](NN)c2cc(Cl)ns2)cc1 2048317808 PVXNXLLJXGPZSW-GFCCVEGCSA-N 282.800 2.415 10 10 CECE COCCOCCCN(C)c1ccc([C@@H](C)O)cc1F 2186326931 GPEOUXGTTNPPFJ-GFCCVEGCSA-N 285.359 2.368 10 10 CECE CC[C@](C)(CN(C)c1ccc(CO)cc1[N+](=O)[O-])OC 2186330880 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XOTHBOCUBBPEFR-UHFFFAOYSA-N 266.251 2.042 10 10 CECE CO[C@]1(CN(C)c2ccc(CO)cc2F)CCSC1 2129655285 AXCIWTGSVUUHNI-AWEZNQCLSA-N 285.384 2.276 10 10 CECE Cc1cc(Oc2ccc(N)cc2)c(C(N)=O)c(C)n1 211417283 DXCMDMWHLVIVFY-UHFFFAOYSA-N 257.293 2.172 10 10 CECE CO[C@H]1CN([C@H](C)c2ccccc2O)CC[C@H]1OC 2134859484 JQQYLIFRGRTLEP-DFBGVHRSSA-N 265.353 2.189 10 10 CECE NCCC1CN(Cc2c(O)ccc3ccccc23)C1 2134809271 NCLGHRLGDRASCL-UHFFFAOYSA-N 256.349 2.326 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)C2C[C@@H]3[C@@H](C2)C3(F)F)C1 1912189835 WNJVZWIUGXRAHZ-FXBDTBDDSA-N 270.283 2.437 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1 1912192507 GWOJYCAPIPZIIE-OCCSQVGLSA-N 278.356 2.495 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)[C@H]2C(F)(F)C23CC3)C1 1912205419 OUKPDRNNPNCSGV-HTQZYQBOSA-N 256.256 2.191 10 10 CECE CCC[C@@H](C)N(C)C[C@@H](O)COc1ccc(N)cc1 218293890 WPODANUZOWQQQW-TZMCWYRMSA-N 266.385 2.129 10 10 CECE CC(C)[C@@H]1C[C@H]1C(=O)NCCOc1ccc(N)cc1 2135341795 ILMYLYDDBXTCBQ-UONOGXRCSA-N 262.353 2.056 10 10 CECE CO[C@@H]1CCN(c2ccc([C@@H](C)O)cc2F)[C@H]1C 1914235787 HDWRLRCDYSNFNN-IMSIIYSGSA-N 253.317 2.493 10 10 CECE CN1CCc2c1cc(O)c1c2[C@@H](CC(=O)O)CCCO1 212283791 WTYMXTQWKPOVPR-SECBINFHSA-N 277.320 2.115 10 10 CECE CCN1CCN(c2c(F)cc(CNC)cc2F)C[C@@H]1C 110730642 BFMPOWMSIACZGP-NSHDSACASA-N 283.366 2.215 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCC[C@@H]2C[C@@H]21 1917104591 GEQAQMOSIHMXFQ-WDMOLILDSA-N 259.353 2.080 10 10 CECE CNC(=O)Oc1cccc(NC(=O)c2cc(O)cs2)c1 1468371392 SHQSDQUUZXEZMS-UHFFFAOYSA-N 292.316 2.424 10 10 CECE CN(C)[C@H]1CCC[C@H]1NCc1cccc(F)c1O 1922033436 LJBOISCJNLFYLO-OLZOCXBDSA-N 252.333 2.104 10 10 CECE CN(C)[C@@H]1CCCC[C@@H]1NCc1cccc(F)c1O 1922028560 XGSKXQXCMTUJDE-UONOGXRCSA-N 266.360 2.494 10 10 CECE COc1ccc(N2CC[C@@H]3NCC[C@@H]3C2)c(F)c1F 2136980679 VJTBMTFBEJEELJ-ZJUUUORDSA-N 268.307 2.162 10 10 CECE COc1ccc(N2CC[C@H](C3CNC3)C2)c(F)c1F 2136980973 WSMACZPMRKLSKT-VIFPVBQESA-N 268.307 2.019 10 10 CECE Oc1ccc(Br)cc1CN1CC[C@]2(CCN2)C1 1922971337 PADMHQWGXALUPT-CYBMUJFWSA-N 297.196 2.093 10 10 CECE Cc1cc(OCc2ccc(N)cc2)ccc1C(N)=O 1924908607 ZXONLVONTOCLLN-UHFFFAOYSA-N 256.305 2.255 10 10 CECE COc1ccc([C@H](C)NC[C@](C)(O)CSC)c(O)c1 230662854 CYWVOAYTVXUGIT-HZMBPMFUSA-N 285.409 2.165 10 10 CECE O=C(Cc1ccsc1)NCc1c(O)cccc1O 1652623633 YCMYUQPTBGDLTE-UHFFFAOYSA-N 263.318 2.018 10 10 CECE CCCN(CCOCCCOC)c1ccc(CN)cc1 232213121 XHKVPVWGSWEINM-UHFFFAOYSA-N 280.412 2.415 10 10 CECE CCCN(CCc1nnc(N)s1)Cc1ccccc1O 161531089 HKEYUQDCGROELG-UHFFFAOYSA-N 292.408 2.281 10 10 CECE COc1cc(Cl)cc(CNC(C)(C)[C@@H](C)O)c1O 169093619 HVVOTTNICVDQKZ-MRVPVSSYSA-N 273.760 2.303 10 10 CECE CCN(CC)c1ccc([C@H]2NN=C3CCNC[C@@H]32)cc1 169971604 YHKMTIXLBIJSLH-GOEBONIOSA-N 272.396 2.143 10 10 CECE CCc1nsc(Sc2ncc(CN)s2)n1 1934273839 QIHGMSKQHGSVHG-UHFFFAOYSA-N 258.397 2.167 10 10 CECE C[C@@H](C(=O)N(C)Cc1ccccc1O)C1CCOCC1 156821924 HNFBHGBFTQUHQN-GFCCVEGCSA-N 277.364 2.413 10 10 CECE COc1cc(C)c(N(C)CC(C)(C)N)c(OC)c1 258819212 LHFIKMDUFAYXKC-UHFFFAOYSA-N 252.358 2.186 10 10 CECE CC[C@H]1CCN(Cc2cc(F)ccc2O)[C@@H](CN)C1 234127619 SHAJRNYOSVLYDK-SMDDNHRTSA-N 266.360 2.481 10 10 CECE CNCc1ccc(N2Cc3cncnc3C2)c(C)c1 2141284151 SOOOIGOYQPJKEF-UHFFFAOYSA-N 254.337 2.025 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1c(O)cccc1F 234301886 DRSYUPCTLSNHFL-UHFFFAOYSA-N 274.295 2.386 10 10 CECE CC[C@@H](C)CS(=O)(=O)CCOc1ccc(N)cc1 233851709 AJZDPAHMJLPQPX-LLVKDONJSA-N 271.382 2.109 10 10 CECE COc1ccc([C@H](C)NCc2ccncn2)c(O)c1 234972214 PDXNDFSKYDUVIV-JTQLQIEISA-N 259.309 2.042 10 10 CECE CN(C)c1ccc2c(c1)CCN2CCc1ccnn1C 2143379431 PYRXZULXTHHWTL-UHFFFAOYSA-N 270.380 2.091 10 10 CECE C[C@H](N[C@H](C)C1CSC1)c1c(O)cccc1O 1942244118 QEPRDOMQIBBPGY-BDAKNGLRSA-N 253.367 2.500 10 10 CECE COc1cc([C@@](C)(N)c2ccccc2O)sn1 1942396795 YOBWPTSBQFYYGT-LBPRGKRZSA-N 250.323 2.080 10 10 CECE COc1cccc(CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c1O 873157172 SQCNVBCXDZJCIL-UBHSHLNASA-N 277.364 2.448 10 10 CECE COC(=O)NCCCN[C@H](C)c1cc(C)ccc1O 1875637809 UXOSJUCRUAHPIV-LLVKDONJSA-N 266.341 2.097 10 10 CECE C[C@H](NCc1ccc(F)c(F)c1O)[C@@H](O)C(F)(F)F 877693554 KAFNWSKXQCVJTO-XUOSJQGZSA-N 285.212 2.072 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC=CC[C@@H]2CO)c1O 1875744592 SPLWJZAZRLQUBY-CYBMUJFWSA-N 295.766 2.371 10 10 CECE Nc1ccc(NC(=O)NCc2ccccc2N)cc1 1876137458 RUIPDSLZASSDPN-UHFFFAOYSA-N 256.309 2.173 10 10 CECE Nc1ccc(CNc2c(N)cccc2C(=O)O)cc1 1876476348 XTBLMHDLYJGQAP-UHFFFAOYSA-N 257.293 2.161 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C(F)F)[C@@H]3C2)cc1O 1877076300 LUIXMVIBMNYRME-DRYIUFOISA-N 269.291 2.393 10 10 CECE N[C@@H]1CCC2(CCC2)N(Cc2cc(F)ccc2O)C1 1878997478 ADSUSZLFYOTKGD-CYBMUJFWSA-N 264.344 2.377 10 10 CECE C[C@H](NC[C@]12C[C@H](CCO1)C2)c1c(O)cccc1O 1879279774 DBOSJFHZYSFSIL-ZIBATOQPSA-N 263.337 2.318 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](O)[C@H](C)C2)c(F)c1 1880482026 LQQVBINKLGNCHN-ZDMBXUJBSA-N 271.307 2.225 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCCN(C)CC2)c(F)c1 1880484499 GDMHXKWFPVLAAU-SNVBAGLBSA-N 270.323 2.160 10 10 CECE C[C@@H](CC(=O)N(C)CCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1885557585 RDAQJHQEAQYDGP-JTQLQIEISA-N 299.375 2.449 10 10 CECE CC[C@@H](c1ccccc1O)N1CC([C@@H]2CCNC2)C1 1886868478 VXUKYVTWSYNGJQ-DOMZBBRYSA-N 260.381 2.385 10 10 CECE C[C@H]1CCC[C@]1(N)C(=O)N(C)[C@H](C)c1ccccc1O 2149449610 MWIMHBZXTQBRAB-HWWQOWPSSA-N 276.380 2.429 10 10 CECE CN(C)C1(CNCc2ccc(O)c(O)c2)CCCCC1 20094538 MXZPBILVQTZALG-UHFFFAOYSA-N 278.396 2.452 10 10 CECE CCOc1ccccc1NC[C@H](O)C[C@@H]1CCCO1 1964698895 RJKSSHUKDZLJDC-OLZOCXBDSA-N 265.353 2.427 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@@H](COC)[C@@H]3C2)c(F)c1 2149558862 YILDQHRLMVEAGF-BFHYXJOUSA-N 278.371 2.264 10 10 CECE C[C@@H]1C[C@@H]1C[C@H](N)[C@H](O)c1ccc2c(c1)CCCN2C 2147889324 QBBNINWOMQATNP-FIUQPQMISA-N 274.408 2.476 10 10 CECE CN(C)c1ccc(CN2CC[C@H](N)C3(CCC3)C2)cc1 1968001626 ODBDMXORMNEHPU-INIZCTEOSA-N 273.424 2.456 10 10 CECE C[C@@H]1CCCN(Cc2ccc(F)cc2O)[C@@H]1C(=O)O 1968129880 OKRRJQOHPNHILM-RNCFNFMXSA-N 267.300 2.216 10 10 CECE COc1cc2c(cc1OC)N(Cc1ccno1)CC2 1970282184 RPHMPKUCODZLIA-UHFFFAOYSA-N 260.293 2.255 10 10 CECE Cc1nc(CCNCc2ccc(F)c(F)c2O)co1 1970394020 DPMBUQOJVMYZHY-UHFFFAOYSA-N 268.263 2.299 10 10 CECE Oc1cc2c(cc1CNCC1(F)CCCC1)OCO2 1972329960 IAKTVELDQGNSNF-UHFFFAOYSA-N 267.300 2.493 10 10 CECE O=C(O)[C@H](NCc1cc(F)ccc1O)C1CC(F)(F)C1 1973070945 HPPAETKAYFNICP-LLVKDONJSA-N 289.253 2.119 10 10 CECE CSc1ccc(C)c(O)c1[C@@H]1C[C@@H](CN)CN1C 258528890 KOVJYIDCCFFROP-QWRGUYRKSA-N 266.410 2.374 10 10 CECE Oc1ccc(Br)cc1CN1CCN[C@H]2CC[C@H]21 2002922319 ZNUWKSLRFWBEDY-NWDGAFQWSA-N 297.196 2.091 10 10 CECE O=S(=O)(Nc1ccc(O)cc1Cl)[C@H]1CC1(F)F 2003142509 SEAFLFCLPKEFKU-QMMMGPOBSA-N 283.683 2.195 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C)[C@@H]2C(=O)N(C)C)cc1 2146458226 WVIQSYOOVLOVDK-LALPHHSUSA-N 275.396 2.009 10 10 CECE NCc1ccc(N2CCN(c3nccs3)CC2)cc1F 160480931 RASXOPYIWMSBJO-UHFFFAOYSA-N 292.383 2.068 10 10 CECE C[C@H](N)c1ccc(N(C)CC2(O)CCCC2)cc1O 161729651 SYOJHDXLXSPSLU-NSHDSACASA-N 264.369 2.153 10 10 CECE CCCN[C@@H](C)c1ccc2c(c1)CCCN2CCO 162272796 UXAQNICSTIUKHN-ZDUSSCGKSA-N 262.397 2.492 10 10 CECE C[C@H](O)c1ccc(N(C)CC(C)(C)CO)c([N+](=O)[O-])c1 2150982801 VCBTYJKREOJLGE-JTQLQIEISA-N 282.340 2.103 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(C)C[C@@H]2CO)cc1O 2151112510 JYAYIRGCNLPDJJ-WCQYABFASA-N 278.396 2.270 10 10 CECE CC(C)NCc1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)c(F)c1 2151394756 YOPVTSILCODZSQ-ZENOOKHLSA-N 278.371 2.141 10 10 CECE CCc1nc(CCN[C@@H](C)c2cc(F)ccc2O)no1 273524746 VBQDNKFVDBURGX-VIFPVBQESA-N 279.315 2.370 10 10 CECE C[C@H]1CCO[C@@H]1CN1CCOc2cc(N(C)C)ccc21 2152450747 YIANBWGMWXHBJH-BLLLJJGKSA-N 276.380 2.376 10 10 CECE C[C@@H]1CN(CCCC(=O)Nc2ccc(N)cc2)C[C@H]1F 2152802673 GVRMHGBRWAGQDM-BXUZGUMPSA-N 279.359 2.277 10 10 CECE Oc1ccc(CN[C@@H](CF)C(F)(F)F)c(O)c1 2012901742 LCWKLPJEIYIKSF-VIFPVBQESA-N 253.195 2.088 10 10 CECE CCCc1nnc(CN2CC[C@H](N=[N+]=[N-])C2)s1 2013585907 SCSAHXQVHFQILZ-QMMMGPOBSA-N 252.347 2.375 10 10 CECE Nc1ccc(CCC(=O)OCCCn2ccnc2)cc1 49329159 PWGHRIUFWKCSTP-UHFFFAOYSA-N 273.336 2.031 10 10 CECE C[C@H]1CNC[C@@H](C)CN(c2ccc3c(c2)OCO3)C1 49665600 JNIAPSYCBCBFCD-TXEJJXNPSA-N 262.353 2.097 10 10 CECE CC(C)n1nncc1[C@](C)(N)c1ccc(N(C)C)cc1 2154709945 GBBWHURIXCUHID-OAHLLOKOSA-N 273.384 2.147 10 10 CECE CCCNCc1ccc(OC[C@@H]2CCC(=O)N2)c(C)c1 2155018917 LHFZSJTWSFYXAL-AWEZNQCLSA-N 276.380 2.152 10 10 CECE N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(Cl)cc1O)C2 2029641042 IWCSKNNAOQQLHJ-XDTLVQLUSA-N 266.772 2.357 10 10 CECE C[C@H]1CCNCCN1[C@H](C)c1cc(F)ccc1O 2035798946 IGCCOHSGEMFADE-WDEREUQCSA-N 252.333 2.276 10 10 CECE CCN(CC)[S@@](=N)(=O)N(C)Cc1ccccc1O 2036691198 CTFDFLXYLUDATF-SFHVURJKSA-N 271.386 2.043 10 10 CECE CC(C)N1CC[C@@H](CN[C@H](C)c2c(O)cccc2O)C1 300437468 UZTXGKAKRFWCIL-OLZOCXBDSA-N 278.396 2.479 10 10 CECE CCN(CCCCO)c1c(F)cc(CN)cc1F 2041183474 IQJXJLOPKXFIBZ-UHFFFAOYSA-N 258.312 2.022 10 10 CECE C[C@@H]1CC[C@H](N[C@H](C)c2cc(O)ccc2O)CO1 402041334 IUJFLZSRUBOPQZ-MXWKQRLJSA-N 251.326 2.316 10 10 CECE CN[C@H](C)c1ccc(N2CCN(C(C)=O)CC2)cc1Cl 78902575 UVONYIROYWHMBN-LLVKDONJSA-N 295.814 2.289 10 10 CECE 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10 10 CECE CCOC(=O)C1=NN(c2ccc(C)c(Cl)c2)C(=O)C1 2098463323 JTDBHULIYGQSHG-UHFFFAOYSA-N 280.711 2.304 10 10 CECE COc1cc2c(cc1OC)N([C@H](C)C[C@H](C)O)CC2 2098649949 XZRJTQRMUXAUNU-MNOVXSKESA-N 265.353 2.226 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@H]3CC[C@H]2C3)cc1 2112506688 SCJJWFFUOZDAHM-RISCZKNCSA-N 259.353 2.082 10 10 CECE CC[C@H](C)N1CC(NCc2ccc(F)c(F)c2O)C1 2112998081 JRFJVCJIGQKMQI-VIFPVBQESA-N 270.323 2.243 10 10 CECE Cc1cc(CN)ccc1N1CCc2ccn(C)c2C1 2114537723 KGFABRMIBBHXJA-UHFFFAOYSA-N 255.365 2.355 10 10 CECE CNCc1ccc(N2C[C@@H](C)CC[C@@H]2CO)cc1OC 2204557797 USJQENHDDIAUTQ-SWLSCSKDSA-N 278.396 2.012 10 10 CECE Cc1ccc(CN2C[C@H]3CC[C@H]2[C@@H]2CNC[C@H]32)c(O)c1 2204639944 STNFQDGTCGVWQO-MIGQKNRLSA-N 272.392 2.130 10 10 CECE COc1ccc(N2CC[C@@H](SC)C2)c(CO)c1 2214862247 NEAAAPKRSLCUKD-GFCCVEGCSA-N 253.367 2.129 10 10 CECE CCCN(CC)C1CN(c2c(F)cc(CO)cc2F)C1 2206080496 BICDGEVNEAAGNE-UHFFFAOYSA-N 284.350 2.378 10 10 CECE CO[C@@H]1[C@@H](NC(=O)Nc2ccc(N)cc2)CC12CCC2 2206703336 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CECE CN(Cc1ccccc1O)C(=O)CC12CCC(CC1)N2 713567429 NJNNLMGTOLZLBV-UHFFFAOYSA-N 274.364 2.025 10 10 CECE COc1ccc(O)c([C@H](C)NCCc2cc[nH]n2)c1 714502076 SNPSRPQNCXRIMA-JTQLQIEISA-N 261.325 2.017 10 10 CECE C[C@@]1(CO)CCCN(c2ccc(CN)cc2Cl)C1 688667746 NQFHEZCKHYEGJX-CQSZACIVSA-N 268.788 2.398 10 10 CECE COC(=O)N(C)CCN(C)c1ccc([C@H](C)N)c(Cl)c1 690799943 UTZPDNUSVASTRH-JTQLQIEISA-N 299.802 2.494 10 10 CECE CCO[C@H]1C[C@@H]1C(=O)N(Cc1ccc(N)cc1)C1CC1 689898908 JYRMGBSUSNZSRG-GJZGRUSLSA-N 274.364 2.185 10 10 CECE CN(C[C@@H](O)C1CC1)c1ccc(CNC2CC2)cc1 690257314 GOCVMBJAQPRNNL-MRXNPFEDSA-N 260.381 2.146 10 10 CECE NCc1ccc(N2CCC[C@@H]3COC[C@@H]32)cc1Cl 690293188 KNJAQENKBIDGQB-RISCZKNCSA-N 266.772 2.414 10 10 CECE CNCc1ccc(N2CC[C@@H]3COC[C@H]3C2)cc1C 690282775 AGBCLPGBEHLLNH-HUUCEWRRSA-N 260.381 2.187 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3COC[C@@H]3C2)cc1 690293027 VDDHXTDTOBLWHW-SNPRPXQTSA-N 260.381 2.440 10 10 CECE CNc1nc(Cl)nc(Sc2nccs2)n1 87851079 XHNLAGVLMJRZHK-UHFFFAOYSA-N 259.747 2.174 10 10 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CECE CCO[C@@]1(C)C[C@@H]1NC(=O)NCc1cccc(Cl)c1O 1615553806 NXKFEFLOLFTASQ-FZMZJTMJSA-N 298.770 2.412 10 10 CECE CCn1nc(C)c([C@](C)(N)c2ccccc2O)c1C 1920485768 CMIKTNCRAAPSAY-OAHLLOKOSA-N 259.353 2.448 10 10 CECE COc1ccc(N2CCC[C@H]3NCC[C@H]32)c(F)c1F 2136976598 KIWGMRDZTCKKBC-NXEZZACHSA-N 268.307 2.304 10 10 CECE NC(=O)Cc1ccccc1NCc1cc(F)ccc1O 226581264 GAHVWLSAHZMHBR-UHFFFAOYSA-N 274.295 2.171 10 10 CECE CC(=O)c1cc(F)cc(CN(C)Cc2ccn(C)n2)c1O 1620663068 RVENUWHYZIKZKJ-UHFFFAOYSA-N 291.326 2.099 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1C[C@H]2CCCC[C@H]2C1 1627855663 DWFIUFDSUYVMSX-BETUJISGSA-N 275.348 2.289 10 10 CECE Cc1cnc(CNC(=O)c2ccc(N=NC(N)=O)cc2)o1 1628736390 CQKMSOLOFVRCPF-UHFFFAOYSA-N 287.279 2.075 10 10 CECE C[C@@H](C(=O)NCc1ccccc1O)c1ccncc1 1636058149 SGICZJIKTKHMAL-LLVKDONJSA-N 256.305 2.207 10 10 CECE CN(C)[C@@H]1CCC[C@@H]1CNCc1cc(F)ccc1O 1924651814 LIPOFXYHLMUXQN-BXUZGUMPSA-N 266.360 2.351 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H](O)[C@@H](C)C2)cc1 229403511 PGWRGKUISFIRKM-XJKSGUPXSA-N 262.397 2.392 10 10 CECE CN(C)c1ccc(Cn2cc([N+](=O)[O-])cc(F)c2=O)cc1 1641226073 KQSCZEWOWKPMJG-UHFFFAOYSA-N 291.282 2.010 10 10 CECE CCCNCc1ccc(N(C)[C@H](C)CO)cc1OC 2139687530 ZMPNOLOMSKRBLG-GFCCVEGCSA-N 266.385 2.012 10 10 CECE COc1cc(N(C)C[C@@H]2CCCOC2)ccc1CN 2139688771 SOUWFEDDGYFXLU-LBPRGKRZSA-N 264.369 2.017 10 10 CECE COC1(C(=O)NCc2cccc(C)c2O)CCCC1 2139745474 IIGDQRJRLUOHHY-UHFFFAOYSA-N 263.337 2.276 10 10 CECE CCN1[C@@H](C)CN(Cc2ccc(F)cc2O)C[C@H]1C 2139795442 BXHLLMNUXZSMDC-TXEJJXNPSA-N 266.360 2.446 10 10 CECE CC(C)N(CCO)c1ccc(CN)cc1Br 169177117 ZMQCOAMLDODIMY-UHFFFAOYSA-N 287.201 2.115 10 10 CECE CC(C)S(=O)(=O)CCN(Cc1ccc(N)cc1)C1CC1 232723431 HIFQLFMLJVBLEB-UHFFFAOYSA-N 296.436 2.056 10 10 CECE CC[C@@H](CSC)N(C)C(=O)Cc1ccc(N)cc1 167065553 RHPQAVWHCIBQKW-ZDUSSCGKSA-N 266.410 2.411 10 10 CECE COc1ccc(N2C[C@@]3(N)CCC[C@@]3(F)C2)cc1C 2141640959 XYRNVGBNHJUULP-CABCVRRESA-N 264.344 2.413 10 10 CECE CCS[C@@H]1CCC[C@H]1NC(=O)COc1ccc(N)cc1 233825031 AYPALJMMQUXYMN-ZIAGYGMSSA-N 294.420 2.438 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)CC(C)(C)F 1940800956 LSNNGHLVKOEBHK-UHFFFAOYSA-N 261.318 2.190 10 10 CECE C[C@H](N)c1ccc(N2CCC([C@@H](C)O)CC2)cc1O 235350811 SOUJVJNQHHPQGE-WDEREUQCSA-N 264.369 2.009 10 10 CECE C[C@H](NC(=O)C[C@@H]1CCC[C@H]1N)c1ccccc1O 870987765 DAHAMODLMJZLMY-GMXVVIOVSA-N 262.353 2.087 10 10 CECE Oc1cccc(F)c1CNC[C@@H]1C[C@@H]2C[C@H]2CO1 1875658820 AZKGNWVXMPAAEI-DCAQKATOSA-N 251.301 2.046 10 10 CECE O=C(O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1NCc1ccc(Cl)cc1O 1876098657 AKGFUNOPQCFZRT-KKOKHZNYSA-N 281.739 2.244 10 10 CECE C[C@H](Nc1cc(=O)c(Cl)nn1C)c1ccccc1O 1877578104 IPMPYTBYNOMDOS-QMMMGPOBSA-N 279.727 2.312 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)C[C@H]2CCOC2)c(F)c1 1880929456 UOVZWEWMFKHRAA-NXEZZACHSA-N 270.323 2.457 10 10 CECE C[C@H](CC(=O)NCCN=[N+]=[N-])N(C)C(=O)OC(C)(C)C 1882298494 SAWHOFXYHWMXFN-SECBINFHSA-N 285.348 2.058 10 10 CECE C[C@H](O)[C@@H](N[C@@H]1CCc2cccc(O)c21)C(F)(F)F 1882704145 FVVGMNMAYSZBHS-LPBBDHJYSA-N 275.270 2.281 10 10 CECE CN(CC[C@@H]1CCOC1)c1c(F)cc(CO)cc1F 1885681950 BUNATQNDTVGSDV-SNVBAGLBSA-N 271.307 2.320 10 10 CECE CC1(C(=O)NCCc2ccc(N)cc2)CC(F)C1 1966887028 MRJGKUSLDZMOAS-UHFFFAOYSA-N 250.317 2.066 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)C[C@H]2CCS(=O)(=O)C2)c1 2148787337 MSZYLPYJGPVGON-CHWSQXEVSA-N 297.420 2.128 10 10 CECE CC[C@H](N[C@@H](C)[C@H]1COCCO1)c1ccccc1O 1967586685 PLFBKBMDSWGCJT-CORIIIEPSA-N 265.353 2.237 10 10 CECE CO[C@H](CN(C)c1ccc(N)cc1)[C@H]1CCCOC1 1967628849 ODBXWKKEOGBKOS-SWLSCSKDSA-N 264.369 2.147 10 10 CECE COc1cc(Cl)cc(CNCCN2C[C@@H]3C[C@H]3C2)c1O 1967784743 NLHMEIGIBUERCM-RYUDHWBXSA-N 296.798 2.096 10 10 CECE COc1cccc(CN2C[C@@H](OC)C(C)(C)C2)c1O 1967789413 DVRIHMOBBJEABN-CYBMUJFWSA-N 265.353 2.258 10 10 CECE C[C@H]1CN(c2ccc(CN)cc2C(F)(F)F)CC[C@@H]1O 166491020 MTPLDFXTPXVJJV-ZANVPECISA-N 288.313 2.371 10 10 CECE CC[C@H](NC[C@@H]1CC[C@@H](CO)CO1)c1ccccc1O 1969540174 UUERKUYUEJYSPK-YDHLFZDLSA-N 279.380 2.220 10 10 CECE COC(=O)N[C@H]1CCN([C@H](C)c2cc(F)ccc2O)C1 252798177 NBXZSLCGGLUGMQ-KOLCDFICSA-N 282.315 2.023 10 10 CECE COc1ccc(O)c([C@@H](C)N2CC(C)(C)[C@@H]2C(=O)O)c1 2148965350 OXYKMZAFPYLDHK-RNCFNFMXSA-N 279.336 2.257 10 10 CECE Nc1ccc(CNc2cccnc2-n2cccn2)cc1 2148941881 QTGKROUXQPZMDC-UHFFFAOYSA-N 265.320 2.462 10 10 CECE Nc1ccc(OCCC(=O)N2CCC[C@H]3CC[C@H]32)cc1 2151786343 SWRCLFXPMPXKTC-SWLSCSKDSA-N 274.364 2.439 10 10 CECE Cc1cccc(CNC2CC3(CC(CN)C3)C2)c1O 1974068092 DMXTYRZEFDYDAO-UHFFFAOYSA-N 260.381 2.308 10 10 CECE CP1(=O)CCN(c2ccc(CN)cc2F)CC1 2004550975 RUPOUUPUTGQZAI-UHFFFAOYSA-N 256.261 2.097 10 10 CECE Cc1ccnc(Sc2ncc([C@H](C)N)s2)n1 1976520165 UMPWIFOOHPAMSE-ZETCQYMHSA-N 252.368 2.412 10 10 CECE O[C@@H]1CN(c2ccc(CNC3CC3)cc2)C[C@@H]1C1CC1 2146826039 KEFAVXDGVZGJNK-IAGOWNOFSA-N 272.392 2.146 10 10 CECE Nc1ccc(NC(=O)CCN2C[C@H]3CCC[C@H]3C2)cc1 157968284 BYZZINKWEYWKSU-BETUJISGSA-N 273.380 2.329 10 10 CECE CO[C@H]1C[C@@H]1CNCc1c(O)cccc1Br 1987749576 GGLLGSVSYWCANX-PELKAZGASA-N 286.169 2.279 10 10 CECE OCc1ccc(N2C[C@@H](O)C(F)(F)C2)cc1C(F)(F)F 2152095230 ZAWPGTPMEHFPKA-SNVBAGLBSA-N 297.223 2.014 10 10 CECE CN1CCCc2cc(CN[C@]3(C)CCOC3)ccc21 161668549 LEWZJDVWKFYGMM-MRXNPFEDSA-N 260.381 2.338 10 10 CECE C[C@]1(F)CCCN(CCC(=O)Nc2ccc(N)cc2)C1 2152236515 BDLZICAZGGUZHZ-HNNXBMFYSA-N 279.359 2.421 10 10 CECE Cc1ccc([C@@H](C)NC(=O)COc2ccc(N)cc2)o1 40345983 LXNLYKYRIGTWJA-LLVKDONJSA-N 274.320 2.426 10 10 CECE CO[C@H]1CCCN(c2cc3c(cc2N)OCCO3)[C@@H]1C 2155358847 VOGAJZXKSODHBV-MFKMUULPSA-N 278.352 2.044 10 10 CECE CCN(CC)C[C@H](C)N[C@H](C)c1cc(O)ccc1O 45690398 RDLYNTZVUCGLBJ-NWDGAFQWSA-N 266.385 2.479 10 10 CECE CC(F)(F)[C@@H]1CCN(C(=O)COc2ccc(N)cc2)C1 2160141257 YMQALGWPRJFIEH-SNVBAGLBSA-N 284.306 2.151 10 10 CECE C[C@@H]1C[C@H](N(C)Cc2ccc(F)cc2O)CCN1C 295265906 HGEMYQRFCFHKAK-BXUZGUMPSA-N 266.360 2.446 10 10 CECE C[C@H](NCc1ccc(O)c(O)c1O)[C@@H]1CCSC1 2029412444 YCDZFPSANKFUNF-WCBMZHEXSA-N 269.366 2.035 10 10 CECE CC[C@H](CCNCc1cccc(O)c1O)COC 2034911853 VMIUZUXIJNDGQR-LLVKDONJSA-N 253.342 2.250 10 10 CECE CCCNCc1ccc(N2CC[C@H](N(C)C)C2)cc1 62967100 HEVXFHBSMLZLBD-INIZCTEOSA-N 261.413 2.327 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@](C)(O)C2)cc1O 300169029 OAVLTFAGVUBWKP-LRDDRELGSA-N 278.396 2.414 10 10 CECE C[C@H]1CCN(Cc2ccc3c(c2)CCN3C)[C@H](CN)C1 300173551 AWWASJBBIUZRIT-BBRMVZONSA-N 273.424 2.238 10 10 CECE CC[C@@](O)(CN1CC[C@@H](CN=[N+]=[N-])C1)C(F)(F)F 2038039522 USWIZWGUECQIHV-DTWKUNHWSA-N 266.267 2.322 10 10 CECE C[C@H](N[C@H]1CCO[C@H]1C1CC1)c1ccc(O)cc1O 300644322 ONMIDFPNLWCVDY-FGEZKYSXSA-N 263.337 2.316 10 10 CECE COc1ccc(O)c(CN2CC[C@@H](C)[C@@H](OC)C2)c1 188313556 IIFNLQJEAYOHQA-ABAIWWIYSA-N 265.353 2.258 10 10 CECE C[C@H](NC[C@@H]1CO[C@H](C)C1)c1cc(O)ccc1O 2040302289 OABCDPZFYDUQJF-OUAUKWLOSA-N 251.326 2.173 10 10 CECE CNCc1ccc(OC)c(CN(C)[C@H]2CCCOC2)c1 401491665 AVHCQFREKBFZNW-HNNXBMFYSA-N 278.396 2.025 10 10 CECE COc1ccc([C@H](C)N[C@@H]2CO[C@@H](C)C2)c(O)c1 402259701 BQQGFOFSPXRNFX-DCAQKATOSA-N 251.326 2.229 10 10 CECE COC(=O)C[C@H](C)N[C@@H](C)c1cc(C)ccc1O 310853151 MGMHJMWQRAEJQX-QWRGUYRKSA-N 251.326 2.303 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H]3CC[C@H](N)[C@H]3C2)c1 312730127 SHAKOWPDOLZUNJ-GVARAGBVSA-N 276.380 2.131 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@H]1CC[C@H](CO)CO1 2159027025 YKMMJJAOGINLLE-MGPQQGTHSA-N 279.380 2.173 10 10 CECE CC[C@H]1CCN(Cc2c(O)cccc2OC)[C@@H]1C(=O)O 2160724690 PBADZROHJXVRCQ-HZMBPMFUSA-N 279.336 2.086 10 10 CECE CC(=O)N(C1CCC1)[C@H](C(=O)O)c1c(C)cccc1O 2160783687 ZZUGKHSFGPBJNR-AWEZNQCLSA-N 277.320 2.227 10 10 CECE Cc1cccc(O)c1CN1C[C@@H]2[C@@H](C1)[C@H]1CC[C@H]2CN1 2160786439 RHOFSEPMCPWGNX-ARLBYUKCSA-N 272.392 2.130 10 10 CECE CCN(CC)Cc1noc(CCc2ccc(N)cc2)n1 327979824 ILKWKNWKLDCFTG-UHFFFAOYSA-N 274.368 2.279 10 10 CECE Cc1cc(N2CC[S@](=O)C[C@@H]2C)ccc1C=CC(=O)O 2171961557 BPPSCUALHCXDJI-YUNKPMOVSA-N 293.388 2.050 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1CCC(F)(F)[C@H]1C 2172041535 NSWVJLNQDWXCJW-NXEZZACHSA-N 283.322 2.325 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)OCCCO3)CCCN1 86269379 POWNWZCUGAUUKO-CYBMUJFWSA-N 276.380 2.426 10 10 CECE C[C@H](N[C@@H]1CC[C@@]12C[C@H]2C(=O)O)c1c(O)cccc1O 2172497292 NSFBCJMSFWRXHY-ZRPZLMRSSA-N 277.320 2.002 10 10 CECE CC1(C)CC[C@@H](CO)N(c2c(F)cc(CN)cc2F)C1 701627763 YBWOXFGKUMRJSK-NSHDSACASA-N 284.350 2.411 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)cc1 702321665 ABAGEHXDPJWNTH-XPKDYRNWSA-N 259.397 2.094 10 10 CECE CC(C)[C@](C)(O)CNCc1ccc(F)c(F)c1O 703377799 ILHYQQUNMOVUFV-CYBMUJFWSA-N 259.296 2.167 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2cnccn2)cc1O 704195404 BTFSAJJXSSWRPK-LLVKDONJSA-N 272.352 2.099 10 10 CECE CN1CCc2cc([C@H](O)C[C@H]3CNCC3(C)C)ccc21 2173039805 CHAVCXBMFYXAQL-GOEBONIOSA-N 274.408 2.348 10 10 CECE C[C@H]1[C@@H](C)NCCN1Cc1c(O)cccc1Br 706861302 GNUMIXKFKUCIMJ-ZJUUUORDSA-N 299.212 2.337 10 10 CECE CCN([C@@H](C)c1cc(F)ccc1O)[C@H](C)C(=O)O 707916073 CTHCSFPQWFDLFS-DTWKUNHWSA-N 255.289 2.387 10 10 CECE Oc1c(F)cc(F)cc1CNCc1ccccn1 708494708 OPQCOCDDOQNRFT-UHFFFAOYSA-N 250.248 2.355 10 10 CECE NCc1ccc(N2CCO[C@@H](C(F)(F)F)CC2)cc1 687573322 MGOQSAFYJWULQC-GFCCVEGCSA-N 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2.069 10 10 CECE CCC(O)(CC)CN(C)c1ccc(CO)cc1C 706389950 WNLKRGFSNLJILJ-UHFFFAOYSA-N 251.370 2.475 10 10 CECE CSC[C@@H]1CCN(Cc2cc(N)ccc2O)C1 706668614 YMFYTKZQDMTTKL-SNVBAGLBSA-N 252.383 2.159 10 10 CECE CN(Cc1c(O)cccc1Br)[C@H](CN)C1CC1 706867064 NDYYEOHJKXWYKR-GFCCVEGCSA-N 299.212 2.324 10 10 CECE CC[C@H](O)c1ccc(N(CC)CCS(C)(=O)=O)cc1 688507411 GWMWLFRRPNOZAY-AWEZNQCLSA-N 285.409 2.001 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(Cl)cnc1F 711603486 YJCPVDWZAGBPOA-UHFFFAOYSA-N 257.656 2.304 10 10 CECE CCN(Cc1ccc(N)cc1)Cc1ncc(C)cn1 692666235 LROYLPCBYPCHNZ-UHFFFAOYSA-N 256.353 2.389 10 10 CECE O=C(NC[C@]12CCCC[C@@H]1C2)c1cccc(O)c1O 693583765 YDGQBUJJLFFYKV-MEBBXXQBSA-N 261.321 2.408 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2CCCCS2(=O)=O)cc1 694144867 MHRLDGMYVKTZOJ-SWLSCSKDSA-N 297.420 2.143 10 10 CECE C[C@@H](N[C@H]1CN(C)C(C)(C)C1)c1c(O)cccc1O 694197351 QRQYLKHFASEYLC-GHMZBOCLSA-N 264.369 2.231 10 10 CECE C[C@@]1(C2CC2)CN(c2c(F)cc(CN)cc2F)CCO1 694856338 AWXSZMCAXIRPEU-HNNXBMFYSA-N 282.334 2.429 10 10 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2.413 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H]2CNC[C@H]2F)cc1 2120672146 LPGCVPKXZKXOTE-KFWWJZLASA-N 266.360 2.124 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]3CC[C@H](C2)O3)C1 2124928082 YFQRLUJUPAUOEW-KKOKHZNYSA-N 264.329 2.103 10 10 CECE CN(c1ccc(CN)c2ccccc12)C1(CO)CC1 2128177093 KUXISSFDKOGFKW-UHFFFAOYSA-N 256.349 2.260 10 10 CECE C[C@@H](C[S@@](C)=O)N(C)c1ccc2c(c1)CCC[C@@H]2O 2128275712 WLDLOHSHQGDIJP-SGJUXQJHSA-N 281.421 2.260 10 10 CECE CCN[C@@H]1CCCc2cc(N(C)[C@@H](C)CO)ccc21 2128271729 DKGZKVOUKUDNLL-BLLLJJGKSA-N 262.397 2.491 10 10 CECE C[C@H]1[C@H](N(C)C)CCN1c1ccc2c(c1)CC[C@@H]2N 2128316383 DUDDAIJKFDWZJX-KNXALSJPSA-N 259.397 2.161 10 10 CECE CCCn1cnnc1CN1CCC[C@@H](CN=[N+]=[N-])C1 1912182713 FUFAMAIAMONQCY-NSHDSACASA-N 263.349 2.210 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H]2CC[C@@H]21 1912196865 YWSCLXKYOOEXDX-SCVCMEIPSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=NCCNC(=O)[C@@H]1CCC[C@@H]1C(F)(F)F 1912166095 SCQXHUWWSFOTCY-RQJHMYQMSA-N 250.224 2.392 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)C[C@@H]2CCCO2)CC1 1912195917 RIYSJHOQOSCFNH-NSHDSACASA-N 252.318 2.104 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(Cc2nnc(Cl)s2)C1 1912199698 WEIVCEUITMQFJH-LURJTMIESA-N 258.738 2.324 10 10 CECE CC1CCC(N(C)C(=O)CN(C)CCN=[N+]=[N-])CC1 1912174589 BJUGKSPVTNKWBQ-UHFFFAOYSA-N 267.377 2.266 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](CO)C23CC3)cc1 2133818888 DSHNKUKRKFFDQO-TZMCWYRMSA-N 260.381 2.318 10 10 CECE COC1(C(F)(F)CNCc2ccc(O)c(O)c2)CCC1 1912513826 XIBWNHUKTQVUQZ-UHFFFAOYSA-N 287.306 2.392 10 10 CECE CCc1nc([C@@H](C)Sc2ncc(C(=O)OC)s2)n[nH]1 1350117596 GALXMLHAVVZLBS-ZCFIWIBFSA-N 298.393 2.464 10 10 CECE CC[C@H]1CCOCCN1c1ccc(CN)c(F)c1F 1913621077 CYNBYLLBOYRIFW-NSHDSACASA-N 270.323 2.429 10 10 CECE Cn1c(OCc2ccc(N)cc2)nc2cnccc21 1924859393 VFIQXUXUPSWLRT-UHFFFAOYSA-N 254.293 2.130 10 10 CECE CC(=O)c1c[nH]c(C(=O)N2Cc3cccc(O)c3C2)c1 1636230968 LOZURBUZEWSOGI-UHFFFAOYSA-N 270.288 2.079 10 10 CECE Cc1nsc(C)c1C(=O)NCc1cc(O)ccc1O 1637125922 HFNYZESJBAPJNE-UHFFFAOYSA-N 278.333 2.101 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cnc(Cl)cn2)c1 1638940975 UMFKDDBCESTHDE-UHFFFAOYSA-N 277.711 2.074 10 10 CECE O=C(/C=C\c1ccc(O)cc1)NCc1c(O)cccc1O 1597574170 JCPXZEVBTXCIGV-TWGQIWQCSA-N 285.299 2.133 10 10 CECE COc1cccc(CNC(=O)c2cc(C)cnc2F)c1O 1595799734 GNEAUNFRBORDBT-UHFFFAOYSA-N 290.294 2.173 10 10 CECE COc1cc(N(C)[C@@H]2[C@H]3C[C@H]3[C@H]3C[C@H]32)ccc1CN 2139684905 CHHMBJHIEYUKDF-LRDNVRMFSA-N 258.365 2.245 10 10 CECE Oc1cc(F)ccc1CNc1cccn2cnnc12 2139887195 KDOLEMCIBOUEKX-UHFFFAOYSA-N 258.256 2.186 10 10 CECE Nc1ccc(COc2nnc([C@@H]3CCOC3)s2)cc1 2139899476 HEEBRFKKHAWFRJ-SNVBAGLBSA-N 277.349 2.203 10 10 CECE CCNC(=O)CCN1CCc2cc([C@H](C)NCC)ccc21 162183544 UPUDBVPCGOQGKX-ZDUSSCGKSA-N 289.423 2.246 10 10 CECE CCCCCC(=O)N(c1ccc(N)cc1)S(C)(=O)=O 206612444 WPXXXMHHPMLKEZ-UHFFFAOYSA-N 284.381 2.142 10 10 CECE COc1cc(C)cc(CN2[C@H]3CC[C@H]2CC(O)C3)c1O 164353278 FQGMQJFOIYRAPU-STQMWFEESA-N 277.364 2.197 10 10 CECE Cc1cc(C(=O)NCc2ccc(N)cc2)ccc1[N+](=O)[O-] 159388382 VXPWAQIEODYSJI-UHFFFAOYSA-N 285.303 2.415 10 10 CECE COCCN(CCOC)/N=N/c1ccc(OC)c(OC)c1 1860485792 YJCIVMOEGAXSQT-FOCLMDBBSA-N 297.355 2.297 10 10 CECE CCOc1ccc(CNCCCC(=O)O)cc1C 258844264 IISMKSYCSAEQEG-UHFFFAOYSA-N 251.326 2.348 10 10 CECE Oc1c(Br)cccc1CN[C@@H]1C[C@H]2COC[C@H]21 1940421932 NXHMXKMPTYTWPB-HOSYDEDBSA-N 298.180 2.279 10 10 CECE COC(C)(C)CS(=O)(=O)Nc1ccc(O)cc1Cl 849308023 DQQALCMOZGAFMA-UHFFFAOYSA-N 293.772 2.212 10 10 CECE CCN1CCc2cc([C@@]3(O)CC[C@@H]3COC)ccc21 2142397260 LERIRGNBKARJAZ-ZBFHGGJFSA-N 261.365 2.313 10 10 CECE Nc1ccc(CCC(=O)Nc2ccc(F)nc2)cc1 236350508 GYSPAMWJLXNBKX-UHFFFAOYSA-N 259.284 2.374 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H]4COC[C@H]43)ccc21 1899111627 LSXKPFXZTHYLEH-APHBMKBZSA-N 258.365 2.118 10 10 CECE CCN[C@@H](CC)c1ccc(N2CC([N+](=O)[O-])C2)cc1 1876137569 UBLUMTFQHMQDOP-AWEZNQCLSA-N 263.341 2.213 10 10 CECE CN1CCC[C@@H](N(C)c2ccc(CN)cc2F)CC1 1877823551 PVPMQRPLFBASDH-CYBMUJFWSA-N 265.376 2.205 10 10 CECE CN(C)C[C@@H]1CN(c2ccc(CN)cc2)C(C)(C)C1 1878135598 AXMDKQFMBXDXBD-CQSZACIVSA-N 261.413 2.312 10 10 CECE C[C@H]1[C@@H](C)[C@H](N(C)c2ccc(CN)cc2)CCN1C 1879236057 CUKDEJXTZFNECV-DVOMOZLQSA-N 261.413 2.310 10 10 CECE COC1(CNCc2ccc(O)c(O)c2)CCSCC1 1879926662 WHNPOUNESNTASY-UHFFFAOYSA-N 283.393 2.100 10 10 CECE C[C@H](O)c1cc(F)c(N(CCO)[C@@H]2C[C@H]2C)c(F)c1 1880484260 DHPGETDVJHLXNH-VYUIOLGVSA-N 271.307 2.225 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]32)cc1O 2143970005 DBXIKJAWDJVOTQ-YODMDTAWSA-N 276.380 2.152 10 10 CECE C[C@H]1C[C@H](CNCc2c(O)cccc2F)CCO1 1964078179 VBYYDNBQIWCPFH-WDEREUQCSA-N 253.317 2.436 10 10 CECE CC1(C)C[C@@H](O)CN1c1ccc(CO)c(Cl)c1 1949216755 ACKFUDNHRJPJRJ-LLVKDONJSA-N 255.745 2.182 10 10 CECE COc1ccc(CNCCc2ccncc2)c(O)c1 40906681 FYNAUORTXPZJNG-UHFFFAOYSA-N 258.321 2.128 10 10 CECE Cc1coc(S(=O)(=O)N(C)Cc2ccccc2O)c1 1965751907 MGPUKBWWCOERBL-UHFFFAOYSA-N 281.333 2.114 10 10 CECE C[C@@H](NC[C@]1(C)COCCO1)c1ccc(N(C)C)cc1 1967516807 NCVUKNNRDDSOON-CZUORRHYSA-N 278.396 2.209 10 10 CECE COc1ccc(O)c(CNC[C@@H]2CCCC[C@@H](O)C2)c1 1967745931 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CCN[C@H](C)CCN1CCN(c2ccc(OC)cc2)CC1 43817746 ALCAVTYCYSAKNH-OAHLLOKOSA-N 291.439 2.205 10 10 CECE CC(C)CCNC(=O)CN(c1ccc(CN)cc1)C1CC1 49283867 JJQIZFUJGITMDT-UHFFFAOYSA-N 289.423 2.276 10 10 CECE C[C@@H](NCc1ccccc1O)C(=O)N1CCCCCC1 228416037 BVQUFKQUMQSEEA-CYBMUJFWSA-N 276.380 2.273 10 10 CECE O=C(Nc1ccc(O)cc1C(=O)O)c1cc(F)ccc1O 132795903 LNWSQFIHYSBTFY-UHFFFAOYSA-N 291.234 2.187 10 10 CECE O=[N+]([O-])c1ccc(CCNCc2ccc(O)c(O)c2)cc1 40675869 SZEZILHQRMEORT-UHFFFAOYSA-N 288.303 2.338 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@](C)(O)C2)c(Cl)c1 235513375 JXMCJWGVBAVNJE-TVQRCGJNSA-N 254.761 2.321 10 10 CECE CCN1CCO[C@@H](CN(Cc2ccc(N)cc2)C(C)C)C1 92058393 GFPIDYWGSCQANA-QGZVFWFLSA-N 291.439 2.200 10 10 CECE N[C@H](CCCO)c1cc(F)cc(Br)c1O 95716894 GXJZMIOZBLZLQP-SECBINFHSA-N 278.121 2.066 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)c1cccc(F)c1 90259022 SIGYCCVUDLZXBQ-JTQLQIEISA-N 252.249 2.241 10 10 CECE Cc1cc(O)c(CN2CCN3CCC[C@H]3C2)cc1C 247083186 NKGULVJHELXOHL-HNNXBMFYSA-N 260.381 2.289 10 10 CECE C[C@H](NC(=O)c1cc(O)nc(O)c1)[C@H]1C[C@H]2CC[C@H]1C2 243793885 QMIRSDYBVSLYMN-QFOLPQNPSA-N 276.336 2.047 10 10 CECE COc1ccc(O)c(CNC(=O)C2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)c1 247025496 DKAKPDQIIVPPEH-CHPZLBCBSA-N 287.359 2.309 10 10 CECE CC(C)N1CC[C@H](CN)[C@H]1c1ccc2c(c1)CCN2C 250496493 JKXHSRNIXFMCOD-NVXWUHKLSA-N 273.424 2.409 10 10 CECE C[C@H](C(=O)O)N(C)[C@H](C)c1ccc(N(C)C)cc1 251348063 FRRMLAULIMZQTL-GHMZBOCLSA-N 250.342 2.219 10 10 CECE CCCOc1ccc(N2CC[C@]3(CNCCO3)C2)cc1 2162670928 NZFAMWUORSUTJP-INIZCTEOSA-N 276.380 2.044 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@@H]3[C@@H](C2)C3(F)F)c(O)c1O 2165989115 HVVJMGJXVXDSOX-OPRDCNLKSA-N 285.290 2.327 10 10 CECE CN1CCc2cc(N3CCCNCC(F)(F)C3)ccc21 2163070429 WVIUNZJYORGMMJ-UHFFFAOYSA-N 281.350 2.114 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3CC34CCNCC4)ccc21 2163070269 GZINHBMMDHGPKP-ZBFHGGJFSA-N 272.392 2.102 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)C12CCN(CC1)CC2 2163071220 MOHNXFLDKBUIFM-INIZCTEOSA-N 273.424 2.499 10 10 CECE CC[C@@](C)(OC)[C@@H](NN)c1ccc2c(c1)CCCN2C 2163102429 KNNNURGTHKXOML-JKSUJKDBSA-N 277.412 2.389 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@H](O)C1(C)CSC1 2163141449 USMOAWMSNLMVGO-GJZGRUSLSA-N 292.448 2.053 10 10 CECE CC1(C)[C@@H](O)C[C@@H]1NCc1cc(Cl)c(F)cc1O 294816413 XDMVTSQNSFNMEW-RYUDHWBXSA-N 273.735 2.434 10 10 CECE CCNCc1cc(F)c(N(C)C[C@H]2C[C@@H](O)C2)c(F)c1 703877555 GRMLIISVLGSGQM-TXEJJXNPSA-N 284.350 2.281 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H]3COC[C@@H]32)cc1O 710318861 PXIUQUWLQUZLFX-GYSYKLTISA-N 262.353 2.027 10 10 CECE CCc1cccc(CNCc2nccc(C)n2)c1O 2130071667 QEJXYVLQNBCICT-UHFFFAOYSA-N 257.337 2.343 10 10 CECE CN(C/C=C\c1ccc(N(C)C)cc1)C[C@H]1COCCO1 827140353 KWLSCFYHBPSQJJ-CHYADLBTSA-N 290.407 2.113 10 10 CECE Cc1cc(O)c(CN2C[C@@H](C(N)=O)CC[C@@H]2C)cc1Cl 824575868 SMTBUAYEVCWKIP-QWRGUYRKSA-N 296.798 2.440 10 10 CECE CC[C@@H]1CCCCN1C(=O)c1cc(O)c(O)c(O)c1 1866303057 JKYGOGVXPBLSPX-SNVBAGLBSA-N 265.309 2.208 10 10 CECE CSC[C@H]1CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 588408387 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C[C@@H]1COC[C@@H]1N(C)c1ccc(/C=C\C(=O)O)cc1F 688237348 NLVVPEODQQPBHA-HBWVAPHISA-N 279.311 2.395 10 10 CECE Nc1ccc(OCC(=O)O[C@@H]2CC[C@H]3C[C@@H]2C3)cc1 1897393452 YDYYRHDDBFBVFE-UHIISALHSA-N 261.321 2.379 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](F)C(C)C)C2)cc1 855228021 UCVIFYKFQIQJQZ-DOMZBBRYSA-N 294.370 2.384 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)c3cccn3C)C2)cc1 855232148 OGALWVQIEWDBHE-ZDUSSCGKSA-N 299.374 2.042 10 10 CECE C[C@H](NC(=O)N[C@H]1CO[C@@H](C2CC2)C1)c1ccccc1O 868814601 FDIBXCXNNNTBSP-JVLSTEMRSA-N 290.363 2.320 10 10 CECE CC1(C)C[C@@H]1c1nnc([C@H](N)c2ccc(O)cc2O)o1 83543875 SOYPJGRGUDMXOT-MWLCHTKSSA-N 275.308 2.042 10 10 CECE Cc1cc2c(cc1O)[C@@H](c1ccc(O)cc1O)NCC2 83657001 MBHZZTANCJEZNQ-MRXNPFEDSA-N 271.316 2.347 10 10 CECE Oc1cc2c(cc1O)[C@@H](c1cccc(F)c1O)NCC2 83621114 KFHLGLUBZZKPHP-CQSZACIVSA-N 275.279 2.178 10 10 CECE COCC[C@@H](C)N1CCOc2cc(N(C)C)ccc21 271736259 VECFKWLSTIWYQF-GFCCVEGCSA-N 264.369 2.376 10 10 CECE CCc1cccc(OCC(=O)NCCCN=[N+]=[N-])c1 701287260 VLRSDHCRZKIYCJ-UHFFFAOYSA-N 262.313 2.444 10 10 CECE CC(C)O[C@@H]1CCN(c2ccc([N+](=O)[O-])c(CO)c2)C1 701684724 QFBISQZTGDIJTQ-CYBMUJFWSA-N 280.324 2.091 10 10 CECE C[C@H]1CN(c2ccc(CO)c(Cl)c2)C[C@@H](C)[C@@H]1O 688088648 XNNRAZJXAMCRLO-MSRIBSCDSA-N 269.772 2.285 10 10 CECE CN[C@@H](C)c1ccc(N2CCN(C)C[C@@H](C)C2)c(F)c1 707106147 OQZIRAJGTWYLGJ-OLZOCXBDSA-N 279.403 2.494 10 10 CECE C[C@@H](N)c1ccc(N2CC(n3cncn3)C2)cc1Cl 707663227 ZOTJKZWKPFYEEI-SECBINFHSA-N 277.759 2.013 10 10 CECE CCNCc1ccc(N2CCNC(=O)C[C@@H]2C)cc1Cl 707633222 PFQFGXLMLVIVIS-NSHDSACASA-N 295.814 2.164 10 10 CECE CN(CCOc1ccc(N)cc1)CCc1nccs1 688766056 YFOAFXPRBREGDS-UHFFFAOYSA-N 277.393 2.279 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@H](O)C2)c(F)c1 61710641 IHMLDQLYWAZWCG-YPMHNXCESA-N 266.360 2.457 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)[C@@H]1CCCSC1 689537571 UIWBBDXBEMXXSA-CQSZACIVSA-N 293.436 2.425 10 10 CECE CN(Cc1ccccc1O)C(=O)c1c(N)cccc1F 714072793 URXSSGPDYHABCS-UHFFFAOYSA-N 274.295 2.386 10 10 CECE Cc1csc(NC(=O)Cc2ccc(O)c(O)c2)n1 1141884444 MRTUWVSDDABSJM-UHFFFAOYSA-N 264.306 2.044 10 10 CECE Cc1ccnc(CN2CCc3cc([C@H](C)N)ccc32)n1 692600251 HILMRKAMRRYYAX-LBPRGKRZSA-N 268.364 2.367 10 10 CECE CC[C@H]1CNC(C)(C)CN1c1ccc2c(c1)OCO2 86216706 ZFBFURGNPARONU-NSHDSACASA-N 262.353 2.382 10 10 CECE Cc1nccnc1CN[C@H](C)c1cc(O)ccc1O 699989020 NAVPKIYFAIMECE-SECBINFHSA-N 259.309 2.047 10 10 CECE CC[C@@H](C)N1CCN(c2ccc([C@H](C)N)c(O)c2)CC1 93671433 XOOFBPQQCAQUEH-OLZOCXBDSA-N 277.412 2.332 10 10 CECE Fc1cc(CNC2CC2)ccc1N1CCO[C@@H]2C[C@@H]21 2115160039 YPUZFMWDJIGNAJ-LSDHHAIUSA-N 262.328 2.055 10 10 CECE CN=c1[nH]ccc(N(C)Cc2ccc(N)cc2)c1C 2117153254 OBWQMNZILZXKNT-UHFFFAOYSA-N 256.353 2.072 10 10 CECE COc1cccc(CNc2nc(C)ncc2C)c1O 1329151978 DRXBARCXLRCDEU-UHFFFAOYSA-N 259.309 2.420 10 10 CECE Cc1c(CNC2[C@H]3COC[C@H]23)n(C)c2ccccc12 2118011047 ZGFZDBSECNLADM-STQMWFEESA-N 256.349 2.221 10 10 CECE NCc1cc(F)c(N2CC(N3CCCC3)C2)cc1Cl 2120880842 FLJHDBANMGCFGZ-UHFFFAOYSA-N 283.778 2.222 10 10 CECE CC[C@H]1C[C@@]1(NC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-] 1905809789 ZBKKPHDUTIBYOV-ZANVPECISA-N 297.359 2.106 10 10 CECE CN(C[C@H]1CCOC1)c1ccc2c(c1)CCC[C@@H]2N 2128272622 SMWVWFBHXPVUME-WBMJQRKESA-N 260.381 2.495 10 10 CECE OCC[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128278412 DLYCILGCBJJZPV-MLGOLLRUSA-N 261.365 2.265 10 10 CECE CN[C@@H]1CCc2cc(N(C)CCCCCO)ccc21 2128314752 KDMNFDVZJJNYAZ-MRXNPFEDSA-N 262.397 2.492 10 10 CECE CO[C@@H](CN(C)c1ccc2c(c1)CC[C@H]2N)C1CC1 2128310955 OGSCAOCHRXSCEH-CVEARBPZSA-N 260.381 2.494 10 10 CECE O[C@H]1CCc2cc(N3CCOCC34CCC4)ccc21 2128321881 LJBLEOBVKGCIOR-HNNXBMFYSA-N 259.349 2.426 10 10 CECE CC(C)(C)[C@H]1C[C@@H](NCc2ccc(O)c(O)c2)CO1 2129162420 QKXHLWHWBGNSOU-BXUZGUMPSA-N 265.353 2.391 10 10 CECE COc1cc(C)cc(CN(C)Cc2nccn2C)c1O 1334314150 VHHRDYXYGCBQJL-UHFFFAOYSA-N 275.352 2.075 10 10 CECE Cc1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)nnc1C 2129286910 ZLWABCLJLUBQLL-JTQLQIEISA-N 260.301 2.008 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@H]3C[C@H]2CN3C)cc1 2131054736 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10 10 CECE COCc1cccc([C@H](NN)c2ccccc2O)c1 2134737185 WBNQLWNCDNMFCS-HNNXBMFYSA-N 258.321 2.091 10 10 CECE C[C@H]1CN(C)CCCN1c1ccc(C=CC(=O)O)cc1 1911894706 UEMKFOOZEPCERT-ZDUSSCGKSA-N 274.364 2.315 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(F)c(F)c1O 1299049682 QBSPMSXFKHWHCI-UHFFFAOYSA-N 295.241 2.263 10 10 CECE CCNCc1ccc(N(CC)CCO)c(OC(C)C)c1 212129829 DEYGRHUWHWMOLG-UHFFFAOYSA-N 280.412 2.402 10 10 CECE C[C@@H]1CCO[C@H]1CCNCc1ccc(O)cc1O 1918130787 UICYFAUSVJDPIR-YGRLFVJLSA-N 251.326 2.003 10 10 CECE CC[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccccn1 1469179505 MRZIBPUIGZWZAL-GFCCVEGCSA-N 286.331 2.303 10 10 CECE CN(CC[C@H]1CCCNC1)c1ccc2c(c1)OCO2 216800448 FCZOLKATRONZAP-GFCCVEGCSA-N 262.353 2.241 10 10 CECE Cc1ccc(C(=O)NCc2cc(Cl)ccc2O)c(O)n1 1469873931 HFZHULNXKLJMHL-UHFFFAOYSA-N 292.722 2.385 10 10 CECE COc1ccccc1N(C)C(=O)c1ccc(O)c(O)c1 227019650 LREFXGJQXPCMST-UHFFFAOYSA-N 273.288 2.383 10 10 CECE CC(C)OCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1628606821 BQCUWWZYRILWJU-UHFFFAOYSA-N 292.339 2.394 10 10 CECE COc1ccc(O)c(CN2C[C@@H](N)CC23CCCC3)c1 1925243548 SKHWEEBIBAAVIT-ZDUSSCGKSA-N 276.380 2.247 10 10 CECE Cc1ccc2oc(C(=O)NCc3cc(O)ccc3O)cc2n1 1637125890 GHOULPKPTOYFHS-UHFFFAOYSA-N 298.298 2.477 10 10 CECE O=C(NCc1c(O)ccc2ccccc12)c1cccc[n+]1[O-] 1635964930 FQXRXBYUKRELFO-UHFFFAOYSA-N 294.310 2.109 10 10 CECE O=C(C[C@@H]1CCC2(CCC2)O1)NCc1cc(O)ccc1O 1643881696 BPGCHRSGFVRDOI-ZDUSSCGKSA-N 291.347 2.206 10 10 CECE CS/C=C/C(=O)NCc1ccc2cccnc2c1O 1570533767 PUWHOZBVCBXXIY-SOFGYWHQSA-N 274.345 2.433 10 10 CECE C[C@@H]1CCN(c2ccc(CN)cc2C(F)(F)F)C[C@@H]1O 230280669 GGIFGRWMSDDSPQ-RNCFNFMXSA-N 288.313 2.371 10 10 CECE O=[N+]([O-])c1c[nH]ccc1=NCc1ccc2cccnc2c1O 1651160739 CVLRVHLJAXLHKB-UHFFFAOYSA-N 296.286 2.278 10 10 CECE CC(=O)c1ccc(O)c(CN(C)CCOC(F)F)c1 2138201402 IAIPAXMBKXFKAP-UHFFFAOYSA-N 273.279 2.266 10 10 CECE CCN([C@H]1CCNC1=O)[C@@H](C)c1ccc(Cl)cc1O 2138553673 PTSWEKXRFVCSPD-CABZTGNLSA-N 282.771 2.317 10 10 CECE CN1CCc2cc([C@@H](O)[C@@](C)(N)C(C)(C)C)ccc21 2139198286 ZIZIQHXWJCOKED-GDBMZVCRSA-N 262.397 2.476 10 10 CECE CCN(CC)[C@H](C(=O)O)c1ccc(N(C)C)cc1 11571136 MRXQMJKJGIYYBY-ZDUSSCGKSA-N 250.342 2.220 10 10 CECE CC12COC(C(=O)N3CCC[C@@H](CN=[N+]=[N-])C3)(C1)C2 2140230677 ZOAGDXJWNIUTTR-PKSQDBQZSA-N 264.329 2.104 10 10 CECE CCNCc1ccc(N(C)CC[C@H](C)O)cc1OC 2139685812 HLSXJZMRTWACGP-LBPRGKRZSA-N 266.385 2.012 10 10 CECE CC[C@@H]1CCNC[C@@H]1N(C)Cc1ccc(F)cc1O 2139771141 UYLKBKAOGXWPTR-RISCZKNCSA-N 266.360 2.351 10 10 CECE CC1=C(C)CN([C@@H](CN)c2ccc(N(C)C)cc2)C1 2140682090 NGICXJVWPDZZMF-INIZCTEOSA-N 259.397 2.404 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCC[C@@H](OC)C1 233707508 NQEMXGQTGXIBGY-DGCLKSJQSA-N 284.360 2.167 10 10 CECE COc1ccc(N(CCCN)C[C@H]2C[C@@H]2CF)cc1 1875927159 HOUFJHQCVZYNPN-CHWSQXEVSA-N 266.360 2.456 10 10 CECE C[C@H](NCC12CCC(CC1)O2)c1cc(O)ccc1O 1876696891 KSNQWXJVXIJNCI-VLRKGOCCSA-N 263.337 2.460 10 10 CECE Nc1ccc(NC(=O)N2C[C@@H]3[C@H](C(F)F)[C@@H]3C2)cc1 1877076248 LAEVPGNLLSLDKI-JGPRNRPPSA-N 267.279 2.244 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H]2C[C@]1(C(=O)O)C2 1877384918 HECHQGRCNRYIIY-UINNMSKDSA-N 265.284 2.141 10 10 CECE CN(Cc1ccccc1O)c1nccc(CO)c1F 1877539206 SIVANIGCELVYDM-UHFFFAOYSA-N 262.284 2.055 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ccnc(NN)c1 1877524021 PCKFDWZCOZIEDY-JTQLQIEISA-N 258.325 2.270 10 10 CECE COC[C@@H](CC(C)C)C(=O)NCc1ccccc1O 1879013727 NCAQJAOTTCWPJV-CYBMUJFWSA-N 265.353 2.317 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCOC(F)(F)C2)c(F)c1 1880482831 SEHGQJPSZOKABP-SSDOTTSWSA-N 279.233 2.448 10 10 CECE COc1cccc(O)c1CN[C@]1(CO)CC[C@H](C)C1 1880882015 LLHISGRACVDERK-XHDPSFHLSA-N 265.353 2.042 10 10 CECE COc1cccc(CNCCc2nc(C)oc2C)c1O 1963441277 JNILLCFNVCHNAG-UHFFFAOYSA-N 276.336 2.338 10 10 CECE CCCN(CCC(=O)O)Cc1cc(F)ccc1O 1964724231 LQTHCYWGSREZFX-UHFFFAOYSA-N 255.289 2.218 10 10 CECE CCOc1cccc(CN(C)[C@@H]2CCC[C@H]2CN)c1O 250524704 WENKXNLZZOQNMX-GXTWGEPZSA-N 278.396 2.350 10 10 CECE Cc1cc(O[C@H]2CCOC2)ccc1N1CCC[C@H](N)C1 251042811 MNVWXPLZTLPDDR-ZFWWWQNUSA-N 276.380 2.090 10 10 CECE C[C@H]1C[C@@H](C(=O)NCc2ccc(N)cc2)CCS1 1966808317 VNGNZIRBIQEFIX-JQWIXIFHSA-N 264.394 2.417 10 10 CECE Oc1ccc(F)cc1CNCC12CC(CCO1)C2 1967849231 RODCWVZTNGQXSQ-UHFFFAOYSA-N 251.301 2.190 10 10 CECE N[C@@H]1CC[C@@H]2CN(Cc3cc(F)ccc3O)C[C@H]2C1 1969034591 NVGYLPIKDFIFQM-JTNHKYCSSA-N 264.344 2.091 10 10 CECE CN(C)c1ccc(CNCc2cccc(O)c2O)cc1 41116651 YOUYBTKSQKOMON-UHFFFAOYSA-N 272.348 2.454 10 10 CECE Oc1cc(F)ccc1CNCc1nccn1C1CC1 1970591939 QHOHNIWFABVKOF-UHFFFAOYSA-N 261.300 2.353 10 10 CECE C[C@H](NCCc1ccc(O)c(O)c1)[C@H]1C[C@H]2CC[C@H]1O2 2148004748 QIOIJERVDZSCHX-MZXFEWSRSA-N 277.364 2.186 10 10 CECE CCN[C@H](c1ccccc1O)[C@@]1(O)COC[C@@H]1C(C)C 2148150571 CVQGOGASBDGZJH-FVQBIDKESA-N 279.380 2.076 10 10 CECE CN(Cc1ccc(Br)cc1O)[C@@H]1CC[C@H]1N 1977173671 NBZBRFJZUBSHHI-GHMZBOCLSA-N 285.185 2.076 10 10 CECE CON(Cc1cc(Cl)cc(Cl)c1O)C1CNC1 2003441287 AKNWSRIRICQJIJ-UHFFFAOYSA-N 277.151 2.034 10 10 CECE COC(=O)CC[C@H](N)c1c(C(F)(F)F)ccc(O)c1O 260255453 BNCPFDDHMGJDPS-ZETCQYMHSA-N 293.241 2.070 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@H]1CCCCS1(=O)=O 2146251359 XGAUOHAYRXNQFE-CABCVRRESA-N 297.420 2.400 10 10 CECE CCOC(=O)CC1(c2cc(O)c(O)c(F)c2)CC1 260561845 YQSTYJIFHLDFJA-UHFFFAOYSA-N 254.257 2.222 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CC=CCC3)ccc21 167761790 JWGFIDQACYHPQS-AWEZNQCLSA-N 257.337 2.056 10 10 CECE CNCc1ccc(N(C)C[C@@H]2[C@H]3CCOC[C@H]32)cc1C 2150193120 AMIKKOGWMNZGND-BRWVUGGUSA-N 274.408 2.433 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2[C@H]3CCOC[C@H]32)cc1O 2150179614 ILCVKFFPZWSPEP-CJYSPXJISA-N 277.364 2.164 10 10 CECE CN(C(=O)CN1CCCCCCC1)c1ccc(N)cc1 37272998 AJSGTTKJSXQZPR-UHFFFAOYSA-N 275.396 2.498 10 10 CECE CN1CC(C)(C)CC[C@@H]1CNCc1ccc(O)c(O)c1 2150655104 PVEQJHXOEJFCSW-CYBMUJFWSA-N 278.396 2.308 10 10 CECE CN(C)c1ccc([C@@H](O)C(=O)c2cnc(Cl)n2C)cc1 2146998723 ZZGRDPJZMYWRBY-GFCCVEGCSA-N 293.754 2.056 10 10 CECE CCCC[C@@H](N)C(=O)N(C)[C@@H](C)c1ccccc1O 37826572 HUBMHPYEWKJNTM-WCQYABFASA-N 264.369 2.429 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)cc1 2151393468 QCOKOFWHPIRXAM-IMJJTQAJSA-N 274.408 2.392 10 10 CECE COC[C@@]1(OC)CCN(c2ccc([C@@H](C)O)cc2F)C1 2151847150 VHPIKIUMNHGXTJ-IAQYHMDHSA-N 283.343 2.121 10 10 CECE O=C([C@@H]1CNc2ccccc2N1)N1CCCC[C@H](F)C1 2152294883 RYGCYJVUEQWNNF-FZMZJTMJSA-N 277.343 2.243 10 10 CECE C[C@@H](O)c1ccc(N2CCOC[C@@H](C3CC3)C2)cc1O 2152889619 NXLINPLAVXFYTB-YPMHNXCESA-N 277.364 2.308 10 10 CECE OCc1cc(F)c(N2CC[C@@H]([C@@H]3CCOC3)C2)c(F)c1 2153069903 KMJLDGINAUKTAZ-VXGBXAGGSA-N 283.318 2.320 10 10 CECE Nc1ccc(OCCNC(=O)[C@H]2CC23CCCC3)cc1 2153709107 VXBGDSSYTCZJPS-CQSZACIVSA-N 274.364 2.344 10 10 CECE CCOC(=O)[C@@H](C)NCc1ccc2c(c1)CCCN2C 50286865 ZOYUSEWWIBVIKP-GFCCVEGCSA-N 276.380 2.110 10 10 CECE C[C@H](N)c1ccc(N(C)CP(C)(C)=O)cc1O 2021447232 MSPYUKXHGGGRBH-VIFPVBQESA-N 256.286 2.428 10 10 CECE CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(Cc2cccc(F)c2O)[C@H]31 289873375 VVYZMMNSICNPTK-PFSWANKYSA-N 277.339 2.387 10 10 CECE CC(C)N1CCO[C@@H](CN2CCC[C@H](N=[N+]=[N-])CC2)C1 2155561580 WTHNZROEJHTOCU-KBPBESRZSA-N 281.404 2.260 10 10 CECE N[C@@H]1CC[C@H]2CN(Cc3ccc(Cl)cc3O)C[C@H]12 2029645233 FZCPDCGJALDOHF-TVYUQYBPSA-N 266.772 2.215 10 10 CECE CC(C)OC(C)(C)CNCc1ccc(O)cc1O 2032079992 DMXKOROITLAFCM-UHFFFAOYSA-N 253.342 2.391 10 10 CECE CN(c1c(F)cc(CO)cc1F)C1C[C@@H]2COC[C@H]2C1 2156142228 LXPPYSSCZHORAH-GHMZBOCLSA-N 283.318 2.318 10 10 CECE Cc1cc(CNC2CC2)ccc1OCC[S@](C)=O 2037494367 KBPMIXCJDMVXEW-SFHVURJKSA-N 267.394 2.004 10 10 CECE CC[C@](C)(CO)Sc1ncc(CNCCOC)s1 2037795197 TUNOYJIZEZRRMI-GFCCVEGCSA-N 290.454 2.132 10 10 CECE C[C@H]1OC2(C)CC1(C(=O)N(C)CCCN=[N+]=[N-])C2 2038988919 IZSFMDMDPWHSDO-OIKLOGQESA-N 252.318 2.103 10 10 CECE Nc1ccc(CNC(=O)[C@H]2C[C@H]2C(F)(F)F)cc1 2039187408 SEXKNKNDBPVAKK-VHSXEESVSA-N 258.243 2.083 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@H]2[C@H]1C(=O)O 2157095037 YCTORHQYKXGTNH-GRLOZPDXSA-N 279.311 2.387 10 10 CECE CCCOc1cc(N2C[C@@H](C)C[C@@H](O)C2)ccc1N 401578042 IRVOWGZYLDIEQA-WCQYABFASA-N 264.369 2.265 10 10 CECE COc1ccc(N(C)C[C@@H](N)COC(C)(C)C)cc1 309861801 JEKOSGLCVMQFIG-GFCCVEGCSA-N 266.385 2.274 10 10 CECE Nc1ccc(CN2C(=O)C3=C(CCCC3)C2=O)cc1 311689173 KCPFCFFTJHTFEZ-UHFFFAOYSA-N 256.305 2.008 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC[C@H](N)C(C)(C)C1 311628274 UZSUFNVDQKXLRR-HZMBPMFUSA-N 264.369 2.218 10 10 CECE CCNCc1ccc(N2C[C@H]3CCC[C@]3(CO)C2)cc1 2159411182 XHMPXAPNZJAOAS-NVXWUHKLSA-N 274.408 2.395 10 10 CECE CCN1CCCN(c2ccc([C@H](C)N)c(O)c2)[C@H](C)C1 319956089 IHTWYTNAPMOJFC-OLZOCXBDSA-N 277.412 2.332 10 10 CECE CN(C)c1ccc(CN2CCN[C@](C)(C3CC3)C2)cc1 2160480102 KBUAJVFNRABTCJ-KRWDZBQOSA-N 273.424 2.327 10 10 CECE O=C(O)[C@H](NCc1c(O)cccc1F)C1CC(F)(F)C1 2160779442 DQXJDYDLARDEET-LLVKDONJSA-N 289.253 2.119 10 10 CECE CN(C)CC[C@H]1CCCN1c1ccc(CN)c(F)c1F 700978771 XPXSHCKYIATYLQ-GFCCVEGCSA-N 283.366 2.344 10 10 CECE CC[C@@]1(C(=O)O)CCCN(Cc2ccc(O)c(O)c2)C1 86784927 JFVBMIYJKMGKSY-OAHLLOKOSA-N 279.336 2.175 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H]2CN(C)C[C@]2(C)C1 702432890 ILJYEKZQWCVCTD-XHBSWPGZSA-N 278.371 2.476 10 10 CECE Nc1ccc(NC(=O)CCCN2CC(C(F)F)C2)cc1 706422216 XGCDDPYAHMDRJQ-UHFFFAOYSA-N 283.322 2.184 10 10 CECE C[S@](=O)C1CN(c2ccc(CNC(C)(C)C)cc2F)C1 2171958008 XAXMDNXOURJXJB-FQEVSTJZSA-N 298.427 2.281 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1CCc2ccccc21 687253364 RJSSKBQAJNWUNF-CQSZACIVSA-N 267.332 2.467 10 10 CECE C[C@@H]1CCC[C@@H]1N(C)C[C@H](O)COc1ccc(N)cc1 709145231 BGIFASPYLBJQHX-INWMFGNUSA-N 278.396 2.129 10 10 CECE Cc1cc(CN)ccc1N1CCC(O)(C(C)C)CC1 710263390 SEHNWUYTRJAFLK-UHFFFAOYSA-N 262.397 2.441 10 10 CECE COc1ccc([C@@H](C)NCc2[nH]cnc2C)c(O)c1 379965170 GKBFYJSXFYBVTK-SECBINFHSA-N 261.325 2.283 10 10 CECE CN(Cc1ccc(Br)cc1O)[C@H]1CCCNC1 691489856 YHEUVKILBYVCPN-LBPRGKRZSA-N 299.212 2.339 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H]1Cc2ccccc2O1 692839046 LDHQPRNRDJYEDK-DGCLKSJQSA-N 272.308 2.291 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3C[C@@]34CC[C@@H]4N)ccc21 2172521269 XBZZASWDONCNQE-HJWJTTGWSA-N 272.392 2.230 10 10 CECE CCCNCc1ccc(N2CC(C)(O)C2)c(Cl)c1 384057899 PDAGVCYHUAZCKF-UHFFFAOYSA-N 268.788 2.411 10 10 CECE C[C@H]1[C@H](O)CCCN1c1ccc(CN)c(Cl)c1 384952456 VMZOVPABOGLSIP-TVQRCGJNSA-N 254.761 2.148 10 10 CECE COc1ccc(O)c(CN[C@H](C)[C@H]2C[C@H]3CC[C@H]2O3)c1 386657740 LXSUQGBKHBFZQD-DSPGLSBSSA-N 277.364 2.446 10 10 CECE CCCNCc1ccc(N2CCSC[C@@H]2CO)c(C)c1 388012094 CVUAHBOZENIREX-HNNXBMFYSA-N 294.464 2.409 10 10 CECE CC(C)O[C@@]1(CNc2ccc(N)cc2)CCOC1 722348233 RVIYXQZWVBCNJR-CQSZACIVSA-N 250.342 2.265 10 10 CECE CC(C)OCOc1ccc(N2CCCNCC2)c(F)c1 394281576 SQVSUDFQHOGXBO-UHFFFAOYSA-N 282.359 2.387 10 10 CECE COCCNCc1ccc(N2CCCOC[C@H]2C)cc1 398900800 BQYIJBBXNVWUAE-CQSZACIVSA-N 278.396 2.038 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)Cc2cncs2)cc1 400022499 NRCCSXXHTNAXQW-OAHLLOKOSA-N 290.436 2.341 10 10 CECE C[C@H]1CCOCC[C@@H]1NCc1cc2c(cc1O)OCO2 2165412652 QZMYSKUOERZVDM-JQWIXIFHSA-N 279.336 2.026 10 10 CECE CO[C@@H]1C[C@@H](OC)CN([C@H](C)c2cc(F)ccc2O)C1 2165453498 ARBNDQRSPZKLMN-RAIGVLPGSA-N 283.343 2.328 10 10 CECE COc1cc(CN(C)c2ccc(CN)cc2F)ccn1 2167047276 YDIFOJYIFMMPNE-UHFFFAOYSA-N 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2336479451 VOHLUOHIYSGALM-DSSZZKGTSA-N 261.365 2.481 10 10 CECE COc1ccc(N2CCC3CC2(CN)C3)cc1OC 2340418901 AGOVXAJJMBLHRE-UHFFFAOYSA-N 262.353 2.021 10 10 CECE CC[C@H]1C[C@@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2341194657 WQWUHBVHPYWOHD-CABZTGNLSA-N 261.321 2.029 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)c1cnc(C)o1 2342794570 GFNZKUZCORXCLP-ZIAGYGMSSA-N 262.309 2.073 10 10 CECE CSc1cc(N2CCC=C[C@@]2(C)CO)ccc1CN 2353855333 JBFVPPFRCVAEIF-HNNXBMFYSA-N 278.421 2.385 10 10 CECE CSc1cc(N2CC[C@@H]3CCO[C@@H]3C2)ccc1CN 2353856509 BYNMCOJAPXVEDA-BXUZGUMPSA-N 278.421 2.482 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2C[C@H]1C[C@]2(C)O)c1c(O)cccc1O 2355726004 DAIYKGNYPYTJIN-ZKVGZHBLSA-N 277.364 2.298 10 10 CECE CN(C)c1ccc(CNC(=O)Nc2nncs2)cc1F 58515026 BMEFFELOUWQNPX-UHFFFAOYSA-N 295.343 2.065 10 10 CECE NC(=O)[C@@H]1CCCN1Cc1ccc(N2CCCCC2)cc1 179577516 ZMDUTHAYMNYCGN-INIZCTEOSA-N 287.407 2.127 10 10 CECE CC[C@@H]1CN([C@H](C)c2c(O)cccc2O)CCO1 300440842 JYAXVIAXQQMWTI-GHMZBOCLSA-N 251.326 2.270 10 10 CECE CCOc1ccccc1NC[C@H](O)COCCOC(C)C 37874960 IHZKKPKJSACJFI-AWEZNQCLSA-N 297.395 2.300 10 10 CECE CC(C)NS(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 127232334 VSUWNLDNGGCOOG-UHFFFAOYSA-N 299.179 2.354 10 10 CECE COc1cc(CN[C@H](C)c2ccc(C)cc2O)nn1C 312731955 HVNDUOCONSUAMY-LLVKDONJSA-N 275.352 2.294 10 10 CECE CCOC(=O)[C@](C)(N)c1ccc(N(CC)CC)cc1 1951803347 UTHXDBPVOHPWSF-OAHLLOKOSA-N 264.369 2.270 10 10 CECE Cc1cc(N2CCN(C)C[C@H]2C)ccc1/C=C\C(=O)O 312190559 XCRBUTVNYLWYKV-SCXUMTSISA-N 274.364 2.233 10 10 CECE COc1cc2c(cc1OC)N1CCSC[C@H]1CN2 213585273 LOSPRXXHJKXDIA-SECBINFHSA-N 266.366 2.051 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](C)OC[C@@H]2C)c(F)c1 217473274 PVTFGTXRDIRQEH-AXFHLTTASA-N 252.333 2.459 10 10 CECE COc1ccc(CN2CCC[C@H]2c2cnn(C)c2)c(O)c1 131962027 ZNUIVLTWLLGVRS-HNNXBMFYSA-N 287.363 2.471 10 10 CECE N[C@@H]1C(=O)Nc2cc(N(Cc3ccco3)C3CC3)ccc21 42693067 GHGGVBSNQBQWMR-HNNXBMFYSA-N 283.331 2.401 10 10 CECE CNC(=O)c1ccc(NCc2cccc(O)c2O)c(C)c1 41117494 GJQYJJKPHAOBLD-UHFFFAOYSA-N 286.331 2.378 10 10 CECE CCN(CC(F)(F)F)[C@H](C)C(=O)Nc1ccc(N)cc1 42737225 VQJLOGWCWWIAIK-SECBINFHSA-N 289.301 2.480 10 10 CECE CC[C@@H](C)N[C@H](CN)c1ccc2c(c1)CCCN2C 87911296 PVLJKTZZWVRJIO-IUODEOHRSA-N 261.413 2.457 10 10 CECE [N-]=[N+]=NCCN[C@@]1(C(=O)O)CCC[C@H](C(F)(F)F)C1 90256364 FYBALSWKKBDFET-CBAPKCEASA-N 280.250 2.462 10 10 CECE CC[C@H](C)N(CC(=O)O)[C@@H](C)c1c(O)cccc1O 234022168 MSSWEUGDTWBTDW-UWVGGRQHSA-N 267.325 2.344 10 10 CECE CC[C@@](C)(O)CN1CCOc2cc(N(C)C)ccc21 162137847 KLYKKJRVFOZMLC-OAHLLOKOSA-N 264.369 2.112 10 10 CECE CCCn1nncc1[C@H](NCC)c1ccc(N(C)C)cc1 97419043 OBRFHUUVYHZIOL-MRXNPFEDSA-N 287.411 2.453 10 10 CECE COc1ccc(O)c(C(=O)NCCCCN=[N+]=[N-])c1 231732025 GPLSMINCEVWXPP-UHFFFAOYSA-N 264.285 2.221 10 10 CECE NCC1(c2cc(O)c(O)c(Br)c2)CCC1 258373189 BKZJYZRHYPGSBB-UHFFFAOYSA-N 272.142 2.241 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCO[C@H]3CCC[C@H]32)cc1 250360723 SVUYWENRDBEOMA-IKGGRYGDSA-N 289.423 2.006 10 10 CECE CCOC(=O)c1nc[nH]c1N=Nc1c(C)nn(C)c1C 254372632 UIJGNGFUFHRZND-UHFFFAOYSA-N 276.300 2.352 10 10 CECE Cc1nc(C2CC2)oc1C(=O)NCc1ccc(O)c(O)c1 273710205 OGYZYFOEVGQFDR-UHFFFAOYSA-N 288.303 2.202 10 10 CECE COc1cc(O)c(CN2CCOCC[C@H]2C)cc1OC 367684347 MZNSGAUFCOVCNJ-LLVKDONJSA-N 281.352 2.020 10 10 CECE CC1(C)SC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 282625933 FZDPJBCXZVFHSB-NSHDSACASA-N 268.338 2.284 10 10 CECE C[C@H]1[C@H](C)[C@@H](N)CCN1c1ccc2c(c1)OCCO2 93031580 DYTBHQIFIUVUCX-GVXVVHGQSA-N 262.353 2.020 10 10 CECE CC(=O)C(=O)COC(=O)[C@H](c1ccc(F)cc1)C(C)C 808531820 YIWBJEHZUJFESQ-AWEZNQCLSA-N 280.295 2.267 10 10 CECE C[C@H](N[C@H]1CCN2CCC[C@H]1C2)c1cc(O)ccc1O 383602402 ZTSAGJFKSYBBSB-HUBLWGQQSA-N 276.380 2.233 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@@H]2CCN(C)C2=O)cc1 723194105 AILQDOSUFVMZKZ-SWLSCSKDSA-N 275.396 2.024 10 10 CECE CCN1CCc2cc([C@H](O)[C@]34CC[C@@H]3CCN4)ccc21 2163072523 YGYYWFQMJAXAJU-PVAVHDDUSA-N 272.392 2.245 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)[C@H](COC)OC 2163097334 NDLBNZXMXWKGQA-JKSUJKDBSA-N 278.396 2.209 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@H]2CNCC2(F)F)cc1 2163097681 QCGJSJACQSCQMO-ZIAGYGMSSA-N 284.350 2.421 10 10 CECE CO[C@H](C)[C@@](C)(O)[C@H](N)c1ccc(N2CCCC2)cc1 2163228866 IQPFCYQZAXTMAH-DAXOMENPSA-N 278.396 2.073 10 10 CECE CN[C@H](CC[C@@H](C)OC)[C@H](O)c1ccc(N(C)C)cc1 2165542401 QJGRJYGWVPFPAI-DAXOMENPSA-N 280.412 2.189 10 10 CECE CC[C@H](O)c1ccc(N2C[C@H](CO)OCC2(C)C)cc1 2167525062 SPDHOXJIMAPOAS-CABCVRRESA-N 279.380 2.106 10 10 CECE CC1(C)C[C@H](N)CN(c2ccc3c(c2)OCCCO3)C1 2162666228 CBJMBHKYYZNJRC-LBPRGKRZSA-N 276.380 2.412 10 10 CECE CNC(=O)[C@H]1CCN(Cc2cc(C(C)C)c(C)cc2O)C1 817370704 SCCRRHGFHLRXRF-ZDUSSCGKSA-N 290.407 2.392 10 10 CECE COc1cc(O)c(CN2C[C@@H](C)[C@H]2C)cc1OC 816648688 NOZVOTPBVISFNM-NXEZZACHSA-N 251.326 2.250 10 10 CECE COc1ccc(N(C)Cc2cncc(C(N)=S)c2)cc1 721586813 NTENGJDRSBVFTD-UHFFFAOYSA-N 287.388 2.361 10 10 CECE Cc1ccc(O)c(CN2C[C@H](N)[C@H](C(F)(F)F)C2)c1 720913112 UNAWDGKHWWZUIU-MNOVXSKESA-N 274.286 2.022 10 10 CECE CO[C@@H]1CC[C@@H]1C[C@@H](NN)c1ccc(N(C)C)cc1 2130377677 CIVQEVJWRDXJOO-BPLDGKMQSA-N 263.385 2.072 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H]3OCC[C@@H]3C2)cc1O 724825806 RPOCXPVXTSPEMD-OZVIIMIRSA-N 276.380 2.288 10 10 CECE C[C@H]1C[C@@H](CNC(=O)c2cccc(O)c2O)C[C@@H](C)O1 724463615 MKXDZIIFDKFGBB-URLYPYJESA-N 279.336 2.031 10 10 CECE COC[C@@](C)(O)CCN[C@H](C)c1cc(Cl)ccc1O 834844790 UYSXHIMBOLONSS-YGRLFVJLSA-N 287.787 2.484 10 10 CECE C[C@@H](CC(=O)NCc1ccc(O)cc1O)n1cccc1 910956563 XZDBWNGLMVQZFQ-NSHDSACASA-N 274.320 2.167 10 10 CECE O=C(NCc1ccc(N2CCSCC2)cc1)C1(F)CC1 843769401 XUHRATYLWUNOOK-UHFFFAOYSA-N 294.395 2.358 10 10 CECE Cc1cc(N(C)C)ccc1CN1C[C@@H]2CCC[C@H](C1)N2 843107544 RLULQGHIXKFUTP-IYBDPMFKSA-N 273.424 2.387 10 10 CECE COc1cccc([C@@H](C)N[C@H]2CCCOC2)c1O 846144417 JECYXKNDOWDSTN-MNOVXSKESA-N 251.326 2.230 10 10 CECE COc1ccc(O)c(CNC(=O)C2(C(F)F)CC2)c1 843832249 VIMYTPYAAJBSIA-UHFFFAOYSA-N 271.263 2.062 10 10 CECE COC(=O)[C@](C)(CCF)NCc1ccc(N(C)C)c(C)c1 852579186 YQOKNGDKMWYGNA-INIZCTEOSA-N 296.386 2.442 10 10 CECE COc1ccc(CN[C@@H]2C[C@@H](O)C23CCC3)cc1C 850388372 LVIXMJIIORILOE-HUUCEWRRSA-N 261.365 2.397 10 10 CECE O=C1[C@H](N[C@H]2CCc3cccc(O)c32)CCN1C1CCC1 858602583 CTAJPFPKYVFTEU-UONOGXRCSA-N 286.375 2.123 10 10 CECE C=Cn1cc(CN[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1 850345947 AEFKXFPJGLAFNQ-OAHLLOKOSA-N 298.390 2.361 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@H]4COC[C@@H]43)ccc21 1899113902 WHXCSPIROGLAAC-VBNZEHGJSA-N 259.349 2.281 10 10 CECE CC(C)(C)OC(=O)N1[C@H]2C[C@@H]1CN(CCCN=[N+]=[N-])C2 1954206820 MMDJGMGZDUNTSE-PHIMTYICSA-N 281.360 2.380 10 10 CECE CC1(C)CCC[C@@](CO)(NC(=O)c2cccc(O)c2O)C1 862845308 AQBIVKSQJZMICV-MRXNPFEDSA-N 293.363 2.159 10 10 CECE [N-]=[N+]=NCCCN(OCc1ccccc1)C1CNC1 1880638943 COCIFCPHQOCKHU-UHFFFAOYSA-N 261.329 2.092 10 10 CECE COC[C@@]1(C)CN(Cc2ccc(N(C)C)c(C)c2)CCO1 860199167 GKBBUEZOBMPDEM-QGZVFWFLSA-N 292.423 2.298 10 10 CECE Nc1ccc(CC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1 870983137 SXIQYUVLSZCGSG-OLZOCXBDSA-N 276.405 2.023 10 10 CECE COC1(CO)CCN(Cc2cc(Cl)cc(C)c2O)CC1 775205540 ZNVLMSQUQGTPAL-UHFFFAOYSA-N 299.798 2.327 10 10 CECE CC(C)(O)C[C@H](O)CNc1ccccc1OCC(F)F 872211482 CNVONODMTPBBLK-JTQLQIEISA-N 289.322 2.264 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H](C(=O)O)C(F)(F)C1 700511890 MGLUHJQKEWSCKE-SCZZXKLOSA-N 271.263 2.105 10 10 CECE COc1cc(C)cc(CN2C[C@@H](O)CC[C@H]2C)c1O 895033843 MBUSUCFKZLFXCG-YPMHNXCESA-N 265.353 2.054 10 10 CECE Oc1cccc([C@H]2NCCc3cccc(F)c32)c1O 83622171 OCZJNCQJTMTSJD-CQSZACIVSA-N 259.280 2.472 10 10 CECE CN[C@@H](C)c1ccc(N2CC([C@@H](C)O)C2)cc1Cl 719786520 VIYSMZNBSSQYMM-VHSXEESVSA-N 268.788 2.437 10 10 CECE C[C@@H](O)c1ccc(N2CC([C@@H](C)O)C2)cc1Cl 719897402 OZAVJKIEKMTEIU-RKDXNWHRSA-N 255.745 2.210 10 10 CECE C[C@@H](O)c1ccc(N2CCS[C@@H](CCO)C2)cc1 719998719 MVDBSBJOFFMQDE-RISCZKNCSA-N 267.394 2.044 10 10 CECE CCNCc1ccc(N(C)Cc2cnccn2)cc1 704160983 NHEYPTZWASGVNV-UHFFFAOYSA-N 256.353 2.223 10 10 CECE CCN(CC(=O)N(C)c1ccc(N)cc1)C[C@@H]1C[C@H]1C 704726945 DILXDFYEEMFHOL-OLZOCXBDSA-N 275.396 2.210 10 10 CECE CNCc1ccc(N(C)C[C@H]2CCCN(C)C2)c(C)c1 705153884 JJESTENFULBPSQ-INIZCTEOSA-N 275.440 2.492 10 10 CECE C[C@@H]([C@H]1CCCCO1)N(C)Cc1cc(N)ccc1O 705950730 KNNZMHCRFLECQI-XHDPSFHLSA-N 264.369 2.364 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@H](C)[C@H]2CO)cc1O 688645930 LPQMRIRIFQGERI-LALPHHSUSA-N 278.396 2.270 10 10 CECE CCOc1cccc(CN[C@H]2CCC2(OC)OC)c1O 711423269 DLWRULVGTVQTIM-ZDUSSCGKSA-N 281.352 2.032 10 10 CECE COc1ccc([C@H](C)NCCc2cc[nH]n2)c(O)c1 714502143 ULIGVCYKKLYZLJ-JTQLQIEISA-N 261.325 2.017 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@H]1Cc2ccccc21 1142533810 RMDQPXLKLWKODT-AWEZNQCLSA-N 269.300 2.054 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2ncccn2)c(F)c1 718907601 XKAVLSLCULOYQV-JTQLQIEISA-N 261.300 2.305 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)C1CCCCC1 692806763 OMYLSEVBYJRFTE-SNVBAGLBSA-N 272.374 2.424 10 10 CECE CCC(F)(F)CN(C)CC(=O)c1ccc(O)c(O)c1 693695137 BXLRHEZMGHADSU-UHFFFAOYSA-N 273.279 2.258 10 10 CECE CN(C)CCOc1ccc(N(C)Cc2cocn2)cc1 763192775 KOJSPNGOBGHLLT-UHFFFAOYSA-N 275.352 2.251 10 10 CECE CCN(CC(=O)Nc1ccc(N)cc1)C[C@@H]1C[C@@H]1C 698403417 WJLAEASCUXXKQQ-RYUDHWBXSA-N 261.369 2.185 10 10 CECE COc1ccc([C@H](C)N[C@@H]2COC[C@@H]2C)c(O)c1 699837742 PDRGRNZHLXAGNO-OUJBWJOFSA-N 251.326 2.086 10 10 CECE CC(C)NCc1ccc(N(C)[C@@H]2CCNC2=O)c(Cl)c1 1916817674 DWDGRKHVJIIDKV-CQSZACIVSA-N 295.814 2.163 10 10 CECE CCNCc1ccc(N(C)C[C@@H]2OCC[C@H]2F)cc1 2122547800 DGJUNWJOVGTHQE-CABCVRRESA-N 266.360 2.359 10 10 CECE CC1(C)CCCN(Cc2c(O)cccc2F)[C@H]1CN 2127913371 XTHNBBXCWBXDIL-AWEZNQCLSA-N 266.360 2.481 10 10 CECE CC[C@H](O)CN(CC)c1ccc2c(c1)CC[C@@H]2NC 2128294793 AGVXTLJCUQOUAM-HOCLYGCPSA-N 262.397 2.491 10 10 CECE C[C@]1(O)CCCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128276722 FJBQXUCIPNLLIX-CVEARBPZSA-N 261.365 2.408 10 10 CECE CC1(C)C[C@@H](CO)N(c2ccc3c(c2)CC[C@H]3N)C1 2128294105 JJAWAJNKWLNZDE-DZGCQCFKSA-N 260.381 2.230 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3N)C[C@@H]1CO 2128273417 WDDBHZKNYSTZLO-KFNAQCHYSA-N 260.381 2.087 10 10 CECE CO[C@H]1CCN(c2ccc3c(c2)CC[C@H]3N)C[C@@H]1C 2128315119 OHMSAXSRNXBHIR-XZJROXQQSA-N 260.381 2.494 10 10 CECE N[C@@H]1CCc2cc(N3C4CCC3(CO)CC4)ccc21 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295.814 2.322 10 10 CECE COc1ccc(N(C)CC2(O)CCC2)c(OC)c1C 2278061618 OIDWOAAGEYDVIM-UHFFFAOYSA-N 265.353 2.363 10 10 CECE COCC[C@H](COC)NC/C=C\c1ccc(N(C)C)cc1 835056017 RCCIMPAHGVNRDG-OGZRUICASA-N 292.423 2.407 10 10 CECE CCCN1CCC[C@H](C(=O)N2Cc3cccc(O)c3C2)C1 913726848 YHNZCYPULUFKRS-AWEZNQCLSA-N 288.391 2.356 10 10 CECE Oc1c(Cl)cccc1CN1C[C@@H]2CCC[C@H](C1)N2 843104852 CBIKIVDZRSDAKN-TXEJJXNPSA-N 266.772 2.372 10 10 CECE O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCOCC1 846473026 HPJYKJFMYFWWBS-JTQLQIEISA-N 283.755 2.479 10 10 CECE CC[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)c(F)c1 844938484 UYOAUNISJSGXPH-GFCCVEGCSA-N 268.332 2.187 10 10 CECE CCc1nc([C@H](C)OC(=O)c2cc(O)cs2)n[nH]1 849728288 PSBVGTKRXIPDPO-LURJTMIESA-N 267.310 2.052 10 10 CECE C[C@H](NC[C@@H]1CNCCC1(F)F)c1ccccc1O 925774967 BATYDBIBDCQGTI-QWRGUYRKSA-N 270.323 2.288 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N3CCCCCCC3)cc21 131342509 JUQXPNUCLSEGAY-OAHLLOKOSA-N 273.380 2.433 10 10 CECE C[C@@H]1CCCCCN1c1ccc2c(c1)N(C)C(=O)[C@@H]2N 131398573 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790070898 KQUNDSKHEHCXOT-QMMMGPOBSA-N 291.278 2.434 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)CCc1ccncc1 701291462 MYIZYRNWGMSQSL-GFCCVEGCSA-N 259.313 2.316 10 10 CECE CC[C@H]1COC[C@@H]1N(C)c1c(F)cc(CO)cc1F 688238156 NYODRLORQOXIMU-GWCFXTLKSA-N 271.307 2.318 10 10 CECE CN1CCCc2cc(CN3CCC(C)(N)CC3)ccc21 704551486 NJOJZMNIOHIUHW-UHFFFAOYSA-N 273.424 2.382 10 10 CECE Cc1noc(CNCc2c(O)cccc2Br)n1 706834357 ZNDXKGQMJCHPRH-UHFFFAOYSA-N 298.140 2.136 10 10 CECE C[C@H](O)[C@H]1CCCN(c2ccc(CN)c(F)c2F)C1 688917076 PULMVTZAGQZBMQ-ONGXEEELSA-N 270.323 2.021 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)NC 61317162 IQBHVMYXDJDYEM-UHFFFAOYSA-N 277.412 2.099 10 10 CECE CSc1c(C(=O)N(C)Cc2ccccc2O)cnn1C 790772264 LQBIWJZIWIQJMX-UHFFFAOYSA-N 291.376 2.120 10 10 CECE CCC[C@H](CCO)NCc1ccc(F)c(F)c1O 716826099 CIAKQSFTCBLZFI-SNVBAGLBSA-N 259.296 2.311 10 10 CECE CN1C(=O)[C@@H](O)c2ccc(N3CCC34CCCC4)cc21 687866266 NEYDNSJQNJXLOW-AWEZNQCLSA-N 272.348 2.219 10 10 CECE CCc1cccc(CN[C@H](CC(C)C)C(=O)NC)c1O 691437283 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C[C@H](NC(=O)c1cccc(O)c1O)C1CC2(CC2)C1 2127990187 QTUNCPJTNSXJPP-VIFPVBQESA-N 261.321 2.406 10 10 CECE C/C=C/C[C@@H](N)[C@H](O)c1ccc2c(c1)CCCN2C 2120760094 UPXZPKFLGBNCJG-YMBFEGSUSA-N 260.381 2.396 10 10 CECE Nc1ccc(CC[S@](=O)CCOCCC2CC2)cc1 2127763844 LDLABQIMEQVELJ-IBGZPJMESA-N 281.421 2.377 10 10 CECE COC[C@H]1CC[C@@H](C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2125335592 DMQDOVMXFOZRDR-WDEREUQCSA-N 266.345 2.350 10 10 CECE CN(Cc1nccn1C)c1ccc2c(c1)CC[C@@H]2N 2128327413 MTIUNBSOARYTKU-AWEZNQCLSA-N 256.353 2.003 10 10 CECE CN(C)C[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128318400 LJHRBPDJLCRCDP-WBMJQRKESA-N 259.397 2.021 10 10 CECE CC(C)(C)[C@@H]1[C@@H](O)CCN1c1ccc(CN)c(F)c1 2128687289 PBVPYECZPJYFHS-KBPBESRZSA-N 266.360 2.270 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2[C@H]2CC[C@H]3O2)c(F)c1 1901498569 ZHIXFZYHEXEUFE-BYNSBNAKSA-N 262.328 2.183 10 10 CECE Cc1cc(CN(C)c2ccc(CN)cc2)nnc1C 2129256763 DJPSJIZARRHOHB-UHFFFAOYSA-N 256.353 2.189 10 10 CECE CO[C@@]1(CN(C)c2ccc(CO)c(C)c2)CCSC1 2129656861 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10 10 CECE CN(CCN=[N+]=[N-])CC(=O)Nc1nc2ccccc2s1 1912195763 QTGPUJLODABHPI-UHFFFAOYSA-N 290.352 2.477 10 10 CECE C[C@H](C(=O)NC1CCCC1)N1CCC[C@@H](CN=[N+]=[N-])C1 1912202659 KSVJWHYWCGGMPW-NEPJUHHUSA-N 279.388 2.456 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134501359 JLKSLXAQNWGFGO-JCILWVLBSA-N 258.365 2.308 10 10 CECE CC1(C)C[C@@](C)(C(=O)O)CN1Cc1ccc(N)cc1 2134876129 GFCBLORUKARZBY-OAHLLOKOSA-N 262.353 2.344 10 10 CECE CCn1ccnc1CN(C)c1ccc(CN)c(C)c1 1913355661 KIIZFDUAQUGJOS-UHFFFAOYSA-N 258.369 2.307 10 10 CECE CCCNCc1ccc(N(C)[C@H](C)CCO)cc1 1917042631 FRNQBHNYQIIGHQ-CYBMUJFWSA-N 250.386 2.393 10 10 CECE CNCc1ccc(N2CC[C@@]3(CCC[C@H]3O)C2)c(F)c1 1918918669 BBPAPYFZVGIIBF-CVEARBPZSA-N 278.371 2.286 10 10 CECE O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCc1cc(O)ccc1O 1471661055 GCZGGDQAVVQUAE-KWBADKCTSA-N 261.321 2.150 10 10 CECE CC[C@H]1CC[C@@H](CNCc2cc(OC)ccc2O)O1 2136776508 ZTUDZYXXUMVKSM-JSGCOSHPSA-N 265.353 2.448 10 10 CECE Cc1cccc(C(=O)NCc2c(O)cccc2O)c1O 1472064394 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STNRURGSVRTBLA-MRXNPFEDSA-N 260.381 2.374 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H]2[C@@](C)(O)C3)c(C)c1 2339655548 FIQDOKMTXSNPFK-BPUTZDHNSA-N 260.381 2.064 10 10 CECE Cc1c([C@H](C)N)ccc(N(C)C[C@@H]2CCN2C)c1C 2340850576 IQAOPBNTBPOXRY-KBPBESRZSA-N 261.413 2.463 10 10 CECE CCCN(CC(N)=O)c1ccc([C@@H](C)O)c(C)c1C 2340853997 XHQWDAVOSZJJMR-GFCCVEGCSA-N 264.369 2.058 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC=C[C@]2(C)CO)c1C 2340855876 IKRQJHQSIYDRCY-XJKSGUPXSA-N 261.365 2.484 10 10 CECE CN(C[C@@H]1CCO1)c1ccc(C=CC(=O)O)cc1F 2341150868 VUVFEVRZKUTOND-NSHDSACASA-N 265.284 2.149 10 10 CECE CC[C@](C)(CN(C)c1ccc(CN)cc1)C(=O)OC 2343208378 MRUIIGBMPZJLOF-OAHLLOKOSA-N 264.369 2.171 10 10 CECE C[C@@H]1CSC[C@@]1(C(=O)O)N(C)Cc1ccccc1O 2345600353 LPZGLRYVGRNLBQ-QMTHXVAHSA-N 281.377 2.030 10 10 CECE CN(Cc1ccccc1O)C1(C(=O)O)C[C@H]2C[C@@H]2C1 2351138968 GAACIEYUUXQSBP-VXGBXAGGSA-N 261.321 2.077 10 10 CECE Nc1ccc(OCCC(=O)N[C@H]2C[C@@H]3CC[C@H]2C3)cc1 2354299266 XMTBPPHXGPAOHK-XUJVJEKNSA-N 274.364 2.343 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(CC)[C@@H](C)COC)ccc21 105485933 ZUUYOHCRWBYYFO-XHDPSFHLSA-N 291.395 2.151 10 10 CECE CCC(O)(CC)CNCc1ccc(OC)cc1O 112017937 GMFCRYIKWBZZLU-UHFFFAOYSA-N 253.342 2.042 10 10 CECE CCNCc1cc(F)c(N2C[C@H](C)C[C@@H](O)C2)c(F)c1 401729170 BYOWZLOSRPNPRI-ZYHUDNBSSA-N 284.350 2.281 10 10 CECE CC[C@H]1C(=O)NCCN1c1ccc(CNC(C)C)c(C)c1 110683037 JPTZJSXZFFMJFL-INIZCTEOSA-N 289.423 2.208 10 10 CECE C[C@@H](N[C@H](C)c1nnc2n1CCC2)c1cc(O)ccc1O 37149203 GJMORVAEKNNVPG-NXEZZACHSA-N 288.351 2.047 10 10 CECE Cc1ccc([C@H](C)NC[C@@H](C)N2CCOCC2)c(O)c1 184935636 GBBBFYQWBDABFX-KGLIPLIRSA-N 278.396 2.072 10 10 CECE CCN(CC)c1ccc(CN[C@@H]2CCC(=O)N(C)C2)cc1 77900120 XFZQBDXEMIPOHM-OAHLLOKOSA-N 289.423 2.243 10 10 CECE O=CNc1cccc2c1C(=O)c1ccccc1C2=O 34101638 OSKSYESYIGCEOW-UHFFFAOYSA-N 251.241 2.030 10 10 CECE Nc1ccc(OCCn2c(=O)cnc3ccccc32)cc1 36671566 GFTCUGOLSZBQEX-UHFFFAOYSA-N 281.315 2.058 10 10 CECE [N-]=[N+]=CC(=O)c1[nH]c2ccccc2c1Br 37632829 WWBKDKKLKDNQBD-UHFFFAOYSA-N 264.082 2.414 10 10 CECE CON(CCC(=O)Nc1ccc(N)cc1)CC(C)C 311605755 PFRZTRHXWQUHQK-UHFFFAOYSA-N 265.357 2.117 10 10 CECE CCN(Cc1ccccn1)c1ccc2c(c1)NC(=O)[C@@H]2N 123306833 UZVHDTQKAPTCDI-OAHLLOKOSA-N 282.347 2.060 10 10 CECE COc1cc([C@@H](C)C2CCNCC2)cc(O)c1O 1952144556 URJQGEKKNPZIJT-VIFPVBQESA-N 251.326 2.210 10 10 CECE CCOC(=O)[C@@H](CCSCC)NCCCN=[N+]=[N-] 132705740 DWKSOCNZRRESSN-SNVBAGLBSA-N 274.390 2.351 10 10 CECE CCOC(=O)[C@@H](C)N[C@H](CC)c1ccccc1O 49368312 IGUQKAGGNXUOPQ-ZYHUDNBSSA-N 251.326 2.385 10 10 CECE Nc1ccc(CCC(=O)N2CCO[C@@H]3CCCC[C@@H]32)cc1 42271739 HOHBTTNKSKNLOE-JKSUJKDBSA-N 288.391 2.371 10 10 CECE CC(C)N[C@@](C)(C[C@H](C)Sc1nccs1)C(N)=O 84351627 QFCDGKJAWURREU-CABZTGNLSA-N 287.454 2.256 10 10 CECE c1csc(SCCCN[C@@H]2CCCOC2)n1 132271021 SQIKBWKCCSMGAM-SNVBAGLBSA-N 258.412 2.394 10 10 CECE CC(C)NCc1ccc(N(CC(N)=O)C2CCCC2)cc1 42438381 WMUFAVHTGLMBOZ-UHFFFAOYSA-N 289.423 2.419 10 10 CECE C[C@H]1CN(C)CC[C@@H]1N(C)Cc1cccc(F)c1O 290645630 YUDBNYAXGDNTLW-FZMZJTMJSA-N 266.360 2.303 10 10 CECE Cc1cc(Cl)cc(CN2CCOC[C@@]23CCOC3)c1O 195018116 BIAILPJBCUKDMQ-HNNXBMFYSA-N 297.782 2.345 10 10 CECE CC(C)(C)[C@@H](CO)NCc1ccc(N2CCOCC2)cc1 194635052 VIPCVNDAZKTXGR-MRXNPFEDSA-N 292.423 2.020 10 10 CECE CC[C@H](C(=O)O)N(C)[C@@H](C)c1cc(F)ccc1O 94622283 ALDQQJVFCCRCIT-GZMMTYOYSA-N 255.289 2.387 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@]1(C)CC1(C)C 2273137201 PBACTUQRKLRUIG-OAHLLOKOSA-N 263.337 2.401 10 10 CECE N[C@H]1CCCc2cc(I)cc(O)c21 238587214 HRYGEUAFUSBUAV-QMMMGPOBSA-N 289.116 2.333 10 10 CECE COc1ccc([C@@H](C)NCCCC(=O)NC2CC2)c(O)c1 92987449 JYMVIGGALPUGLY-LLVKDONJSA-N 292.379 2.110 10 10 CECE CN(C[C@@H]1CCCN1C)c1ccc(CN)cc1Cl 92620468 KLXGWMZFUCODJC-LBPRGKRZSA-N 267.804 2.329 10 10 CECE COCCNCc1ccc(N(C)[C@H]2CCCC[C@H]2O)cc1 252937498 YIHTYNHINVLKLB-DLBZAZTESA-N 292.423 2.162 10 10 CECE CNC[C@@H]1CCN([C@H](C)c2ccc(F)cc2O)C1 251578190 VQOXNSHBVFQIAO-MNOVXSKESA-N 252.333 2.134 10 10 CECE CCOC(=O)Cc1c(Br)cc(F)c(O)c1O 260453910 JGHOFMIUXUUAKL-UHFFFAOYSA-N 293.088 2.105 10 10 CECE CC[C@@H](N[C@@H](C)Cn1cncn1)c1ccc(F)cc1O 286246320 UFKNNJRCPUWSQT-GXFFZTMASA-N 278.331 2.252 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CCNC[C@@H]3C)ccc21 2163071848 SAVATMYLVLUDOJ-MJEQTWJJSA-N 274.408 2.348 10 10 CECE CCN1CCc2cc([C@@H](NC)[C@@H]3CSCCO3)ccc21 2163073629 KVUHARXMNYRNOT-JKSUJKDBSA-N 292.448 2.462 10 10 CECE CN1CCCc2cc([C@]3(O)CN[C@H]4CCC[C@@H]43)ccc21 2163105494 JSMUGBSBCJEDGK-YQQAZPJKSA-N 272.392 2.029 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H](O)C3CC(F)(F)C3)ccc21 2163141420 ULOLSEUMMGRTRL-KGLIPLIRSA-N 282.334 2.085 10 10 CECE CN1CCc2cc([C@@H](NN)C3CC4(CSC4)C3)ccc21 2163157373 BTMUGVRUTHAHGD-OAHLLOKOSA-N 289.448 2.327 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](OC)C[C@@H](OC)C2)cc1 2165506911 LNNMAOHCTCNDMA-WQVCFCJDSA-N 278.396 2.207 10 10 CECE CCOc1ccc(O)c(CN[C@@H](CC)[C@@H](O)C(F)F)c1 294955520 DMILLKQZVIORLE-WCQYABFASA-N 289.322 2.285 10 10 CECE O=C(N[C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)c1ccc(O)c(O)c1 2165985668 IZYPSOCYWVXJRP-KXUCPTDWSA-N 283.274 2.261 10 10 CECE CC(C)(F)C(=O)Nc1ccnn1-c1ccc(N)cc1 394026952 CKXVCVZTTAFBBN-UHFFFAOYSA-N 262.288 2.141 10 10 CECE C[C@H](N[C@H]1CNCC[C@H]1C)c1ccc(N(C)C)cc1 817968703 WFRCLRFWKARZHN-WWGRRREGSA-N 261.413 2.401 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H]2[C@@H](C1)[C@@H]2C(=O)O 721172423 GZFOKQHILVRXSZ-PQFRYHKHSA-N 261.321 2.106 10 10 CECE CCN(C)c1ccc(CN2CCC[C@H](O)[C@@H]2C)cc1 831255537 PTULJEVBAZWREU-BBRMVZONSA-N 262.397 2.488 10 10 CECE CCO[C@@H]1[C@@H](C)[C@H]1C(=O)N[C@@H](C)c1ccccc1O 913763436 GVOCHUCFABDXIA-DUBDDPSESA-N 263.337 2.240 10 10 CECE C[C@H]1CCNC[C@@H]1NCc1cc(Cl)cc(F)c1O 841059571 UNOHLODDPGBTLI-UFBFGSQYSA-N 272.751 2.272 10 10 CECE COC(C)(C)CCNC(=O)NCc1c(O)cccc1F 923897528 YJZZZMADPHFSPD-UHFFFAOYSA-N 284.331 2.146 10 10 CECE Nc1ccc(CCNC(=O)Cc2cc(C3CC3)no2)cc1 852794670 BBODZYPWZCUOAA-UHFFFAOYSA-N 285.347 2.036 10 10 CECE c1cc(N2CCCC2)ccc1OC[C@@H]1COCCO1 853675309 QVJGVBHXMMQIHW-HNNXBMFYSA-N 263.337 2.081 10 10 CECE Nc1ccnc(CN[C@H]2CCc3cccc(O)c32)c1 925768433 UNIPDGJSTZZBQO-ZDUSSCGKSA-N 255.321 2.147 10 10 CECE COc1ccc(N2CC[C@H](NC3CCC(O)CC3)C2)cc1 850489989 ZKVVIDFRCRGCNT-BBBYJDLNSA-N 290.407 2.167 10 10 CECE CC(=O)C(=O)COC(=O)/C(C)=C/C1CCC(C)CC1 869771507 DKIGMECXTUHVHP-DHZHZOJOSA-N 266.337 2.460 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCCC[C@@H]2O)c(C)c1 132042542 GYGHUKPVEYATMV-CVEARBPZSA-N 262.397 2.454 10 10 CECE CCOC(=O)CCC[C@H](N)c1ccc(N(C)C)cc1 75455044 HHAFYVVVCDXSSZ-AWEZNQCLSA-N 264.369 2.486 10 10 CECE COc1ccc2c(c1)NCCN2Cc1ccc(C(=O)O)o1 76926873 TWGSGWCKNNQSEC-UHFFFAOYSA-N 288.303 2.419 10 10 CECE CO[C@H](CCNCc1ccccc1O)C(F)(F)F 786824606 XFTADAVIQBJMPM-LLVKDONJSA-N 263.259 2.449 10 10 CECE COc1cc2c(cc1OC)N(CCC(=O)O)CC[C@H]2C 84805682 NEUIQOVAILUMNV-SNVBAGLBSA-N 279.336 2.492 10 10 CECE COC1(OC)CC[C@H]1N[C@H](C)c1ccccc1O 711012660 MZZRCQAZBPYCDF-ZWNOBZJWSA-N 251.326 2.194 10 10 CECE CN(Cc1ccccc1O)C[C@H](O)c1ccc(F)cn1 799307625 NFIAZPKVVFZMQT-HNNXBMFYSA-N 276.311 2.092 10 10 CECE C[C@@H](C(=O)N(C)c1ccc(N)cc1)[C@H]1CCCCO1 711866020 DZAUMUNTCHKPKZ-BXUZGUMPSA-N 262.353 2.437 10 10 CECE O=C(N[C@@H]1C[C@@H]2CCCC[C@H]21)c1cccc(O)c1O 712571683 KNHPOPNKWJWCHU-HOSYDEDBSA-N 261.321 2.406 10 10 CECE CN[C@H]1CCN(c2ccc(CN(C)C)cc2)[C@H](C)C1 689484997 ZPYLVFSFXLMYIW-HIFRSBDPSA-N 261.413 2.325 10 10 CECE C[C@@H]1CC[C@@](NCCCN=[N+]=[N-])(C(=O)O)CS1 689459223 AXCZNFUNEPDRRG-SCZZXKLOSA-N 258.347 2.015 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)C1CC2(CSC2)C1 718370286 KXFXQFMCONZQFB-UHFFFAOYSA-N 276.405 2.370 10 10 CECE Nc1ccc(O)c(CNC(=O)OCCC(F)(F)F)c1 686850412 HTWYNTUXEHHDPJ-UHFFFAOYSA-N 278.230 2.153 10 10 CECE COc1ccc(CN[C@@H]2CO[C@H](C(C)C)C2)c(O)c1 691500485 GOFGLTFRYLYYOW-WFASDCNBSA-N 265.353 2.304 10 10 CECE COCC1(CN[C@H](C)c2cc(O)ccc2O)CC1 691852438 TXAKPXCLTXMVAE-SNVBAGLBSA-N 251.326 2.175 10 10 CECE COc1ccc(C(=O)NCc2cccc(O)c2O)cc1C 1153798624 SLUXUXPQIIPTLO-UHFFFAOYSA-N 287.315 2.345 10 10 CECE C[C@H](NC(=O)CCc1cnc(N)s1)c1ccccc1O 877257063 KOSSKTDZOFQJFX-VIFPVBQESA-N 291.376 2.241 10 10 CECE C[C@H](NCCc1nccn1C)c1cc(F)ccc1O 94617813 QRTPYJWROSXRJH-JTQLQIEISA-N 263.316 2.158 10 10 CECE CCCN[C@H](C)c1ccc(N(C)[C@@H](C)C(=O)NC)cc1 1916819679 XZTMFAJOONDHBG-OLZOCXBDSA-N 277.412 2.318 10 10 CECE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2C=CCC2)cc1 1165667177 IWZRMHGGXQZEEL-SNVBAGLBSA-N 258.281 2.297 10 10 CECE CN1CC[C@@H]2[C@H]1CCCN2Cc1cc(F)ccc1O 2127341002 GVFJNQZMCQQNBM-ZIAGYGMSSA-N 264.344 2.200 10 10 CECE CN(CCC1(C)CC1)S(=O)(=O)Cc1ccc(N)cc1 2123189245 HOUDRZSYTMGKDR-UHFFFAOYSA-N 282.409 2.221 10 10 CECE C[C@@H](N[C@H](CO)c1cscn1)c1ccc(F)cc1O 2119001525 LBPPOMROVVVAIR-LDYMZIIASA-N 282.340 2.372 10 10 CECE CO[C@H]1C=C[C@](N)(c2ccc(N3CCCC3)cc2)C1 2119424079 MGIJOFOBPJBABI-JKSUJKDBSA-N 258.365 2.416 10 10 CECE CCN(C)C(=O)[C@H](C)NCc1ccc(Cl)cc1O 1657949642 OIXZWKMWVPVXJK-VIFPVBQESA-N 270.760 2.002 10 10 CECE Nc1ccc(C[C@H](O)c2ccc3cncn3c2)cc1 2120375799 MEXKIEXBUCQTMA-HNNXBMFYSA-N 253.305 2.193 10 10 CECE CC=C(C)[C@@H](NC)[C@@H](O)c1ccc2c(c1)CCN2C 2120359297 CITRLIBUDPDPCU-CVEARBPZSA-N 260.381 2.267 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3[C@@H]2C[C@H]3O)c(F)c1 2121682267 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Nc1ccc(CN(CC(=O)O)C2CCCCC2)cc1 2272424032 SVFBJHYTMQWJJX-UHFFFAOYSA-N 262.353 2.488 10 10 CECE Cc1cc(N(C)Cc2ccnnc2)ccc1[C@H](C)O 2274306911 OBSWUCKHDGDLTM-LBPRGKRZSA-N 257.337 2.475 10 10 CECE Cc1cccc(CNC(=O)NC2CCSCC2)c1O 2265358908 LDXBUCGBUSOUMT-UHFFFAOYSA-N 280.393 2.395 10 10 CECE Cc1nscc1C[C@@H](NN)c1ccc(N(C)C)cc1 2265402251 YEGNAPMSKHSGDA-CQSZACIVSA-N 276.409 2.265 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC(F)(F)C[C@H]2CN)c1 2278905620 RURSOZAGFLBXKC-QWRGUYRKSA-N 270.323 2.430 10 10 CECE COc1ccc(N2CC=CCC23CNC3)c(C)c1C 2269174726 CIBWHBUCAMORHV-UHFFFAOYSA-N 258.365 2.420 10 10 CECE CCN1C[C@@H]2C[C@H]1CN2c1ccc([C@@H](C)N)c(C)c1 2269664018 WNWDAKSZJYVEOG-SNPRPXQTSA-N 259.397 2.298 10 10 CECE Cc1cc(N(C)Cc2cncnc2)ccc1[C@@H](C)O 2269687510 KLEWLKVGFCWXQM-GFCCVEGCSA-N 257.337 2.475 10 10 CECE CN1CCc2cc([C@@H](N)c3nccn3C(F)F)ccc21 2280081297 BHZFGYZENFVGSG-GFCCVEGCSA-N 278.306 2.319 10 10 CECE COc1ccc(N2CC[C@H](OC)C[C@H]2CN)c(C)c1C 2284531385 OSVFVNGKALMXFD-KBPBESRZSA-N 278.396 2.255 10 10 CECE 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C[C@H](CN)c1cc(Br)c(F)c(O)c1O 258548829 WBVOEIDTAQSZFV-SCSAIBSYSA-N 264.094 2.062 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCN(C)C[C@H]1C 253290231 POXZQXVWVUKMCC-RISCZKNCSA-N 291.395 2.198 10 10 CECE CC(=O)N1CCN(Cc2cc(C)c(C)cc2O)[C@@H](C)C1 271175203 JFMFMVWWHTUXNX-ZDUSSCGKSA-N 276.380 2.062 10 10 CECE CN1CCc2cc([C@@H](O)CNCCC(F)(F)F)ccc21 2163067412 WRZGVMCSLLRROO-ZDUSSCGKSA-N 288.313 2.254 10 10 CECE CCN1CCc2cc(C3(O)C[C@H]4COC[C@@H]4C3)ccc21 2163069592 QZUDJTRUCZDUPE-KBPBESRZSA-N 273.376 2.313 10 10 CECE C[C@H]1CN[C@H](C)C[C@]1(O)c1ccc(N2CCCC2)cc1 2163113339 KJBOKZNGKDRCBF-JJRVBVJISA-N 274.408 2.492 10 10 CECE CN(C)c1ccc([C@@H](N)[C@H](O)c2ccc(F)cn2)cc1 2163134924 DWMKAYXKUOKFCI-HUUCEWRRSA-N 275.327 2.020 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@](C)(O)CCCOC 2163138858 ROCLHPAETKGNJA-HOTGVXAUSA-N 280.412 2.191 10 10 CECE CC1CC(C)([C@@H](O)[C@@H](N)c2ccc3c(c2)CCN3C)C1 2163144141 LOFCZYWHAVZKLP-SWSPDFSFSA-N 274.408 2.476 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(Cl)c2cccnc12 808505074 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Nc1ccc(O)c(CN=c2[nH]cnc3cscc23)c1 1885882223 WXSPPMMCBQTQEJ-UHFFFAOYSA-N 272.333 2.013 10 10 CECE C[C@H](O)c1ccc(N(CC(F)F)C2COC2)c(F)c1 1886820291 WYEXYEOIIZFILD-QMMMGPOBSA-N 275.270 2.349 10 10 CECE Oc1ccc(F)cc1CNC1([C@@H]2CCCO2)CC1 1963630168 QIQLJUNPMDXAPE-ZDUSSCGKSA-N 251.301 2.333 10 10 CECE CCN(CC1CCOCC1)C(=O)Cc1ccc(N)cc1 1964371302 CQZWSPHAXDQAIZ-UHFFFAOYSA-N 276.380 2.086 10 10 CECE CCc1nc(CNCc2ccc(F)cc2O)co1 1964575461 FNYBXANAGVRBOF-UHFFFAOYSA-N 250.273 2.372 10 10 CECE CNC[C@@H]1CCCN([C@H](C)c2cc(OC)ccc2O)C1 251697997 MVOYQKJJPCGHFU-OLZOCXBDSA-N 278.396 2.393 10 10 CECE C[C@H]1CN2CCC[C@H]2CN1c1c(F)cc(CN)cc1F 251676564 HQCCDYUAIIGIEU-JQWIXIFHSA-N 281.350 2.096 10 10 CECE CN[C@@H](c1ccsn1)[C@@H](O)c1ccc2c(c1)CCN2C 2147691471 FFKOHGCCISQDMG-GJZGRUSLSA-N 289.404 2.130 10 10 CECE CN[C@@H](C)c1ccc(N2CCCCC[C@H]2CO)cc1O 253180338 SVHYYPSVIDEFQL-JSGCOSHPSA-N 278.396 2.414 10 10 CECE CC1CC(CO)(NCc2ccc(Cl)cc2O)C1 1972493744 VADBNOSTDVKFAJ-UHFFFAOYSA-N 255.745 2.296 10 10 CECE CNC(=O)CC1CCN(c2ccc([C@@H](C)O)cc2)CC1 2145057166 IYCSJRRHMVKODC-GFCCVEGCSA-N 276.380 2.092 10 10 CECE Cc1ccc([C@H](C)NCc2ncc(C(N)=O)s2)c(O)c1 1974366842 CRNLZQHVAGEVIU-VIFPVBQESA-N 291.376 2.107 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H]([C@H]2CCCN2)C1 2145270657 MWZQGFNDZMQFRM-FRRDWIJNSA-N 276.380 2.233 10 10 CECE CC(C)N(CCCn1cncn1)c1ccc(CN)cc1 2145396940 DNGPSABRZKIWPF-UHFFFAOYSA-N 273.384 2.042 10 10 CECE CCC[C@@H]1C[C@](O)([C@@H](NC)c2ccccc2O)CCO1 2148166001 ZZSQUFSPOFPGQI-KCXAZCMYSA-N 279.380 2.363 10 10 CECE O=C([C@H]1CNc2ccccc2N1)N1C[C@H]2CCC[C@H]1C2 2145860507 MGBPNXUDVHOKMF-SLEUVZQESA-N 271.364 2.294 10 10 CECE NN[C@H](c1ccc2ccccc2n1)c1ccccc1O 2146242858 RFYUUDPJDDXSSJ-INIZCTEOSA-N 265.316 2.493 10 10 CECE Oc1cccc(Br)c1CN[C@H]1CC[C@H](O)C1 1983969115 YIAKSWVCXQSDOZ-IUCAKERBSA-N 286.169 2.158 10 10 CECE NN[C@@H](c1ccc2ncccc2c1)c1ccccc1O 2146243917 ZSYUAQFTSHAKJU-INIZCTEOSA-N 265.316 2.493 10 10 CECE COc1ccc(N(CCCN)CCN(C)C(C)C)cc1 2148811625 WTIOHGMBAGDHBK-UHFFFAOYSA-N 279.428 2.191 10 10 CECE CN(CCCC(=O)Nc1ccc(N)cc1)[C@@H]1CCSC1 37174194 MWBKLSBIRHZDQI-CQSZACIVSA-N 293.436 2.425 10 10 CECE COc1ccc(CN[C@@H]2CCN3CCC[C@H]23)cc1C 37322210 HDPBKHZTGVQKQT-HUUCEWRRSA-N 260.381 2.330 10 10 CECE COCCN(c1ccc(N)cc1)[C@H]1CCSC1 2003835577 SGIVMFTXNYHSFS-ZDUSSCGKSA-N 252.383 2.227 10 10 CECE COCCO[C@@H]1CCCN(c2ccc(CO)c(C)c2)C1 2158832503 HGLIOKUFURICOI-MRXNPFEDSA-N 279.380 2.119 10 10 CECE OCc1ccc(N2Cc3conc3C2)cc1Cl 1997757914 VYLKUQSJWISSRR-UHFFFAOYSA-N 250.685 2.341 10 10 CECE COc1ccc(O)c(CN2[C@H]3CC[C@@H]2C[C@H](CN)C3)c1 2159210316 GUJRHCMKYKHIGX-UBSAEIQESA-N 276.380 2.103 10 10 CECE CO[C@H]1C=CCN(c2ccc(CN)c(Br)c2)C1 2000818550 SHYZFWBKVYAWOK-LBPRGKRZSA-N 297.196 2.299 10 10 CECE Cc1cc(N2C[C@@H]3C[C@@H](O)[C@H]3C2)ccc1CNC1CC1 2151395781 GBIPCAFDNBNDJY-RRQGHBQHSA-N 272.392 2.064 10 10 CECE Cn1cnc(Cl)c1CN1CCC[C@H]1CN=[N+]=[N-] 2009445371 NZPNJRFJRVEAGM-QMMMGPOBSA-N 254.725 2.348 10 10 CECE CN[C@H](C)c1ccc(N(CCOC)[C@H]2CCOC2)cc1 2152149727 RTSQPWONSSSJHR-CJNGLKHVSA-N 278.396 2.209 10 10 CECE CN1CCc2cc([C@H](O)[C@H](N)CCC(C)(F)F)ccc21 2153573360 PJPDNFNTRSWVFK-OCCSQVGLSA-N 284.350 2.475 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)CCC(C)C)ccc21 48923402 BXYSBMQGLLWRQQ-CQSZACIVSA-N 261.369 2.382 10 10 CECE CCOc1cccc(CN2CC[C@H](N)CC2(C)C)c1O 2155080172 RHUARRRXTVHRSV-ZDUSSCGKSA-N 278.396 2.493 10 10 CECE Oc1ccc(Cl)cc1CN1CCCC2(CNC2)C1 2027716490 UMVYJBSAYVXGNK-UHFFFAOYSA-N 266.772 2.231 10 10 CECE C[C@@H](O)c1ccc(N2CCN(C)[C@@H]3C[C@H]32)c(Cl)c1 2049407062 FKPDVNXIYGNDAB-OWYVNGRQSA-N 266.772 2.286 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)c1scnc1Cl 2031157649 GSCXJVXZGMYDJG-ZJUUUORDSA-N 284.768 2.496 10 10 CECE COC[C@@H](C)CCN[C@H](C)c1ccc(O)cc1O 2031863968 HGBHCXHCCWSMRH-WDEREUQCSA-N 253.342 2.421 10 10 CECE NCc1ccc(N2CC(C(F)(F)F)C2)c(F)c1F 2034853779 MBCHYBITRNHOBC-UHFFFAOYSA-N 266.213 2.422 10 10 CECE N[C@@H](c1ccccc1O)[C@@H](O)c1cccc2c1COC2 2156013129 AARPXNVRMNGZGA-HOTGVXAUSA-N 271.316 2.156 10 10 CECE C[C@H]1C[C@@H](N(C)c2ccc([C@@H](C)N)cc2F)CO1 401589462 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2170394147 FAAXMMSAGBOEJO-PBHICJAKSA-N 275.440 2.273 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(F)c([N+](=O)[O-])cc1F 701317670 TVUZBALIBSZZFB-UHFFFAOYSA-N 285.210 2.303 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)CC1CC=CC1 2162061548 RXZHUTKIDCDFHB-GFCCVEGCSA-N 273.380 2.494 10 10 CECE O=C(O)CN1C(=O)C(=Cc2ccsc2)SC1=S 2053467518 NHEGFDYEVYVPKD-UHFFFAOYSA-N 285.371 2.034 10 10 CECE C[C@H](O)c1ccc(N2CCN3C(=O)OC[C@H]3C2)c(Cl)c1 2170707745 PTKYSYQBNRXLES-GXSJLCMTSA-N 296.754 2.034 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)C[C@@H]2C)c(C)c1 706009062 WRZODULTVBRZGA-DZGCQCFKSA-N 262.397 2.454 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4CCCC[C@@H]43)ccc21 706770141 WDYSDMFYHHYVGB-IIMNLJJBSA-N 257.337 2.017 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@H](C)O[C@H]1C 686442024 KKXPNTDUHKAHLC-SLEUVZQESA-N 276.380 2.431 10 10 CECE COc1ccc(N2CCC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])c1 708467383 CMLBXMRPNFZYLK-QMTHXVAHSA-N 280.324 2.201 10 10 CECE C[C@@H](OCCc1ccc(N)cc1)C(=O)N1CCCCC1 2176290013 JPNQTQGVSIFNGI-CYBMUJFWSA-N 276.380 2.229 10 10 CECE c1cc(N2CCCC2)ccc1CNC[C@@]12COC[C@@H]1C2 689240053 MMBKPNAOEBLLSC-RDJZCZTQSA-N 272.392 2.413 10 10 CECE CCCN(C(=O)[C@@H]1C[C@H]1OCC)c1ccc(N)cc1 689906850 XQWTZNZXSKJMMG-ZIAGYGMSSA-N 262.353 2.437 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC1CN(C)C1 379481014 WFWIAEJMUMMWCQ-YPMHNXCESA-N 260.381 2.400 10 10 CECE COC(=O)N(C)CCN(C)[C@@H]1CCc2cccc(O)c21 690816245 MGNRQJUFOOHEIX-GFCCVEGCSA-N 278.352 2.010 10 10 CECE C[C@@H](c1ccccc1O)N1CCC[C@@H](CS(C)(=O)=O)C1 380315812 LZZSSYVSMUUGIZ-QWHCGFSZSA-N 297.420 2.210 10 10 CECE C[C@@H](N[C@@H]1CCCOCC1)c1ccc(O)cc1O 381341873 KRRXSMOPMRGJOM-GHMZBOCLSA-N 251.326 2.318 10 10 CECE CCNCc1ccc(N(C)C[C@H](C)OC)c(C#N)c1 382250511 FEJKUFUYJGWVMN-LBPRGKRZSA-N 261.369 2.139 10 10 CECE C[C@H](NCCCOC1CC1)c1cc(O)ccc1O 717371912 KYPZAPPANQBMML-JTQLQIEISA-N 251.326 2.318 10 10 CECE COc1ccccc1C[C@@H](O)Cc1ccc(N)cc1 696515527 PJEXFNNXYOXZHU-HNNXBMFYSA-N 257.333 2.424 10 10 CECE CCCNCc1ccc(N2C[C@H]3COC[C@@H]3C2)c(F)c1 718257104 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CCNCc1ccc(N2CCOC[C@H](C)C2)c(F)c1 399174485 PHPWGRQVYQNUBW-GFCCVEGCSA-N 266.360 2.408 10 10 CECE C[C@H]1CC[C@H](O)CN1c1ccc(CNC2CC2)cc1F 399243802 JUCSQINCQBGSEI-FZMZJTMJSA-N 278.371 2.427 10 10 CECE Nc1cccc(F)c1NC1CCN([C@H]2CCOC2)CC1 2173048247 ONDQDPLSORRZDA-LBPRGKRZSA-N 279.359 2.073 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2[C@H]3CCCCC[C@H]32)cc1 2167258470 UFSCAOSYYCNUBZ-FICVDOATSA-N 294.420 2.267 10 10 CECE COc1cc(N)c(N(C)CCCCN(C)C)cc1OC 2177927143 YDQJFDJDWYUZLX-UHFFFAOYSA-N 281.400 2.064 10 10 CECE Oc1ccc(CNC2CN(C3CCCCC3)C2)c(O)c1 2169250768 GIIAQWSFJCMDSF-UHFFFAOYSA-N 276.380 2.204 10 10 CECE CNCc1cc(F)c(N2CCOC[C@H]2C(F)F)c(F)c1 2175643913 QVRWUFWQEZRMMP-NSHDSACASA-N 292.276 2.155 10 10 CECE C[C@@H](c1ccccc1O)N(C)CC1(F)COCCOC1 2187209943 IVNAVCLELOWKND-LBPRGKRZSA-N 283.343 2.140 10 10 CECE CNCc1ccc(N2CCN3C[C@H](C)C[C@@H]3C2)c(C)c1 2181277168 BHUBGIAVEUFWGN-CZUORRHYSA-N 273.424 2.245 10 10 CECE Cc1nnc2cccc(N(C)Cc3ccccc3O)n12 2192565542 ARMNAWGTYQUZBZ-UHFFFAOYSA-N 268.320 2.380 10 10 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COc1ccc(N(C)C2(CN)[C@@H]3C[C@@H]3[C@H]3C[C@H]32)cc1 2110335034 SSOYUSBRFZVHLS-KBUPBQIOSA-N 258.365 2.115 10 10 CECE OCc1ccc(N2C[C@]34CC[C@@]3(COC4)C2)c(Cl)c1 2090385088 NFTURVXCFHBIEF-GJZGRUSLSA-N 279.767 2.449 10 10 CECE CC(C)[C@@]1(O)CCN(c2ccc(CN)c(F)c2F)C1 2094377542 PLODXRYKQPYVQH-CQSZACIVSA-N 270.323 2.021 10 10 CECE Oc1c(F)cccc1CNC1CC([C@@H]2CCOC2)C1 2094832214 ZZKMCESTMGGYQY-PNESKVBLSA-N 265.328 2.436 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CC=CCO3)C2)c(F)c1 2094981047 FEUHVCOILNUJCY-LLVKDONJSA-N 263.312 2.414 10 10 CECE C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(CO)c2)C[C@@H]1F 2095934028 NBBLBVHDMLHJOA-SKDRFNHKSA-N 268.288 2.271 10 10 CECE CCc1cc(CN[C@H](C)c2c(O)cccc2O)on1 2096357784 OJSWUCUSZLWREY-SECBINFHSA-N 262.309 2.499 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(N)=O)CCC[C@@H]2CCCC[C@@H]21 2201113621 QLOIBJCVDJLZNE-SGMGOOAPSA-N 279.388 2.491 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2[C@@H]3CCC(F)(F)[C@@H]32)cc1 2114387376 BTIXUOCHRXGLDS-TUAOUCFPSA-N 266.291 2.176 10 10 CECE 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CCCN1CC[C@H](N(C)c2ccc(OC)cc2CN)C1 2235954256 KZBQGUPDPKOOCO-AWEZNQCLSA-N 277.412 2.074 10 10 CECE COc1ccc(N2Cc3cnn(C)c3[C@@H]2C)c(CO)c1 2236001655 IJFKLKDKWLYTHU-JTQLQIEISA-N 273.336 2.002 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C[C@H](F)C2)c(C)c1 2226315681 VWQUPFPMCHQZAL-KBPBESRZSA-N 266.360 2.014 10 10 CECE OC1[C@H]2C[C@H]1CN(c1ccc(OC3CCC3)cc1)C2 2226528204 XTSSHCKXDNNSBU-RYUDHWBXSA-N 259.349 2.435 10 10 CECE CC(C)Oc1ccc(N2C[C@H](CO)OC[C@H]2C)cc1 2226759372 IWOGNAMWKIJYPF-IUODEOHRSA-N 265.353 2.060 10 10 CECE OC1C[C@@H]2CN(c3ccc(OC4CC4)cc3)C[C@H]2C1 2226778063 BLFZSKJPXLGDNX-VXGBXAGGSA-N 259.349 2.435 10 10 CECE COc1ccc(N2C[C@H]3CCC[C@@]3(CO)C2)c(F)c1 2226788329 JZKKROZTQFUUDO-ABAIWWIYSA-N 265.328 2.433 10 10 CECE COc1ccc(N2CC[C@](C)(O)[C@@](C)(O)C2)cc1Cl 2226923767 ANPNGQXYOYZMTD-KBPBESRZSA-N 285.771 2.061 10 10 CECE CC[C@@H](C)C[C@](N)(CO)COc1ccc(N(C)C)cc1 2237698872 VCRGFBNZBXZYHZ-CJNGLKHVSA-N 280.412 2.257 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@]1(C)COC 2227673573 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CCCOc1cc(N2C[C@H]3CNC[C@]3(C)C2)ccc1N 2191617931 XKXRNTHQPQPLGS-MLGOLLRUSA-N 275.396 2.103 10 10 CECE NCCc1cccc2c1ccn2Cc1nncs1 2066502470 ZUYWPUGGGFSKGH-UHFFFAOYSA-N 258.350 2.042 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)C12CCN(CC1)C2 2198771618 XQYHOZXWLGVYRV-INIZCTEOSA-N 271.408 2.035 10 10 CECE COC[C@H]1C[C@@H]1CN(C)c1ccc(CO)cc1F 2069574446 JPQUVKZEUPHJTF-VXGBXAGGSA-N 253.317 2.037 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])C1CC=CC1 2070792673 BOYYLPSHMAICSL-GFCCVEGCSA-N 252.318 2.174 10 10 CECE CCCC[C@H](N)C(=O)N[C@H](C)c1ccccc1O 2072491883 WCTWLXQBNQTIMX-PWSUYJOCSA-N 250.342 2.087 10 10 CECE CCOC(=O)[C@](NCCN=[N+]=[N-])(C(C)C)C(F)F 2077285035 VHCLMKCHKPHGMC-JTQLQIEISA-N 264.276 2.109 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](CO)C3)c(F)c1 2100984810 JJFDCKNWEXACIA-XVSYOHENSA-N 264.344 2.195 10 10 CECE CON(CC(=O)O)[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 2102167751 HOQCUIYFXLCRNY-NXEZZACHSA-N 265.309 2.197 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@@H](N)[C@@H](C(F)F)C1 2102495358 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CCN[C@@H](c1ccc2c(c1)CCCN2C)C1(O)CC1 2106948685 SZJYVUKXDLWRIM-HNNXBMFYSA-N 260.381 2.245 10 10 CECE N[C@@H](c1ccc(N2CCCC2)cc1)[C@]1(O)CCSC1 2106943443 ILCWCNWLKDAODM-GJZGRUSLSA-N 278.421 2.155 10 10 CECE C[C@@](O)(c1ccc(N2CCCCC2)cc1)[C@@H]1CCN1 2107267287 HUDSBFLIAPPSKL-JKSUJKDBSA-N 260.381 2.246 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H](O)C3(CCC3)C2)cc1 2108773256 AFCPXGRGIZQUHN-HUUCEWRRSA-N 260.381 2.448 10 10 CECE Oc1ccc(CNC[C@@H]2CCC(F)(F)CO2)c(O)c1 2088783964 IXNKRUXBHNTLLE-NSHDSACASA-N 273.279 2.002 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@]3(N)CC3(C)C)ccc21 2109656916 FAXDCJCPLPVDNN-ZBFHGGJFSA-N 260.381 2.230 10 10 CECE Cc1nc[nH]c1CCN[C@@H](C)c1cc(F)ccc1O 2089617123 NDPHSVBDGGGLJH-VIFPVBQESA-N 263.316 2.456 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3CC[C@@]2(CO)C3)cc1 2089717695 HJTZOSGWVVSCTE-WWGRRREGSA-N 260.381 2.318 10 10 CECE CCN[C@H](c1ccccc1O)[C@@](C)(O)C(C)(C)OC 2091860815 WUFAUJBOKRFOTP-UKRRQHHQSA-N 267.369 2.219 10 10 CECE Cc1nscc1CNC(=O)CCc1ccc(N)cc1 2093851502 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C[C@@]1(O)[C@H]2C[C@@H]1CN(c1ccc3c(c1)CCCO3)C2 2270737757 MGJQDZDHUWOUOR-VIKVFOODSA-N 259.349 2.219 10 10 CECE COCCCCN(C)c1ccc(OC)cc1C=O 2220420499 GDQROEKONFGJSO-UHFFFAOYSA-N 251.326 2.371 10 10 CECE COc1ccc(N2CC(C)(CSC)C2)c(CN)c1 2220416543 BBOZRCFXZPAIQI-UHFFFAOYSA-N 266.410 2.343 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@H]2CN(C)C)c(F)c1 2230480885 FEBGYYWSOOHQLR-YPMHNXCESA-N 264.344 2.185 10 10 CECE CCc1nsc(CN[C@H](C)c2cc(O)ccc2O)n1 2273041489 YROVTXDLYHRMNT-MRVPVSSYSA-N 279.365 2.363 10 10 CECE CN[C@@H](C)c1ccc(N2CC(CCCO)C2)c(F)c1 2230681662 UJQMQOCOWBDURD-NSHDSACASA-N 266.360 2.315 10 10 CECE Cc1cc([C@](C)(NCCN=[N+]=[N-])C(=O)O)ccc1F 2232051195 HXFPLDQJHFIXFL-LBPRGKRZSA-N 266.276 2.334 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@@H]2OC[C@H]3CCCC[C@H]32)CC1 2233188240 PQTCJPZTXMGWPM-IJLUTSLNSA-N 278.356 2.398 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@H]1CC[C@@](C)(C(=O)O)C1(C)C 2234175905 GVGMVNOYWHUAPA-RNCFNFMXSA-N 282.344 2.282 10 10 CECE C[C@@H](O)CN(C[C@@H](C)O)c1ccc(OC(F)(F)F)cc1 2234895527 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CECE COC[C@@]12CN(c3ccc(CO)c(Cl)c3)C[C@H]1CCO2 2239915221 HKDKKCQFZZTPEJ-DOMZBBRYSA-N 297.782 2.074 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)CC(=O)N1CCCC1 2240735727 RAAHDHVVFVKEIT-CYBMUJFWSA-N 275.396 2.073 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)CC1(S(C)(=O)=O)CC1 2240840538 VHCRHKNQJBBFRE-LBPRGKRZSA-N 296.436 2.028 10 10 CECE CSc1ncc(CNCC[C@@]2(C)CCN2)s1 2243841152 WPPZNRBXOSCHKI-NSHDSACASA-N 257.428 2.097 10 10 CECE CNC1(C(=O)NCc2cnc(SC)s2)CCCC1 2257026377 LQAPJIJDNIZZTE-UHFFFAOYSA-N 285.438 2.013 10 10 CECE Cc1cc(N(C)[C@H](C)C[S@@](C)=O)ccc1[C@H](C)N 2257457382 KKMXJQSJTQESGT-FTLABTOESA-N 268.426 2.218 10 10 CECE CC(C)[C@H](C)[C@@H](O)c1ccc(N2CCNCC2)cc1 2270553079 VDYHDPULZGOJQZ-XJKSGUPXSA-N 262.397 2.422 10 10 CECE CN(Cc1ccc(Cl)cc1O)[C@@H]1CNCC1(C)C 2261178813 LDDBWLLSGDBZCA-CYBMUJFWSA-N 268.788 2.475 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@]3(CN)C2)cc1Cl 2272655956 RYXDMWDPHCBVQG-XPTSAGLGSA-N 282.771 2.142 10 10 CECE C[C@H]1Cc2cc(N(C)[C@@H]3CNCC3(C)C)ccc2O1 2274189649 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2.495 10 10 CECE Nc1ccc(OCCNC(=O)C2[C@H]3CCCC[C@H]23)cc1 161549597 VMTBHWWPTQVFHL-KBPBESRZSA-N 274.364 2.200 10 10 CECE C[C@@H](CNCc1ccc(F)c(F)c1O)c1ccn(C)n1 2147081014 SJENIIKSVFPUOO-VIFPVBQESA-N 281.306 2.297 10 10 CECE Nc1ccc(CS(=O)(=O)N2CC[C@H]3CCCC[C@@H]32)cc1 162304981 LFNAAIGVHVHKLZ-HIFRSBDPSA-N 294.420 2.363 10 10 CECE C[C@@H]1CCS[C@@H]1CNC(=O)CCOc1ccc(N)cc1 2150840174 IPGVFKOJOSJTOE-BXUZGUMPSA-N 294.420 2.296 10 10 CECE CN(Cc1cnco1)c1ccc(CN)cc1Cl 1998723313 NDFKYAAKTOVXFE-UHFFFAOYSA-N 251.717 2.423 10 10 CECE Nc1ccc(CCNc2cnncc2Br)cc1 2000875504 VFZTYSZWACYWNV-UHFFFAOYSA-N 293.168 2.476 10 10 CECE Oc1c(CNCc2cnn(C3CC3)c2)ccc(F)c1F 2153078304 SEVQGDUCJCNUPT-UHFFFAOYSA-N 279.290 2.492 10 10 CECE CN(C(=O)COC1CC(C(F)F)C1)c1ccc(N)cc1 2153307330 WQTYUGFVPVMDTF-UHFFFAOYSA-N 284.306 2.292 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)CC[C@@H]1N 49707506 MIALTFIRYHVUFI-AAEUAGOBSA-N 262.353 2.021 10 10 CECE CO[C@@H]1CCO[C@@H](CN[C@@H](C)c2cc(F)ccc2O)C1 2154203515 XPTJKDNAMKSRAL-CYZMBNFOSA-N 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2206563699 XVKSDPFORKQVDS-UKRRQHHQSA-N 276.380 2.364 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2C(F)(F)C23CC(N)C3)cc1 2207049853 NXICITMJLMWTMQ-OSOQGNGPSA-N 282.334 2.159 10 10 CECE CCCN[C@@H]1CCN(c2ccc(OC)cc2F)C1 2220322984 VKXXOUINZZLYSP-LLVKDONJSA-N 252.333 2.413 10 10 CECE CCN[C@H]1CCc2cc(N3CC[C@@H](O)[C@@H]3C)ccc21 2273272071 LSYCSVUNJIAKHA-KNXALSJPSA-N 260.381 2.243 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC[C@@H](O)C2)cc1C 2231458551 IWKVQMNNZXZQHY-CZUORRHYSA-N 262.397 2.454 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@@H]2C[C@H](C[C@@H]2O)C1 2232105713 WNPFALJPDMQPDX-LMWOUKEDSA-N 260.381 2.222 10 10 CECE C[C@@H](N=c1[nH]c(=N)[nH]cc1C1CC1)c1ccccc1O 2233492634 LDAQRTKWEATLNL-SECBINFHSA-N 270.336 2.067 10 10 CECE CN1CCCc2cc(N3CC[C@H]4[C@H](C[C@H]4O)C3)ccc21 2235038040 XHLHQXCXCYYMIG-UKPHBRMFSA-N 272.392 2.276 10 10 CECE COc1ccc(N2CCO[C@@H]3C[C@@H](CO)C[C@H]32)cc1Cl 2235212210 LIJWDYCVDKPBSJ-PSOPSSQASA-N 297.782 2.325 10 10 CECE COc1ccc(N(C)C[C@@H]2CO[C@@H](C)C2)c(C(=O)O)c1 2235951965 IUZTVKBCPVEPQQ-WDEREUQCSA-N 279.336 2.255 10 10 CECE CCNCc1cc(OC)ccc1N(C)C[C@H]1CCCO1 2235973319 RHBVTFVYZFKJGF-OAHLLOKOSA-N 278.396 2.420 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@]2(CCOC2)C1 2235953500 BJLJIIJSJSNLKX-MRXNPFEDSA-N 276.380 2.031 10 10 CECE Oc1c(CNC[C@H]2COC3CC2C3)ccc(F)c1F 2226356759 QAYXHOWGAPCLMJ-YVNMAJEFSA-N 269.291 2.185 10 10 CECE CCOc1ncc(NCCc2ccc(N)cc2)cn1 2226488511 BMEPJGADDOMTCH-UHFFFAOYSA-N 258.325 2.112 10 10 CECE COC[C@H]1CCN(c2ccc(CN)c(OC)c2)C1(C)C 2236693346 HLMUPJVVCHDFGC-CYBMUJFWSA-N 278.396 2.405 10 10 CECE N[C@H]1CCc2cc(N3CC(OC(F)(F)CF)C3)ccc21 2237640495 NHAXJUIOXBITAX-ZDUSSCGKSA-N 286.297 2.400 10 10 CECE CCO[C@H]1CCN(c2ccc(OC)cc2C(=O)O)C1 2227665509 MJXDRRILMYTLAZ-NSHDSACASA-N 265.309 2.009 10 10 CECE COc1ccc(N2C[C@@H](C)OC[C@H]2C)c(C(=O)O)c1 2227671002 XGJHPGVSNALMII-NXEZZACHSA-N 265.309 2.007 10 10 CECE COCCCNC[C@H](C)Oc1ccc(N(C)C)cc1 2229371934 COCJMBSASRWEQE-ZDUSSCGKSA-N 266.385 2.146 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)cc2F)[C@@H](C)CN1C 2229729960 GINFCYXUQOMHND-SDDRHHMPSA-N 265.376 2.374 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC([N+](=O)[O-])C2)c(C)c1 2240027530 YYDVKPSZNAXMKJ-GFCCVEGCSA-N 277.368 2.348 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)C[C@@H]1CCCS1(=O)=O 2240763302 UDRPNNWTJVMGAY-OCCSQVGLSA-N 296.436 2.028 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2ncnn2C)c(C)c1 2240828895 JSFKDZLQZODMEB-GFCCVEGCSA-N 273.384 2.040 10 10 CECE CCOC(=O)[C@@H]1C[C@@H]1CNCc1cnc(SC)s1 2256942292 WRJMRZOXYWFRRX-PSASIEDQSA-N 286.422 2.154 10 10 CECE COc1cc(OC)c(N2C[C@H]3CNC[C@H]2C3)cc1Cl 2270415776 IBIKBPUGGDKNSG-NXEZZACHSA-N 282.771 2.155 10 10 CECE C[C@@]1(CNCc2ccc(F)c(F)c2O)CCC[C@@H]1O 2271292586 VPYXDGFQOIGKOZ-FZMZJTMJSA-N 271.307 2.311 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@H]2C[C@@]2(CN)C1 2272629391 OOAGKXIAFJLZMF-XNRPHZJLSA-N 259.397 2.094 10 10 CECE C[C@]1(O)C[C@H]2[C@H]1CCN2c1ccc(OCF)cc1 2263850491 NRKHREDXOIUXJC-RDBSUJKOSA-N 251.301 2.342 10 10 CECE CCN(Cc1ccc(N)cc1)c1ccnc(OC)n1 2266687317 VGYHZHWTNWHCJI-UHFFFAOYSA-N 258.325 2.094 10 10 CECE C[C@H](N=c1nc2[nH]ccnc-2s1)c1ccccc1O 2268499761 QMJRBPOICQGLLI-QMMMGPOBSA-N 272.333 2.339 10 10 CECE Cc1cc(N2CC[C@]3(C2)C[C@@H](O)C3)ccc1[C@@H](C)N 2269661177 CXKLEBNPBMAIMO-XPKDYRNWSA-N 260.381 2.366 10 10 CECE N[C@H]1CCN(Cc2cc(F)ccc2O)[C@@H](C(F)(F)F)C1 2281050283 IIUMGFGBEJIKEM-CMPLNLGQSA-N 292.276 2.385 10 10 CECE N[C@H]1CCN(Cc2ccc(F)cc2O)[C@H](C(F)(F)F)C1 2281041940 PQLMTTJHUPKVQB-JQWIXIFHSA-N 292.276 2.385 10 10 CECE Cc1cc(N2CCC[C@H](S(C)(=O)=O)C2)ccc1[C@@H](C)N 2285147204 ZBVDLENDXMQFIY-OCCSQVGLSA-N 296.436 2.028 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@]3(C)O)c(F)c1 2286241883 FXUNZKKHEWZSHJ-VIKVFOODSA-N 278.371 2.142 10 10 CECE Nc1ccc(COc2nc(C3CCC3)ncc2N)cc1 2286656777 RJJCGLCQMNLVQG-UHFFFAOYSA-N 270.336 2.488 10 10 CECE Cc1ccc([C@H](C)N[C@H]2CC[C@@H](C(N)=O)CC2)c(O)c1 2287895589 SKYXESCGZSTQGP-RWMBFGLXSA-N 276.380 2.395 10 10 CECE CCOc1cccc(CNCc2nc(CC)ns2)c1O 2288693998 MTZREWWCSRFFCP-UHFFFAOYSA-N 293.392 2.495 10 10 CECE COC(=O)C1=C(C)NC(=O)C1=Cc1ccccc1Cl 2297335787 NRBXLENEPFVZDW-UHFFFAOYSA-N 277.707 2.300 10 10 CECE Cc1ccc(CN[C@H]2CNC[C@H]2C)c(O)c1Br 2307568207 BZRIMTLEQLADPI-KOLCDFICSA-N 299.212 2.161 10 10 CECE C[C@@H](NC[C@H]1[C@@H]2CCO[C@@H]21)c1ccc(F)cc1O 2309871646 QZCSKUUAEJPZHP-JRQIVUDYSA-N 251.301 2.217 10 10 CECE C[C@@]1(C[S@](=O)Cc2ccc(N)cc2)CCCOC1 2321700449 GWIYEAKQSGVHRZ-RDTXWAMCSA-N 267.394 2.334 10 10 CECE CSc1cc(N2C[C@H](O)CC[C@@H]2C)ccc1CN 2328537132 WODZEIOCZCGFPD-GXFFZTMASA-N 266.410 2.217 10 10 CECE O=C(NC[C@@H]1C[C@H]2C=C[C@@H]1C2)c1ccc(O)c(O)c1 2330554150 GUOAVSOMPLPCQK-UMNHJUIQSA-N 259.305 2.040 10 10 CECE CO[C@H]1C[C@@H]2C[C@@H](N(C)c3ccc(CO)cc3)C[C@@H]21 2331960972 SEYZXJAQEXKCEY-UKMLZYKCSA-N 261.365 2.429 10 10 CECE COc1ccc(N2CC[C@@H]3CCCN[C@H]3C2)c(F)c1 2336202973 CCTIHTGNMKRFAN-FZMZJTMJSA-N 264.344 2.413 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@]12CCCC[C@@H]1OCC2 2337776833 IMZBCUHCQXRSMK-AAEUAGOBSA-N 266.345 2.495 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC[C@H](N(C)C)C2)c1C 2340850260 FONNXCYNNIQUFZ-KBPBESRZSA-N 262.397 2.497 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[C@H](O)[C@H](F)C2)c1C 2340859519 LCTXHTRQZRWVBC-LNSITVRQSA-N 266.360 2.232 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H](C)CN(C)C)cc1O 2351786843 WLHBHASFUWZGHL-NEPJUHHUSA-N 265.401 2.059 10 10 CECE CSc1cc(N2CC[C@@H](O)[C@@H]2C(C)C)ccc1CN 2353860796 AXINSLBJDDSGOF-HIFRSBDPSA-N 280.437 2.463 10 10 CECE C[C@H](N[C@H]1CC[C@@H]2CN(C)C[C@@H]21)c1ccc(O)cc1O 2354060525 OKRAFXPETAMNFZ-JLUCKKNBSA-N 276.380 2.089 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3CCC[C@H]3C[C@@H]2CO)cc1O 2354701629 WZIIJUIZQJNTJM-MEDZGJRSSA-N 277.364 2.185 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2CC(N)C3)cc1F 54628043 ODRBQUVOQGLWFX-FGWVZKOKSA-N 250.317 2.293 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N(C)C[C@@H]1CNCCO1 125382587 YOQOUJVTXAATDD-RDBSUJKOSA-N 290.407 2.169 10 10 CECE CN(C)c1ccc([C@H](N)c2noc(C(F)(F)F)n2)cc1 36764952 HBWAUDUEWKLOEM-VIFPVBQESA-N 286.257 2.203 10 10 CECE CNC(=O)CCN(C)c1ccc(/C=C\C(=O)O)c(Cl)c1 312196165 ODODBUXLTXVCQY-XQRVVYSFSA-N 296.754 2.010 10 10 CECE Nc1ccc(NC(=O)COCCC(F)(F)F)cc1 125243380 GHQIMSUUGYREGY-UHFFFAOYSA-N 262.231 2.176 10 10 CECE NCc1ccc(N2C[C@@H]3CC[C@H](C2)O3)c(Br)c1 212941936 CAKNMNHVPUMHPV-PHIMTYICSA-N 297.196 2.275 10 10 CECE COc1nccc(N(C)C)c1NCc1cccc(O)c1O 41116933 DWHGHSMFHSNXRK-UHFFFAOYSA-N 289.335 2.180 10 10 CECE COC[C@H](N)c1cccc(NC(=O)OC(C)(C)C)c1O 1952281777 ULFUKVJQUPGTGJ-JTQLQIEISA-N 282.340 2.385 10 10 CECE CC1(C)CN(c2ccc(OC(F)F)cc2)CCN1 86127069 GLLBEEBHGAADBP-UHFFFAOYSA-N 256.296 2.476 10 10 CECE CC(C)(C)OC(=O)Nc1ccc(O)c([C@H]2NCC[C@@H]2O)c1 1952344784 UZLQXCYITJDEBR-QWHCGFSZSA-N 294.351 2.135 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](CO)OC(C)(C)C2)cc1 228914506 YHLQRWBEIFYETF-CJNGLKHVSA-N 292.423 2.333 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@@H](NC(=O)OC)C2)cc1 229788792 UMFKQLIYNUFAGX-GXTWGEPZSA-N 291.395 2.292 10 10 CECE Oc1ccc(CNCC[C@H]2CCCCO2)c(O)c1 227335975 ZYCFKTGVHCBPFO-CYBMUJFWSA-N 251.326 2.147 10 10 CECE CC(C)[C@H](O)[C@H](N)c1cccc(Br)c1O 95804978 QJPKCAZUORIGMB-ZJUUUORDSA-N 274.158 2.171 10 10 CECE O=c1[nH]c(CNCc2cc(Cl)ccc2O)cs1 231696925 GSQVALOCLADPOC-UHFFFAOYSA-N 270.741 2.085 10 10 CECE CC[C@H]1COCCN1[C@@H](C)c1c(O)cccc1O 234087606 WMQZVBIEJNDJBE-QWRGUYRKSA-N 251.326 2.270 10 10 CECE NCc1ccc(N2C[C@@H]3CC[C@@H](O)[C@H]3C2)c(Cl)c1 252884518 WQKQZTZELRBWLE-COPLHBTASA-N 266.772 2.006 10 10 CECE C[C@@H]1CCN(c2ccc(CNC3CC3)cc2F)[C@H]1CO 299946753 BBFSDEDSNJAWOC-BZNIZROVSA-N 278.371 2.285 10 10 CECE CO[C@H]1CN(c2ccc(CN)c(F)c2)CC[C@H]1C 299959698 XVDJBGXFQMSFNY-YGRLFVJLSA-N 252.333 2.146 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@H](C)C1N 2162636741 RADVVJPAZKJGNH-IUCAKERBSA-N 284.306 2.428 10 10 CECE CO[C@@H](C)[C@@H](C)NC(=O)N(C)Cc1ccc(N(C)C)cc1 291065524 WRTXVHBYWHVSHS-OLZOCXBDSA-N 293.411 2.317 10 10 CECE CCN1CCc2cc([C@@H](N)c3ccc(C)nn3)ccc21 2163070154 GXDNELNVWAUXCJ-MRXNPFEDSA-N 268.364 2.216 10 10 CECE Cc1ncncc1[C@H](N)c1ccc(N2CCCC2)cc1 2163095290 BQDYMLKDJJYGOJ-MRXNPFEDSA-N 268.364 2.433 10 10 CECE CC(C)N1CC[C@@](N)(c2ccc3c(c2)CCCN3C)C1 2163103934 ZKGAIPMDRQBCRB-KRWDZBQOSA-N 273.424 2.337 10 10 CECE COC1(OC)CC[C@@]1(N)c1ccc(N2CCCC2)cc1 2163125684 DQYYPJAITKSQTH-OAHLLOKOSA-N 276.380 2.224 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@]2(O)CO[C@@H](C)C2)cc1 2163150144 RCHRRAFHORWUFO-VBNZEHGJSA-N 278.396 2.073 10 10 CECE Cc1cc(N)ccc1N1C(=O)[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C1=O 2166923713 QCXIOOSVDHSPTM-DHPDLVEQSA-N 270.332 2.113 10 10 CECE CC[C@H]1CCNC[C@H]1N(C)Cc1c(O)cccc1OC 2163612188 HNUPOASTKNDFHX-GXTWGEPZSA-N 278.396 2.221 10 10 CECE Cc1cc(CN2CCO[C@@]3(CCOC3)C2)ccc1N(C)C 294672546 RZFNNIQQYIBOKN-KRWDZBQOSA-N 290.407 2.052 10 10 CECE CN1CCc2cc([C@@H](N)[C@H](O)C3(CF)CCC3)ccc21 2166505868 GIGYLIOQKMSFKI-CABCVRRESA-N 278.371 2.179 10 10 CECE C[C@H](NS(=O)(=O)Cc1ccc(N)cc1)[C@H]1CC1(C)C 397669528 FIOMWLXYKBYOHY-GXFFZTMASA-N 282.409 2.123 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H]2CO3)cc1Cl 718364616 PJNPYFOZVAIBNG-STQMWFEESA-N 266.772 2.427 10 10 CECE COc1ccc(N2CCC(NC(=O)CSC)CC2)cc1 726562513 KJBUIGHEYDLLRS-UHFFFAOYSA-N 294.420 2.143 10 10 CECE CCN(CC)c1ccc([C@@](C)(N)CC(=O)O)cc1 725416222 IYXYZMHWGHKLAM-AWEZNQCLSA-N 250.342 2.181 10 10 CECE CC[C@@H](O)CC(=O)NCc1ccc(N2CCCC2)cc1 822495241 CELUMLWHEVYSPT-OAHLLOKOSA-N 276.380 2.064 10 10 CECE Oc1c(Br)cccc1CN1CCC2(COC2)C1 827642641 AGMWTTNBJRDLEI-UHFFFAOYSA-N 298.180 2.377 10 10 CECE CN1CCC[C@H](NC/C=C\c2ccc(N(C)C)cc2)C1 835036508 QORWOLOIZHAUPI-LEXSJLIMSA-N 273.424 2.450 10 10 CECE CCO[C@@H]1[C@@H](C)[C@H]1C(=O)N(C)Cc1ccccc1O 906992735 YHSOOLRIZLDOSP-ZLKJLUDKSA-N 263.337 2.022 10 10 CECE C/C=C/[C@@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 900292705 HUICZQCKQCWQRM-FYCOFBDGSA-N 290.407 2.427 10 10 CECE Cc1ncc(NC(=O)c2cccc(O)c2O)c(C2CC2)n1 848031483 FSYOCGDROPGQRV-UHFFFAOYSA-N 285.303 2.326 10 10 CECE Cc1cc(O)c(CN[C@@H](C)C[S@@](C)=O)c(Cl)c1 840940110 VODNPERCFODPGS-HUTHGQBESA-N 275.801 2.211 10 10 CECE CC(C)N(Cc1cc(F)ccc1O)C[C@@H]1CCC(=O)N1 840976688 PXGNJGBGMXNGKH-ZDUSSCGKSA-N 280.343 2.020 10 10 CECE Cc1ccc(C(=O)NC[C@@H]2CC3(CCC3)CO2)c(O)c1O 924115977 QIXNBYSLZUHQAW-NSHDSACASA-N 291.347 2.095 10 10 CECE COC[C@@](C)(CN[C@@H](C)c1cc(C)ccc1O)OC 1895307617 GZJDTRBYVPRSPF-SWLSCSKDSA-N 267.369 2.403 10 10 CECE COC[C@@H](CNC(=O)OC(C)(C)C)Oc1ccc(N)cc1 1896225613 MKMFLIGNTGKOKY-CYBMUJFWSA-N 296.367 2.187 10 10 CECE COc1cccc(O)c1CNC[C@]12OCCC[C@H]1C2(F)F 850379030 YGYXZCHQAWXDNF-KGLIPLIRSA-N 299.317 2.305 10 10 CECE COc1ccc(N2CC[C@H](NCc3cccnc3)C2)cc1 850346159 QZFBASMTBLWYAF-HNNXBMFYSA-N 283.375 2.459 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2cnccn2)c(F)c1 699541925 NNIZQHWTDILVRR-JTQLQIEISA-N 261.300 2.305 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@@H]1CCCO1 48946649 FMIYGWHPGYBJPR-HNNXBMFYSA-N 264.369 2.149 10 10 CECE Nc1ccc(CCNC(=O)c2cc(F)ccc2O)cc1 132777143 JEFAAHXTMPYBJJ-UHFFFAOYSA-N 274.295 2.086 10 10 CECE O=C(CCCOc1cccnc1)N1Cc2cccc(O)c2C1 871202892 OHRDCBSNDRAVHQ-UHFFFAOYSA-N 298.342 2.489 10 10 CECE CNCc1ccc(N2CCCN3CCC[C@H]3C2)cc1 249844584 BFKSCRDGOCTVGH-INIZCTEOSA-N 259.397 2.081 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1Cc2cccnc2C1 1123665018 GFKWGTTZIWACHE-AWEZNQCLSA-N 282.343 2.161 10 10 CECE CC[C@H]1CN(COC)c2cc3c(cc2N1)OCO3 76928962 HHGBRISEDVWHQJ-VIFPVBQESA-N 250.298 2.030 10 10 CECE COc1ccc2c(c1)N[C@@H](C)CN2C(C)(C)C(=O)O 76928055 YCRWTPJWJGYSFK-VIFPVBQESA-N 264.325 2.179 10 10 CECE CCN(Cc1cn(C)nn1)Cc1cc2c(cc1O)CCC2 781580480 ZKUSRENQKZQLBG-UHFFFAOYSA-N 286.379 2.032 10 10 CECE CCOc1ccc(O)c([C@]2(CC)COCCN2)c1 83385108 WFTYANWYVODRCA-AWEZNQCLSA-N 251.326 2.016 10 10 CECE C[C@H](CCNCc1cccc(Cl)c1O)[S@](C)=O 165398710 RCAGFZMYYCJWME-VVVCHXIZSA-N 275.801 2.292 10 10 CECE CC(C)NCc1ccc(N2CCS[C@H](CCO)C2)cc1 720035873 FEPLUWJLAJKOFC-MRXNPFEDSA-N 294.464 2.489 10 10 CECE C[C@@H](N)[C@H]1CCCN(Cc2ccc3c(c2)CCN3C)C1 70171918 XCGYQMUCPRNSJH-CJNGLKHVSA-N 273.424 2.238 10 10 CECE CC1(CNCc2ccc(O)c(O)c2O)CC(F)(F)C1 720911187 HQTBZKZDICMWPM-UHFFFAOYSA-N 273.279 2.328 10 10 CECE CCOC[C@H]1CN([C@H](C)c2cc(C)ccc2O)CCO1 705848888 RBZDNJYANFKDQP-ZIAGYGMSSA-N 279.380 2.499 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2CC[C@H]3CCC[C@H]32)cc1 707722697 WLCVDXZQZFABIB-BPLDGKMQSA-N 294.420 2.267 10 10 CECE CN[C@H](C)c1cnc(Sc2nncs2)s1 1958555841 PLPXVPBWURBQHD-RXMQYKEDSA-N 258.397 2.426 10 10 CECE COCCN(CCOC)c1ccc([C@H](C)N)cc1Cl 61696369 AUMCRDCZBRTGPL-NSHDSACASA-N 286.803 2.459 10 10 CECE CNCc1cc(F)c(N2C[C@@H]3CSC[C@H]3C2)c(F)c1 711589730 HFPKBDXRPLDUDH-GHMZBOCLSA-N 284.375 2.483 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2C[C@@H]3CCCC[C@@H]32)cc1 712379888 XFWNEQNOEXSELN-AEGPPILISA-N 294.420 2.267 10 10 CECE C[C@@H](N[C@@H]1C[C@H]2CCCN(C2)C1)c1cc(O)ccc1O 717004201 ZLQSYEYMYCIBAJ-JHJVBQTASA-N 276.380 2.233 10 10 CECE CC1(C)CC[C@@H](CNCc2ccc(O)c(O)c2)O1 691857839 GEDYDQMZUPXLHU-NSHDSACASA-N 251.326 2.145 10 10 CECE CCCOc1cc(N(CC)CC(=O)OCC)ccc1N 692296485 MEAKAXWVZICMCO-UHFFFAOYSA-N 280.368 2.447 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H]3C[C@H](C2)C3O)cc1 2116308242 ZZSQTNPITVHNAM-XFDYKOMQSA-N 260.381 2.174 10 10 CECE CCNCc1ccc(N2CC=C[C@H]2COC)cc1C 2125987703 VIELCWLUTFIBNA-INIZCTEOSA-N 260.381 2.496 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H](O)[C@H]2C)c(F)c1 2126120890 XRGSHAVFSFSOJB-IAQYHMDHSA-N 266.360 2.141 10 10 CECE CN(C)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1O 2118346206 JBAMWVPJKSNLDC-FICVDOATSA-N 260.381 2.449 10 10 CECE CN(C)[C@H]1C[C@@H]2CC[C@H](C1)N2c1ccc(CO)cc1 2118321552 DNWDVDVZVIDGFX-MUJYYYPQSA-N 260.381 2.240 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)c1ccon1 2124227074 DQSCMXMECYEMTE-OAHLLOKOSA-N 257.337 2.366 10 10 CECE CO[C@@H]1CCC[C@@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2126402918 KIDWPOGDVDLIMU-GRYCIOLGSA-N 266.345 2.493 10 10 CECE CCc1cc(NC(=O)NCc2c(O)cccc2F)n(C)n1 1334783947 SQDJIVPURRMBJR-UHFFFAOYSA-N 292.314 2.149 10 10 CECE C[C@H](NC(=O)c1ccc(O)c(O)c1)C1CC2(CC2)C1 2127990836 XVIBXIBTVQLYHY-VIFPVBQESA-N 261.321 2.406 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@H](C)[C@H](O)C3)ccc21 2128296185 QNYRDRPJNLHLAW-IUIKQTSFSA-N 260.381 2.100 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](O)C3(C)C)ccc21 2128315710 VPFVHPPNVAPRRD-CABCVRRESA-N 260.381 2.243 10 10 CECE C[C@H](O)[C@H]1CCCN(c2ccc3c(c2)CC[C@H]3O)C1 2128318330 UQWKTPLLKUDHNC-DETPVDSQSA-N 261.365 2.263 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)CC12CC2 2128325450 SSHFZBIOTLJWNS-HUUCEWRRSA-N 259.349 2.281 10 10 CECE C[C@H]1CO[C@H](CN(C)c2ccc3c(c2)CC[C@@H]3N)C1 2128321554 LQVXBMPTZAFTGZ-WPGHFRTFSA-N 260.381 2.494 10 10 CECE NC[C@@H]1[C@H]2C[C@H]2CN1c1ccc(OC2CCC2)cc1 1905537542 RLCMAKQGAWVOIG-KNXALSJPSA-N 258.365 2.401 10 10 CECE CN(Cc1cc(F)ccc1O)C[C@@H]1CCCCN1C 2129628658 SISJUIYMMBVDRO-AWEZNQCLSA-N 266.360 2.447 10 10 CECE CCn1ccnc1CN(C)c1ccc(CN)c(F)c1F 1913355347 HUYHWQLLSWUPGE-UHFFFAOYSA-N 280.322 2.276 10 10 CECE C[C@@H](NC(=O)CN1CC[C@@H](N=[N+]=[N-])C1)c1ccccc1 1912184115 WHSZQWHRMPOIBH-DGCLKSJQSA-N 273.340 2.248 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C[C@@H]2COc3ccccc3O2)C1 1912196205 JUIRWVHPGFXDOJ-GHMZBOCLSA-N 260.297 2.211 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(CCc2cnccn2)C1 1912198130 CNDMFLXGWSQTIO-LBPRGKRZSA-N 260.345 2.432 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)C2Cc3ccccc3C2)C1 1912157975 ZSZCFYRBRUYQBV-CYBMUJFWSA-N 256.309 2.313 10 10 CECE C[C@H](C(=O)N1CCCCC1)N1CCC[C@H](CN=[N+]=[N-])C1 1912142973 YDVVVPGBVQLMBV-CHWSQXEVSA-N 279.388 2.410 10 10 CECE CCCOCC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912173516 NNXKGYCYARLBQA-NSHDSACASA-N 254.334 2.352 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(CC(=O)NCc2ccc(Cl)cc2)C1 1912168701 WGJAVLAUCSHOKG-GFCCVEGCSA-N 293.758 2.341 10 10 CECE COC[C@@H]1C[C@H]1COC(=O)CCc1ccc(N)cc1 2133577399 DDKQAIYEVBPGDD-STQMWFEESA-N 263.337 2.027 10 10 CECE CCCNCc1ccc(N(CC)CCO)c(OC)c1 212676030 GCTHQPXUXFZFIF-UHFFFAOYSA-N 266.385 2.013 10 10 CECE Cc1ccc(C=C2SC(=S)N(N)C2=O)cc1 1911815401 SVODAUGMWZCOGI-UHFFFAOYSA-N 250.348 2.070 10 10 CECE C/C(=C\c1ccccn1)C(=O)NCc1cccc(O)c1O 1455316074 NIPGEHOLQSIGQJ-PKNBQFBNSA-N 284.315 2.213 10 10 CECE COc1ccc(CNCC(C)(C)CCCO)c(O)c1 221388553 PTMUNVQLGBIJTQ-UHFFFAOYSA-N 267.369 2.289 10 10 CECE CN(c1ccc(C=CC(=O)O)cc1Cl)C1COC1 1915707233 JTBSOZZRHAHJSN-UHFFFAOYSA-N 267.712 2.273 10 10 CECE COCc1cc(O)ccc1NC(=O)c1cccc(O)c1O 1451257026 WGFMDBLNKSXFSX-UHFFFAOYSA-N 289.287 2.202 10 10 CECE CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1[C@@H](CO)N=[N+]=[N-] 1535978935 PGPBIQSUZSSLED-HLTSFMKQSA-N 274.296 2.005 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCC=CO1 1540440367 FOKXEZQVXSDIQT-OAHLLOKOSA-N 274.364 2.404 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H](CCO)C2)c(F)c1 227407297 STKQWWAFYHXRGU-VXGBXAGGSA-N 266.360 2.444 10 10 CECE CSCC1(CCNC(=O)Cc2ccc(O)c(O)c2)CC1 1557422901 UBUXSFKCVSDQAO-UHFFFAOYSA-N 295.404 2.290 10 10 CECE COC(=O)[C@@H](NC(=O)c1cc(O)cs1)c1ccccc1 1558723671 UHMNWZSMAPQALN-LBPRGKRZSA-N 291.328 2.098 10 10 CECE Oc1c(F)cccc1CN[C@@]12CCC[C@@H](C1)OC2 1925085072 UJBJXMSUAIVQJX-FZMZJTMJSA-N 251.301 2.333 10 10 CECE COc1cnc(F)c(C(=O)N[C@@H](C)c2ccccc2O)c1 1635803212 BFGDQYLGTMQEFV-VIFPVBQESA-N 290.294 2.426 10 10 CECE O=C(NCc1c(O)ccc2ccccc12)c1ccon1 1652705386 CNRDPYIVXKYTAN-UHFFFAOYSA-N 268.272 2.463 10 10 CECE COc1ccc(N(C)Cc2ccncc2F)c(N)c1 2138234734 QYSRWTGXFOXRGW-UHFFFAOYSA-N 261.300 2.448 10 10 CECE CNC(=O)[C@@]1(C)CCN([C@@H](C)c2ccc(F)cc2O)C1 230923410 JJFINDJGMAOQTP-BONVTDFDSA-N 280.343 2.050 10 10 CECE CNCc1ccc(N(C)[C@@H]2CC[C@@H]2OC)cc1OC 2139702021 FXQCIXSPLSITJZ-KGLIPLIRSA-N 264.369 2.028 10 10 CECE COCCOCCCN(C)Cc1ccc(C)cc1O 2139789672 CNOPBZZVHQYIDL-UHFFFAOYSA-N 267.369 2.186 10 10 CECE Cc1cccc(CN=c2[nH]c(Cl)nc(C)c2N)c1O 2139740696 BWAWXCYGMGKYEE-UHFFFAOYSA-N 278.743 2.069 10 10 CECE CCOC(=O)c1ccc(=Nc2cc(Cl)ccc2O)[nH]n1 1859849560 KXVLFWSFHNKTFV-UHFFFAOYSA-N 293.710 2.178 10 10 CECE CN(C)c1ccc([C@@H](c2ccncc2)N2CCNCC2)cc1 19932235 VYVKJVJVZVXLOA-SFHVURJKSA-N 296.418 2.142 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CCCC[C@H]1OC 233698952 XFVFKGDMXQWMKX-YPMHNXCESA-N 284.360 2.167 10 10 CECE COC[C@]12C[C@](NCc3cc(Cl)ccc3O)(CO1)C2 2141143127 POTFWUARNGZVIR-HDJSIYSDSA-N 283.755 2.083 10 10 CECE CCn1cnc(CNCc2ccc(N(C)C)cc2)c1 902040829 DYPZJNFRDUIHIG-UHFFFAOYSA-N 258.369 2.259 10 10 CECE COc1ccc(N2CC[C@@H]3CCNC[C@@H]3C2)cc1C 2141645363 IHTSRCXJJCOEIU-UONOGXRCSA-N 260.381 2.439 10 10 CECE Cc1ccc(O)c(CNCCC(=O)NCc2ccco2)c1 1857861622 ARSBKRYTXRMURM-UHFFFAOYSA-N 288.347 2.090 10 10 CECE N[C@@H](c1ccccc1O)[C@H](O)c1occc1Br 1943692118 WYVCNLMYVDKYNO-QWRGUYRKSA-N 298.136 2.481 10 10 CECE COc1ccc(CN(C)C[C@]2(C)CCCO2)c(O)c1 1876698586 PUDPAVDFMXNLCB-HNNXBMFYSA-N 265.353 2.402 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@]12C[C@H](CN1)C2 1877340953 QCEPJRAOOMCWTA-VBNZEHGJSA-N 258.365 2.072 10 10 CECE CC[C@H](c1ccccc1O)N1CC2CC1(C(=O)O)C2 1877378865 RRXPMKFEZSNZCD-WBFHCKIUSA-N 261.321 2.392 10 10 CECE Cc1cc(CN)nc(N(C)Cc2ccccc2O)c1 1877532852 LDRMCGSBJMWUQW-UHFFFAOYSA-N 257.337 2.191 10 10 CECE CN(Cc1ccccc1O)c1ccn2ccnc2n1 1877517157 FDGQBVYVZZABML-UHFFFAOYSA-N 254.293 2.071 10 10 CECE C[C@H]1N2CCC(CC2)[C@@]1(O)c1ccc(N(C)C)cc1 1877868998 STQYRDWZVIWELP-WBMJQRKESA-N 260.381 2.054 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(N)=O)[C@@H]1CCCC2(CC2)C1 1879776435 OYPPXIZAIDNYGZ-GHMZBOCLSA-N 265.361 2.101 10 10 CECE C[C@]12CO[C@](CNCc3ccc4c(c3)CCO4)(C1)C2 1879851325 ZZVZUJNOCXZRAW-IYBDPMFKSA-N 259.349 2.280 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@@H]3COCC[C@@H]32)c(F)c1 1880928174 PJJUSCBGBZRVTR-JQEORGNBSA-N 268.307 2.210 10 10 CECE Oc1cccc(Cl)c1CN1C[C@H]2CO[C@@H](C2)C1 1946945661 CXSBBKYZLHBIAP-UWVGGRQHSA-N 253.729 2.266 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]1CC(=O)NCCN=[N+]=[N-] 1886046926 JIEXFBYCLUXAAB-NXEZZACHSA-N 297.359 2.106 10 10 CECE NC[C@@]12CCC[C@@H]1CCN2Cc1cc(F)ccc1O 1889558474 OVACTZRFCUYWGF-DOMZBBRYSA-N 264.344 2.235 10 10 CECE C[C@H](CN1CCCC1)NCc1ccc(F)cc1O 1964554403 FOIOBMGLSLIHFI-LLVKDONJSA-N 252.333 2.105 10 10 CECE OC[C@H](NCc1ccc(F)cc1O)c1ccccc1 1964559411 CHZMHELHOXZHRF-AWEZNQCLSA-N 261.296 2.355 10 10 CECE CCN[C@@H](Cc1cnn(C)c1)c1ccc(N(C)C)cc1 137481313 ZIGPGXPNNVDGIU-INIZCTEOSA-N 272.396 2.379 10 10 CECE Oc1cc(F)ccc1CNC1CC(c2ncc[nH]2)C1 1967713651 PVGOQWDBVQIFLM-UHFFFAOYSA-N 261.300 2.290 10 10 CECE Cc1cccc(CNC[C@@H]2CCS(=O)(=O)[C@H](C)C2)c1O 1967901030 IIJRUHAJDMRZBE-CHWSQXEVSA-N 297.420 2.004 10 10 CECE Cc1cccc(CN[C@@H]2CCC[C@H]3CNC[C@@H]32)c1O 1967985064 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CC[C@H](NC)c1ccc(N2CC(=O)NC(C)(C)C2)cc1 2150471083 XBFVLPCGWNLMFE-AWEZNQCLSA-N 275.396 2.072 10 10 CECE C[C@@H](NC1CC(O)(C(F)(F)F)C1)c1cc(O)ccc1O 2158823136 MMFNPNVGCBLFPB-OQNPIJIBSA-N 291.269 2.204 10 10 CECE CC[C@H](C)[C@H](NCc1ccc(OC)cc1O)C(=O)OC 40906497 DPZDVGLFBVLCAF-HZMBPMFUSA-N 281.352 2.078 10 10 CECE COCCC1CN(c2ccc([C@@H](C)O)cc2[N+](=O)[O-])C1 2152250796 AMPJCGODNNYXAK-SNVBAGLBSA-N 280.324 2.121 10 10 CECE CCOc1cc([C@H](O)c2ccc(N(C)C)cc2)ncn1 2158086119 OZZGLQDFQUBYER-OAHLLOKOSA-N 273.336 2.023 10 10 CECE COc1ccc(O)c(CN2CC[C@H](CC(=O)O)[C@@H]2C)c1 2153489359 DFCIWLFSQAMMTJ-WDEREUQCSA-N 279.336 2.086 10 10 CECE OCc1cc(F)c(N2CCn3ncc(Cl)c3C2)c(F)c1 2154038172 GYKRFLDYOUXUND-UHFFFAOYSA-N 299.708 2.327 10 10 CECE C[C@@H](N)c1ccc(N2CCN3CCCC[C@H]2C3)cc1O 2154250353 BLGJYDIZPSOUMK-OCCSQVGLSA-N 275.396 2.086 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CCC[C@H](CO)C1 50560532 MSSLWLOEOJXYOW-HNNXBMFYSA-N 274.408 2.456 10 10 CECE CN(C)[C@H]1CCCCN(c2c(F)cc(CO)cc2F)C1 2154978803 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VKVKGEKGGIPNNP-MWLCHTKSSA-N 271.307 2.318 10 10 CECE CC[C@H](C)NC(=O)N1CCOc2ccc(N(C)C)cc2C1 822635490 XTAJHUHYFCHDGC-LBPRGKRZSA-N 291.395 2.455 10 10 CECE COc1cccc(CN(C[C@@H]2CCCN2)C(C)C)c1O 234973207 RYFBMRBWNABALI-AWEZNQCLSA-N 278.396 2.363 10 10 CECE O=C(O)C12CCC(CC1)N2Cc1cc(F)cc(F)c1O 2143586290 NPHXJSHOPJBMJK-UHFFFAOYSA-N 283.274 2.252 10 10 CECE CO[C@H]1C[C@@H](N[C@H](C)c2ccccc2O)C[C@H]1OC 1875527550 WFLAZZDXTNJYMI-HKCMKHECSA-N 265.353 2.235 10 10 CECE CN(C[C@]12C[C@H](CO1)C2)c1ccc2c(c1)CC[C@H]2N 1879888804 NZRXETVMCHFAPH-LYRGGWFBSA-N 258.365 2.248 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](O)C(C)(C)C2)c(F)c1 1880488437 VGYGULNHHGEQLY-QPUJVOFHSA-N 271.307 2.225 10 10 CECE CCCC1(O)CN(c2c(F)cc([C@H](C)N)cc2F)C1 1880967527 BMWCEQJXZJVFQU-VIFPVBQESA-N 270.323 2.336 10 10 CECE Nc1ccc(CN2CCC[C@@H](n3cccn3)C2)cc1 1963537277 DEHCXURPLRVECN-OAHLLOKOSA-N 256.353 2.302 10 10 CECE c1cc2c(cc1CNC1([C@@H]3CCCO3)CC1)CCO2 1962770195 RFRKLLQEZORQKK-HNNXBMFYSA-N 259.349 2.423 10 10 CECE COCCC1CN(c2ccc(CN)c(Br)c2)C1 1946879841 PYDNXJSYAZXSFD-UHFFFAOYSA-N 299.212 2.381 10 10 CECE NCc1ccc(N2CCCN3CCC[C@H]3C2)cc1Cl 249896354 GMIJTEUNTHPBJM-AWEZNQCLSA-N 279.815 2.473 10 10 CECE CCN[C@H]1CCCN(Cc2cc(F)ccc2O)C1 1964655071 WZKDYBUXSUXQSP-ZDUSSCGKSA-N 252.333 2.105 10 10 CECE C[C@H](NC[C@@H]1C[C@H]2O[C@H]1[C@@H]1C[C@@H]21)c1c(O)cccc1O 2144065763 PDIKZLANYDUZMC-MCZSZQHBSA-N 275.348 2.172 10 10 CECE Cc1csc([C@H](N)[C@H](O)c2ccc3c(c2)CCN3C)n1 2147837947 UADJVQRVJPTRHQ-ZIAGYGMSSA-N 289.404 2.177 10 10 CECE O=C1[C@@H](NCc2ccc(Cl)cc2O)CCCN1C1CC1 1967730938 SGPYKHMNSJWEKY-ZDUSSCGKSA-N 294.782 2.289 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@H]2CCNC[C@@H]2C1 1967988673 SMQGNMYVWDJESF-VXGBXAGGSA-N 280.799 2.477 10 10 CECE CC[C@@H]1CCN(Cc2cccc(OC)c2O)[C@@H]1C(=O)O 1968201853 KEGJKPYYMLIENQ-MFKMUULPSA-N 279.336 2.086 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H]2CC[C@H](C1)O2 1968864673 BYBDDBQTWXNZSZ-ZSOGYDGISA-N 275.348 2.308 10 10 CECE Oc1cccc(CNCc2cc(Cl)ns2)c1O 2002128931 OYOAWXIMIZBKBP-UHFFFAOYSA-N 270.741 2.498 10 10 CECE CON(C)C1CN(c2ccc(CNC(C)C)cc2C)C1 2144632840 VUXYUVPJEGUKAR-UHFFFAOYSA-N 277.412 2.175 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H](CCO)CC2)cc1O 2149741933 UPRFFQQCELIBAE-QWHCGFSZSA-N 279.380 2.434 10 10 CECE CO[C@@H]1CN(c2ccc(C[C@H](C)N)c(C)c2)CC12CC2 2149722068 BTYMVCRNEZKONZ-XJKSGUPXSA-N 274.408 2.500 10 10 CECE CN(CCOC[C@H]1CCCCO1)c1ccc(N)cc1 1971390658 AHZDBBVUNZFWOF-OAHLLOKOSA-N 264.369 2.291 10 10 CECE OCc1ccc(N2C[C@H]3OCC[C@@H]3C2)c(Br)c1 2004625001 OJXKMERGWXBVBI-ZWNOBZJWSA-N 298.180 2.167 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CCN2CCC[C@@H]2C1 158823905 IFMFNZZBJDLUIJ-CHWSQXEVSA-N 264.344 2.248 10 10 CECE CNCc1ccc(N2CC[C@@H](C)[C@@H]2C(=O)NC)c(Cl)c1 2146460818 SNSBGUHRSGIXPI-QMTHXVAHSA-N 295.814 2.020 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@@H]2CCNC[C@H]2C1 2148937655 YZGOXBQAOMYWAI-AGIUHOORSA-N 276.380 2.090 10 10 CECE CC(C)NCCC(=O)N(C)[C@@H](C)c1ccccc1O 37826569 BFEAFTFJAVYMLA-LBPRGKRZSA-N 264.369 2.300 10 10 CECE O=C(O)Cc1cccc(CSc2nccs2)n1 1997670413 CLDJBXLOCUFDJZ-UHFFFAOYSA-N 266.347 2.458 10 10 CECE Cn1cnc(Sc2nccs2)c1CNC1CC1 2006602300 YSIVVBNSDPVNDZ-UHFFFAOYSA-N 266.395 2.280 10 10 CECE C[C@@H]1COCCN1c1cc(Cl)c(CN)cc1F 2008207060 QSFASDCBGACIQB-MRVPVSSYSA-N 258.724 2.163 10 10 CECE C[C@H](OC[C@H]1OCC[C@H]1C)C(=O)Nc1ccc(N)cc1 2152441413 TUFIODXMXSWTHT-UHIISALHSA-N 278.352 2.037 10 10 CECE Cn1nc(CN2CCC[C@H]2CN=[N+]=[N-])cc1Br 2009445640 QJLZQPJMYXVUJQ-VIFPVBQESA-N 299.176 2.457 10 10 CECE COc1cccc(CNC[C@@]23CCC[C@@H]2CCO3)c1O 2153053230 OAOKUJFYOMMOGF-CJNGLKHVSA-N 277.364 2.450 10 10 CECE CCC1(CC)OCCC[C@@]1(O)[C@H](N)c1ccccc1O 2155089376 KRJSRMFDUKQRKC-GDBMZVCRSA-N 279.380 2.492 10 10 CECE C[C@@H]1C[C@@H](NC(=O)c2ccc(O)c(O)c2)CCS1 2027207001 BSEJHHRRCUCBGX-SCZZXKLOSA-N 267.350 2.112 10 10 CECE Nc1ccc(CCN=c2[nH]c3c(s2)CCC3)cc1 2029667415 MTBJHGIYVAKGJM-UHFFFAOYSA-N 259.378 2.291 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)CSC[C@@H]1C 2031152238 CMVWJPJQUOAUQB-GDLCADMTSA-N 267.394 2.157 10 10 CECE COCCNCc1cnc(Sc2nc(C)co2)s1 2037794015 MGSUJURCFXVSHY-UHFFFAOYSA-N 285.394 2.327 10 10 CECE COc1ccc(O)c(CN2CCCNC[C@@H]2C(C)C)c1 2159170060 VWUSDCURGUDFEO-OAHLLOKOSA-N 278.396 2.221 10 10 CECE Oc1c(Cl)cccc1CNCC1(O)CCSCC1 305779176 NBFNPZOYGONLGK-UHFFFAOYSA-N 287.812 2.393 10 10 CECE COc1ccc(CNCCCn2ccnc2C)c(O)c1 2159894917 OUCGHJIICDPDFX-UHFFFAOYSA-N 275.352 2.086 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@](C)(OC)C2)cc1O 311559051 KJCZVURAMJMKBQ-XHDPSFHLSA-N 264.369 2.288 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CC[C@H](N)C(C)(C)C1 311986581 USBAVEHLQSTGNL-YGRLFVJLSA-N 264.369 2.218 10 10 CECE COC1CC2(CC(CNCc3ccc(O)cc3O)C2)C1 2157453403 LFEBTYYLPJRVRO-UHFFFAOYSA-N 277.364 2.393 10 10 CECE Nc1ccc(CCC(=O)N2CC(F)(F)C(F)(F)C2)cc1 313305686 PSTFMMGJMFZTMA-UHFFFAOYSA-N 290.260 2.314 10 10 CECE CCCNCc1cnn(C)c1C1=S=Nc2ccccc21 2159957513 ZXTSRFPUGLQLIC-UHFFFAOYSA-N 286.404 2.400 10 10 CECE C[C@@H](c1cc(O)ccc1O)N(CC(C)(C)C)C1CNC1 2160186775 JZZMCNCAMHRVPA-NSHDSACASA-N 278.396 2.479 10 10 CECE Cc1nc([C@@H]2CCN2c2ccc([C@@H](C)N)cc2F)no1 2160459193 MKABBHMZYHARBO-OQPBUACISA-N 276.315 2.488 10 10 CECE CN(C)C[C@@H]1CCN1c1ccc(CN)c2ccccc12 2160897248 OBJVXMIMNMUMSA-AWEZNQCLSA-N 269.392 2.439 10 10 CECE C[C@]1(C(F)(F)F)C[C@@H]1C(=O)NCc1cc(N)ccc1O 2161806691 HGQANTRFVSOJPX-SKDRFNHKSA-N 288.269 2.179 10 10 CECE Nc1ccc(OCCC(=O)NCC[C@@H]2CC2(F)F)cc1 701978031 SKNPLAMFBVOWLT-SNVBAGLBSA-N 284.306 2.199 10 10 CECE Oc1c(CNCC[C@@H]2CCOC2)ccc(F)c1F 703276537 QGJKWYYXJCDAGS-SECBINFHSA-N 257.280 2.187 10 10 CECE Cc1cccc(O)c1C(=O)NCc1ccccc1O 706637324 QVTVQPLOVKMTNF-UHFFFAOYSA-N 257.289 2.336 10 10 CECE OCCN(CC1CC1)c1ccc(CO)c(Cl)c1 688377325 KUUMGSSUNNQDAI-UHFFFAOYSA-N 255.745 2.041 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3OC(=O)N(C)[C@H]3C2)cc1Cl 2176930456 KHRBSNZIICVTIP-JCOFBHIZSA-N 296.754 2.033 10 10 CECE CCN(C(=O)[C@@H]1C[C@@H](C)O[C@@H]1C)c1ccc(N)cc1 686451460 RZNZZUARXMDZSG-JTNHKYCSSA-N 262.353 2.435 10 10 CECE CC(C)(C)CN(CCO)c1ccc(CN)c(F)c1 708526229 ISKSRRQXSKLNEM-UHFFFAOYSA-N 254.349 2.129 10 10 CECE C[C@H]1CN(Cc2cc(Br)ccc2O)C[C@H]1CN 708898782 APDJIEFJEXLONP-GXSJLCMTSA-N 299.212 2.181 10 10 CECE Cn1nccc1[C@H]1CCCN1CCc1ccc(N)cc1 2171781264 GYEMCZHJXPVKEM-MRXNPFEDSA-N 270.380 2.382 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cccn3ccnc23)C1 2177066373 KYJZQQUKOWCTTI-SNVBAGLBSA-N 270.296 2.249 10 10 CECE CCNCc1ccc(N2CCC[C@@H](CO)CC2)cc1 378744061 KRQQRHYGVBBCSB-OAHLLOKOSA-N 262.397 2.395 10 10 CECE COc1ccc(N2CCC[C@H](CO)CC2)c([N+](=O)[O-])c1 378803833 VQHMXGVOFQWBQW-NSHDSACASA-N 280.324 2.202 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H](CF)C3)c(Cl)cc21 711404956 AYYXHORVHLNNLK-KRTXAFLBSA-N 283.734 2.088 10 10 CECE Cc1cc(N(C)C[C@@H]2C[C@@H]3C[C@@H]3CO2)ccc1CCN 2179463111 WRGUGLGJYBEXEP-UXLLHSPISA-N 274.408 2.357 10 10 CECE Oc1cccc(CN[C@H]2CCCSCC2)c1O 692507997 NXSIMLNSURCUNZ-NSHDSACASA-N 253.367 2.473 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC(C4CCC4)C3)ccc21 2172048705 UEJNMHQHGZQIET-OAHLLOKOSA-N 271.364 2.136 10 10 CECE CSC(C)(C)CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 713948472 ISLRGDVGDJZSDE-CYBMUJFWSA-N 294.420 2.274 10 10 CECE CCCNCc1ccc(N2C[C@H](F)[C@@H](CO)C2)c(C)c1 2177149809 NTSDOLWAJYKTMT-CABCVRRESA-N 280.387 2.261 10 10 CECE CCn1cc([C@@](C)(N)c2ccc3c(c2)CCN3C)cn1 2163066661 OBZGTYSTESNKLR-INIZCTEOSA-N 270.380 2.118 10 10 CECE FC1(F)Oc2ccc(N3CC[C@@H]3CNC3CC3)cc2O1 696321358 SNGBETRWRWDCME-LLVKDONJSA-N 282.290 2.339 10 10 CECE CC[C@@H]1[C@@H](CO)CCN1c1ccc(CNC)cc1C 385712947 RDSPVQIURRZKSM-HUUCEWRRSA-N 262.397 2.312 10 10 CECE CN1CCCc2cc(CNC[C@H]3[C@@H]4COC[C@H]34)ccc21 385812497 LGJQRCGYLDHBDI-PHZGNYQRSA-N 272.392 2.051 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1[C@@H]2CCNC[C@H]21 2163102566 LSVYGJYXMICUTG-QBPKDAKJSA-N 272.392 2.176 10 10 CECE Oc1c(Cl)cccc1CNCc1cnc2cccnn12 2172226362 VPMZMCCSQACRBY-UHFFFAOYSA-N 288.738 2.378 10 10 CECE CCCC(=O)NCCN[C@H](C)c1cc(F)ccc1O 393045596 JDRZJFLGNNZIGV-SNVBAGLBSA-N 268.332 2.098 10 10 CECE C[C@H](N[C@@H]1CC[C@@]12C[C@H]2C(=O)O)c1ccc(F)cc1O 2172497029 LXEOWADTPPMEJG-BUWBAVOPSA-N 279.311 2.435 10 10 CECE c1cc2c(cc1CNC[C@H]1C[C@H]3CC[C@H]1O3)CCO2 394066820 LWPPDNYLMUSWJN-IIAWOOMASA-N 259.349 2.279 10 10 CECE CC(C)NCc1ccc(N2CC(C)(O)C2)cc1Cl 394926613 JWARBJBJLXEGQF-UHFFFAOYSA-N 268.788 2.409 10 10 CECE CC1(C)C[C@H](CO)CN(c2ccc(CN)c(F)c2F)C1 2172581668 VQPNWHLPMFWWEY-JTQLQIEISA-N 284.350 2.268 10 10 CECE CC[C@@H](O)CCCNCc1ccc(OC)cc1O 398574749 MTJRPNBOAZEYTN-GFCCVEGCSA-N 253.342 2.042 10 10 CECE CC[C@]1(C)CCN(c2cc3c(cc2N)OCC(=O)N3)C1 399325167 LSKNFSKOHJCYKN-OAHLLOKOSA-N 275.352 2.226 10 10 CECE C[C@@H](N[C@H](CN(C)C)C(F)(F)F)c1c(O)cccc1O 2177720296 UGCCOJIPGGYXAY-LDYMZIIASA-N 292.301 2.241 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1nc(C)cn1C 2166631553 XRVGKEDNYANJKT-OAHLLOKOSA-N 272.396 2.493 10 10 CECE COc1ccc(O)c([C@H](C)N2[C@H]3CC[C@H]2[C@H](CN)C3)c1 2174293815 MYYFNDFGWOXALX-ASHKBJFXSA-N 276.380 2.273 10 10 CECE COCCNCc1ccc(N2CC3(F)CC2C3)cc1C 2167642235 HMBRNORRCIVVPW-UHFFFAOYSA-N 278.371 2.422 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1ccc(=N)[nH]c1 2169174253 YLMJGXSNZUAXAV-INIZCTEOSA-N 270.380 2.259 10 10 CECE Cc1cc(CNC(C)C)ccc1OC[C@]1(O)CCOC1 2169643781 ISMMJEZCJTYQDD-INIZCTEOSA-N 279.380 2.023 10 10 CECE COC[C@](C)(CN1CCc2cc(N(C)C)ccc21)OC 2198256674 WZKWJTPOKLEENA-INIZCTEOSA-N 278.396 2.167 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)c1nn(C)cc1S 2192596208 OPTLHSTVVAFUSB-SECBINFHSA-N 291.376 2.248 10 10 CECE CC(C)[C@@H]1NCC[C@]1(O)c1ccc(N2CCCC2)cc1 2188251466 GTSGZLZNXWYPHW-IRXDYDNUSA-N 274.408 2.492 10 10 CECE CC[C@@H](c1ccccc1O)N(C)[C@H]1CCC(=O)N(C)C1 2188462737 AWKYWQNBNSLFRJ-JSGCOSHPSA-N 276.380 2.396 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@H]1CC(=O)N2CCC[C@H]12 2188488387 XGLZKCFWORZLNV-KGLIPLIRSA-N 294.782 2.032 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@H]1CCN(C)C(=O)C1 2188463919 MTNGJRXPWCAXBG-JQWIXIFHSA-N 280.343 2.145 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@H]2[C@@H]1[C@H]1CC[C@H]2O1 2188732207 SSXRPSLEXDWNHV-CNKRUPENSA-N 275.348 2.056 10 10 CECE Cc1cccc(N(C)C(=O)c2cc(O)c(O)c(O)c2)c1 2188868727 VWDYBWYVGUVOLB-UHFFFAOYSA-N 273.288 2.388 10 10 CECE C[C@H]1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1(C)C 2188921140 AMDVHWWJQPBLBW-VIFPVBQESA-N 279.336 2.312 10 10 CECE Cc1ccc(CN2CCc3cc(N(C)C)ccc32)nn1 2196011037 JZQJEVATSXSBBM-UHFFFAOYSA-N 268.364 2.414 10 10 CECE CN1CCc2cc([C@@H](O)c3cc(F)ncc3F)ccc21 2196426053 JMSVCRJCRKKDBS-OAHLLOKOSA-N 276.286 2.434 10 10 CECE CCOc1cccc(CNC[C@]23C[C@H](CCO2)C3)c1O 2193684901 JVFOECSFDVGXCI-DRQUAOQDSA-N 277.364 2.450 10 10 CECE Nc1ccc(CS(=O)(=O)NC2CC3(C2)CC32CC2)cc1 2184044127 DFBXQMPSBBCGRN-UHFFFAOYSA-N 292.404 2.021 10 10 CECE C[C@H](NC[C@@H]1CCC[C@H](C(=O)O)O1)c1ccccc1O 2193759711 BFKBKLVSCUCIJI-COPLHBTASA-N 279.336 2.065 10 10 CECE C[C@@H](NC(=O)[C@H]1NCCSC1(C)C)c1ccccc1O 2193913834 UJEXHXLJHMETOP-ZWNOBZJWSA-N 294.420 2.053 10 10 CECE CN1C[C@@H]2C[C@H](C1)CN2c1ccc2c(c1)CCC[C@H]2O 2184686565 IPAJPHKASVRVHT-ISTRZQFTSA-N 272.392 2.197 10 10 CECE CN[C@H]1CCc2cc(N3CCN4CCC[C@@H]4C3)ccc21 2184710244 CIVFKRHKHSJWAZ-WBVHZDCISA-N 271.408 2.178 10 10 CECE CO[C@@H]1C[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C12CCC2 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2.285 10 10 CECE CC[C@@H](CCCN1CC[C@H](CN=[N+]=[N-])C1)S(=O)(=O)O 2099270124 WLHCOPJPETUXSD-MNOVXSKESA-N 290.389 2.065 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)O 2201096597 QVJRJNJUWFGSBL-MAGOMRGPSA-N 277.320 2.096 10 10 CECE CNCc1ccc(N2CCCN(C3CC3)CC2)cc1 2113730184 DVSALPWTYFKQQK-UHFFFAOYSA-N 259.397 2.081 10 10 CECE C[C@@H]1C[C@@H](C)N(Cc2ccc(F)cc2O)C[C@@H]1C(=O)O 2204636827 VMQFAOZHCDVENA-BREBYQMCSA-N 281.327 2.462 10 10 CECE Cc1cccc(CNC(=O)c2cccc(O)c2O)c1O 2204620270 IYYSYTPUSUGJQX-UHFFFAOYSA-N 273.288 2.042 10 10 CECE Cc1ccc(CN2C[C@@H](C(F)(F)F)[C@H](CN)C2)c(O)c1 2204639699 PCDXZEMQDHWPHK-VXGBXAGGSA-N 288.313 2.270 10 10 CECE Oc1cc(F)ccc1CN(C[C@H]1CCCNC1)C1CC1 2204625439 RXLUFSZMJPTZNU-LBPRGKRZSA-N 278.371 2.495 10 10 CECE CC[C@H]1CN(c2ccc(OC)c3c2CCC3)C[C@@H]1O 2269179860 YIRFCXABQLKYFN-NHYWBVRUSA-N 261.365 2.391 10 10 CECE CCO[C@@H]1C[C@@H](NCc2cnc(SC)s2)[C@H]1OC 2208720710 RSGFHXUGTXQHTN-GMTAPVOTSA-N 288.438 2.147 10 10 CECE 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CECE COc1ccc(N2CCC[C@]3(CC[C@@H]3O)C2)cc1OC 2235120311 NPFVHWWVPPEHSE-HOTGVXAUSA-N 277.364 2.445 10 10 CECE CC[C@]1(CO)COCCN1c1cc(C)c(OC)cc1C 2235103537 KFIDPLMVFNGDLN-INIZCTEOSA-N 279.380 2.290 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@H](O)c1ccccc1 2225793823 AAQDKNYWPQARMY-TUAOUCFPSA-N 260.297 2.068 10 10 CECE COc1ccc(N2CCC[C@@H]2CO)c(CNC(C)C)c1 2235965436 DMWGIEXLSCFRET-CQSZACIVSA-N 278.396 2.154 10 10 CECE CNCc1cc(OC)ccc1N1CCCC[C@@H]1[C@H](C)O 2235960346 BQMHPZPTULIMCE-SWLSCSKDSA-N 278.396 2.154 10 10 CECE COc1ccc(N(C)C[C@H]2CCO[C@H]2C)c(C(=O)O)c1 2235951680 GKHADGCEOJKJKZ-WDEREUQCSA-N 279.336 2.255 10 10 CECE COc1ccc(N2CCC[C@@]3(CCOC3)C2)c(CO)c1 2236002531 NKMWJHWXWUMQOR-MRXNPFEDSA-N 277.364 2.194 10 10 CECE CNCc1cc(OC)ccc1N(C)[C@@H]1C[C@H]2CC[C@H]1O2 2236350299 OCCYMTREJDQYRK-FVQBIDKESA-N 276.380 2.171 10 10 CECE Cc1cc(NS(=O)(=O)c2cccc(F)n2)c(C)cc1O 2236904826 ZUMZQAASJNAVBY-UHFFFAOYSA-N 296.323 2.344 10 10 CECE COc1ccc(N2C[C@@H](CO)CC[C@H]2C)c(C=O)c1 2227694368 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10 10 CECE COc1cccc(O)c1CN[C@@]1(C2CC2)CCCOC1 2238368531 WDIKGMBVTOPFOB-INIZCTEOSA-N 277.364 2.450 10 10 CECE CCOc1ncc([C@H](NCCCN=[N+]=[N-])C(=O)OC)s1 2239771744 GOWAOJVAEIUSAK-VIFPVBQESA-N 299.356 2.046 10 10 CECE COC[C@H]1CCOCCN1c1ccc([C@H](C)O)cc1C 2240836737 KRWJBDNDHSTTJQ-DZGCQCFKSA-N 279.380 2.290 10 10 CECE CSc1ncc(CNCC[C@@H](N)C2CC2)s1 2243856711 PYAPWHDAAPYVQI-SNVBAGLBSA-N 257.428 2.082 10 10 CECE CCc1cc(CNCc2cnc(SC)s2)n(C)n1 2256937243 GVGGZKHLMGIWTK-UHFFFAOYSA-N 282.438 2.451 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1nccnc1Br 2248072346 PLGNQKVEWGXQKK-UHFFFAOYSA-N 299.132 2.012 10 10 CECE CCO[C@]1(CSc2ncc(C(=O)O)s2)CCOC1 2259047730 YRFMPGJMKYCIDP-LLVKDONJSA-N 289.378 2.129 10 10 CECE CSc1ncc(CNC[C@]2(N)C[C@H]3CCC[C@@H]32)s1 2259949441 QKQJFMAMWGXODP-SUZMYJTESA-N 283.466 2.472 10 10 CECE C[C@H](O)CN(c1ccc([C@@H](C)O)c(O)c1)C(C)(C)C 2272495632 DWIJNENVGRXWQR-WDEREUQCSA-N 267.369 2.431 10 10 CECE CN(c1ccc(OCF)cc1)[C@H]1CNCC1(C)C 2263931436 GQWBJJAFJUDMRD-ZDUSSCGKSA-N 252.333 2.427 10 10 CECE Cc1cc(N(C)CC2[C@@H]3COC[C@@H]23)ccc1[C@@H](C)O 2269687134 JLSCIQWYQNTZJE-RLCCDNCMSA-N 261.365 2.377 10 10 CECE CN(CC1=CCCCC1)C(=O)c1cc(O)c(O)c(O)c1 2281219437 RQBCMWWNJSEIBA-UHFFFAOYSA-N 277.320 2.376 10 10 CECE CCn1nncc1CN(C)c1ccc([C@H](C)N)c(C)c1 2285128041 GFKSTMDFNUTYKX-LBPRGKRZSA-N 273.384 2.263 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@]3(CO)C2)cc1C 2285144575 UPTZKOCPXVQIMR-JKIFEVAISA-N 274.408 2.484 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2COC3(COC3)C2)cc1Cl 2286259260 NKLCSBGHXDTYEG-PWSUYJOCSA-N 296.798 2.354 10 10 CECE CN[C@@H]1CCc2cc(N(C)Cc3ccnnc3)ccc21 2290046454 GMKNEXIXKNOZAT-MRXNPFEDSA-N 268.364 2.320 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)[C@H](F)C(F)(F)F 2298023816 LVMWMWZZNIKUHC-SRQIZXRXSA-N 254.187 2.234 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C12CCOC(C)(C1)C2 2315988471 IXKOLLFXVXNHTK-UHFFFAOYSA-N 252.318 2.104 10 10 CECE Oc1ccc(N=NN2CCN(c3ncccn3)CC2)cc1 2330146436 GHVDWPKXNQFLTL-UHFFFAOYSA-N 284.323 2.003 10 10 CECE CN1CCc2cc([C@@H](NN)[C@@H]3C[C@H]3C(F)F)ccc21 2329488840 KFNRJTWALXTWFS-NQBHXWOUSA-N 267.323 2.085 10 10 CECE CCN(CCN=[N+]=[N-])CC(=O)N1[C@@H](C)CCC[C@@H]1C 2337775657 DGFKKTZTFZFORV-RYUDHWBXSA-N 267.377 2.408 10 10 CECE C[C@H](NC[C@]1(C)CC=CCO1)c1cc(O)ccc1O 2340200035 GOMLXCVTFGSEOE-NHYWBVRUSA-N 263.337 2.484 10 10 CECE C[C@@H](NC1CC(N)(C(F)(F)F)C1)c1ccccc1O 2340377850 JMMLTHWXROIRHB-YDNLMGDJSA-N 274.286 2.465 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC[C@H]2CN(C)C)c1C 2340855560 KLUUAMURSYTMLQ-KGLIPLIRSA-N 261.413 2.463 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC3(CC[C@H]3O)C2)c1C 2341067727 SFSGPYFKSYUNFN-IUODEOHRSA-N 260.381 2.284 10 10 CECE O[C@@H]1CCc2cc(N3C[C@@H]4CC[C@@H]3[C@H](O)C4)ccc21 2349992689 HXDPMIZCCPEJQC-HMTTWLPMSA-N 259.349 2.016 10 10 CECE CN[C@@H](CN(C)c1ccc(OC)cc1)[C@H]1CC1(F)F 2352326155 ZYCLKUGGEWTJLN-OLZOCXBDSA-N 270.323 2.375 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H]1C[C@@H]2C[C@@H]2CO1 2355831449 ZZJVMHRHTMGXPX-OHTBPHCPSA-N 275.348 2.337 10 10 CECE CCNCc1ccc(OC)c(CN(C)C2CCOCC2)c1 50124941 KREHBWHXOILKMY-UHFFFAOYSA-N 292.423 2.416 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@H]2CCSC2)cc1 300270215 CQDUMQYZUYQLAZ-FZMZJTMJSA-N 266.410 2.212 10 10 CECE Nc1ccc(N2C(=O)NC[C@@H](c3ccccc3)C2=O)cc1 61609552 PGMNHMRQWIYSSI-AWEZNQCLSA-N 281.315 2.109 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H]2CO)c(Cl)c1 61696198 HFKNQZGZDATOBS-MWLCHTKSSA-N 254.761 2.321 10 10 CECE CN(C)c1ccc(CN2CCCC[C@@H]2CC(N)=O)cc1F 120651877 UUNRMAPDIZVCPZ-CYBMUJFWSA-N 293.386 2.122 10 10 CECE Cc1cc(Cl)cc(CN2CCO[C@@H](CN(C)C)C2)c1O 183400109 LXLSGTPZVHZQOR-AWEZNQCLSA-N 298.814 2.116 10 10 CECE CC(C)(C)OC(=O)C[C@@](C)(N)c1cccc(F)c1O 1951854619 KLJZXBFYLGEVLV-CQSZACIVSA-N 269.316 2.437 10 10 CECE CCN(C(=O)[C@@H]1CCSC1)c1ccc(N)cc1 70435548 IXLDJKIQEXQEEC-SNVBAGLBSA-N 250.367 2.375 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCC[C@@H](CN)C1 219068774 BKRZUVKRRCWWDS-MNOVXSKESA-N 252.333 2.263 10 10 CECE OCc1c(Sc2nccs2)nc2sccn12 82617064 ITKIVIPIJHSJFZ-UHFFFAOYSA-N 269.376 2.496 10 10 CECE Oc1ccc(F)cc1CNCC1CCC(O)CC1 227649812 AJEYNXBCWFDYOF-UHFFFAOYSA-N 253.317 2.172 10 10 CECE CCN(CCCC(=O)Nc1ccc(N)cc1)[C@H](C)COC 42737672 YKOSDEUGDNCHRS-CYBMUJFWSA-N 293.411 2.344 10 10 CECE CN1CCCC[C@@H]1CNCc1cc(F)ccc1O 234332240 IMADZBNUMJSIQC-CYBMUJFWSA-N 252.333 2.105 10 10 CECE CC[C@@H]1OCC[C@@H]1CNCc1ccc(O)c(O)c1 233915573 DEZBERNEGWJUBU-RISCZKNCSA-N 251.326 2.003 10 10 CECE C[C@H](CCN(C)C)N[C@H](C)c1c(O)cccc1O 235434836 BVLSVZAHPUUBJZ-GHMZBOCLSA-N 252.358 2.089 10 10 CECE COC[C@H](C)CC(=O)Nc1ccnn1-c1ccc(N)cc1 95034029 SLCSWGJKXBZUQG-LLVKDONJSA-N 288.351 2.066 10 10 CECE COCCN1CCN(Cc2cc(C)c(C)cc2O)C[C@@H]1C 247159986 QNLDUWRHMMSMNW-HNNXBMFYSA-N 292.423 2.162 10 10 CECE CC[C@@H]1COCCN1c1ccc([C@H](C)N)c(O)c1 251905930 XHRWFDSAOAYBHB-WDEREUQCSA-N 250.342 2.027 10 10 CECE COC(=O)C1(c2cc(O)c(O)c(Br)c2)CC1 260870255 QNUZERJRIPQMAQ-UHFFFAOYSA-N 287.109 2.065 10 10 CECE CC[C@H]1[C@@H](CO)CCN1Cc1cc(F)cc(C(C)=O)c1O 386248197 IUGXPYFKSCWXTH-ABAIWWIYSA-N 295.354 2.327 10 10 CECE COc1ccc(N2CCC(N[C@@H](C)[C@H](C)O)CC2)cc1 806171230 XAYGCHINXLBFFG-STQMWFEESA-N 278.396 2.023 10 10 CECE CC[C@H](NCc1cc(F)ccc1O)[C@H](O)C(F)F 294993170 HULLJVVLQXNGGL-ONGXEEELSA-N 263.259 2.026 10 10 CECE COc1ccc(N(C)[C@@H]2CCNC[C@@H]2C)c([N+](=O)[O-])c1 2162871536 ILJXXSJSHOKXPB-CMPLNLGQSA-N 279.340 2.038 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H](C)C(N)=O)cc1Cl 723177474 COJKSOMIYMIBBB-ZJUUUORDSA-N 283.803 2.321 10 10 CECE CCN1CCc2cc([C@H](O)C3CC(F)(CN)C3)ccc21 2163066557 NEPSRNFHTOCDED-SIWZUTFBSA-N 278.371 2.179 10 10 CECE CCN(CC)c1ccc([C@@]2(O)CCOC[C@@H]2OC)cc1 2163098421 BXRQPSNJBAQLMW-HOTGVXAUSA-N 279.380 2.156 10 10 CECE COCCOC[C@H](N)c1ccc(N2CCCCC2)cc1 2163109871 CWMBDRHXVUWPLY-INIZCTEOSA-N 278.396 2.340 10 10 CECE O[C@@H](c1ccc(N2CCCCC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 2163114119 SGAIBJWURZPKTO-IWCQGFGOSA-N 272.392 2.318 10 10 CECE CCN1CCc2cc([C@H](N)[C@@](C)(O)C(F)(F)F)ccc21 2163135764 NBLUQBIEHHDNBS-QWHCGFSZSA-N 288.313 2.382 10 10 CECE CN1CCc2cc([C@H](NN)c3ccc(F)cc3)ccc21 2163139104 VECDDVVZAGPHIR-MRXNPFEDSA-N 271.339 2.371 10 10 CECE CN(C)CC[C@H]1CCCCN1c1ccc(CO)cc1 701480982 XHWMSWBVADUETB-OAHLLOKOSA-N 262.397 2.490 10 10 CECE C[C@H](CCN(C)c1ccc2c(c1)NC(=O)[C@H]2N)C(F)F 2166575723 JMJVWMMVGSEADV-PELKAZGASA-N 283.322 2.366 10 10 CECE CO[C@H]1C[C@@H](OC)CN([C@@H](C)c2ccc(C)cc2O)C1 2165459216 VVMKGPZIQHXBLM-MELADBBJSA-N 279.380 2.497 10 10 CECE CN1CCc2cc([C@@H](O)CC3CC4(CNC4)C3)ccc21 2165633910 MCOIIXHMNAYWOA-INIZCTEOSA-N 272.392 2.102 10 10 CECE C[C@H](OCC(=O)N(C)c1ccc(N)cc1)C1CCC1 719744403 QADKQRRJOVQZHP-NSHDSACASA-N 262.353 2.437 10 10 CECE Cc1c(Cl)c(/C=C2\SC(=S)N(C)C2=O)nn1C 817706335 BEXWIKZSFIJZBC-DAXSKMNVSA-N 287.797 2.213 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@]1(C)CCCCN1 133292121 YNEHWSCXHNMTHH-WBMJQRKESA-N 276.380 2.444 10 10 CECE CC[C@@H](c1ccc(C)c([N+](=O)[O-])c1O)N1CCOCC1 575302288 HNWRKDYTNMEWJZ-LBPRGKRZSA-N 280.324 2.392 10 10 CECE OCc1cc(F)c(N2CC[C@@H]3OCC[C@@H]3C2)c(F)c1 724693515 PKYZTZUHWKDABV-MFKMUULPSA-N 269.291 2.072 10 10 CECE 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CN(C)c1ccc([C@@H](CN)N2[C@H]3CCC[C@@H]2C3)cc1 1899613280 LCOHFHABQZGAFT-OWCLPIDISA-N 259.397 2.379 10 10 CECE CCC[C@@H](N)CCNCc1cnc(SC)s1 2243844726 PLRSNMQSWJQTFO-SECBINFHSA-N 259.444 2.472 10 10 CECE CC[C@H](NCCOCCCN)c1cc(Cl)ccc1O 863547040 OFJSDZSVHABRBS-ZDUSSCGKSA-N 286.803 2.452 10 10 CECE C[C@@H]1C[C@H]1N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 863536232 UGOJCRBXXQFBNS-LDYMZIIASA-N 294.738 2.218 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1[C@@H]3C[C@H]4[C@H](CO[C@H]41)C3)CC2 866444724 CARSTEFIICMIKE-XTPYWUFDSA-N 271.360 2.393 10 10 CECE CN(Cc1cc(F)cc(F)c1O)[C@H]1CC[C@H](O)CC1 894535294 YLDHWJAVQNODFT-HAQNSBGRSA-N 271.307 2.406 10 10 CECE COCCN(CCOC)[C@@H](C)c1cc(F)ccc1O 133417002 LBBVSNGJLJLMPJ-NSHDSACASA-N 271.332 2.187 10 10 CECE Oc1ccc(O)c([C@@H]2NCCc3c2ccc(F)c3O)c1 83656614 KLZBGBRBIXXVFX-CQSZACIVSA-N 275.279 2.178 10 10 CECE Oc1ccc2c(c1O)[C@@H]([C@@H]1C[C@@H]3C=C[C@H]1C3)NCC2 83724199 NNMOKBGGUXOCIA-JDTTZNEISA-N 257.333 2.497 10 10 CECE COc1cc(Cl)cc(CNCCC2CC(O)C2)c1O 702491539 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CCCNCc1ccc(N2CC=C[C@H]2CO)c(F)c1 2119812028 JNQJLIALAWPIKI-ZDUSSCGKSA-N 264.344 2.062 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@H]1[C@H]2OCC[C@@H]21 2119950616 FWDXFUKJHGEUSS-QXSJWSMHSA-N 260.381 2.438 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@@H]1[C@@H]2CCCO[C@H]21 2119918048 WBFQPUUCVVADIF-SQWLQELKSA-N 261.365 2.349 10 10 CECE C[C@H](O)CN(C)c1ccc(OCC(F)(F)F)cc1 2219559709 BRAJAIRFKRLRGM-VIFPVBQESA-N 263.259 2.445 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)cc1 2121682829 DDXOJIPGHMDMSG-XHSDSOJGSA-N 260.381 2.144 10 10 CECE CN(C)c1ccc(/C=C/CN[C@@H]2C=C[C@@H](C(=O)O)C2)cc1 1334842198 UFCTUPUICJQLST-LRPXVYOUSA-N 286.375 2.385 10 10 CECE O[C@H]1CCc2cc(N3CCOC[C@H]3C3CC3)ccc21 2128323131 VDOCCJRWCVIGLH-HOTGVXAUSA-N 259.349 2.281 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3CCO[C@@H]3C2)cc1O 2128306273 JIVOLNRIKXMWFZ-FIXISWKDSA-N 263.337 2.061 10 10 CECE N[C@H]1CCc2cc(N3CCC[C@H](CO)CC3)ccc21 2128328298 MJFXXCWVZHSEAE-LRDDRELGSA-N 260.381 2.231 10 10 CECE COc1cc(C)cc(CN2CCCN3CCC[C@@H]3C2)c1O 1335666371 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298.814 2.301 10 10 CECE CCN(c1ccc(C=CC(=O)O)c(C)c1)C1CN(C)C1 2146887176 WWXHUUFSHWTMLJ-UHFFFAOYSA-N 274.364 2.233 10 10 CECE Nc1ccc(OCCC(=O)N2C[C@H]3CC[C@@]2(F)C3)cc1 2146821944 INXXJAGEQZXMFJ-NHYWBVRUSA-N 278.327 2.346 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](N)C1CCCC1 2149307753 GHVFASFMOCVGHF-IAQYHMDHSA-N 276.380 2.429 10 10 CECE CCCNC(=O)[C@H](C)N[C@@H](C)c1cc(C)ccc1O 36959866 LUHRJUQUWNNNLB-RYUDHWBXSA-N 264.369 2.266 10 10 CECE CCC1(F)CN(c2cc3c(cc2Cl)[C@H](NC)C(=O)N3)C1 2149827155 MLTCBYAUSKGHHH-LBPRGKRZSA-N 297.761 2.491 10 10 CECE CC(C)CN(C(=O)COc1ccc(N)cc1)C1CC1 40322201 TVTJVXBEOGRAAJ-UHFFFAOYSA-N 262.353 2.295 10 10 CECE Nc1ccc(NC(=O)CCN2CCS[C@@H]3CC[C@@H]32)cc1 2152207832 SQZDSECBCMWYRW-UONOGXRCSA-N 291.420 2.177 10 10 CECE CCC[C@H](C)CN(C)c1cc2c(cc1N)OCC(=O)N2 2152832328 VXSQRJUJBGUZIV-JTQLQIEISA-N 277.368 2.472 10 10 CECE COc1cccc(CNC[C@]23CCC[C@H]2CCO3)c1O 2153053232 OAOKUJFYOMMOGF-XJKSGUPXSA-N 277.364 2.450 10 10 CECE CCCN(Cc1ccc(N)cc1)C[C@@H]1COCCCO1 2154016194 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C[C@@H]1CO[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)C1 2038002830 PXTMGFWTXLHRCP-GARJFASQSA-N 252.318 2.103 10 10 CECE CC[C@H](C)N(C)CCN[C@H](C)c1c(O)cccc1O 300670890 YUYPVCKCLXTEOR-NWDGAFQWSA-N 266.385 2.479 10 10 CECE C[C@@H](C[C@H]1CCCS1(=O)=O)Nc1ccc(N)cc1 2039067185 BFBRFCCOFQPSNC-GXFFZTMASA-N 268.382 2.037 10 10 CECE CC1(C)C[C@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CO1 2041435491 PBSHBAVXHFPNBO-UWVGGRQHSA-N 252.318 2.103 10 10 CECE Cc1nccn1CCN(C)c1ccc([C@H](C)O)c(O)c1 2159894082 JXTCITRYLUTTBC-NSHDSACASA-N 275.352 2.087 10 10 CECE COC[C@H](C)CN(C)c1ccc(CN)c(F)c1F 310989042 SFVDPBSGLNZOLY-SECBINFHSA-N 258.312 2.142 10 10 CECE CCN(CC)C1[C@H]2CN(Cc3c(O)cccc3F)C[C@H]12 2160774157 KGFPTKRTPMPTKW-RYUDHWBXSA-N 278.371 2.303 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CCO[C@H](C)C1 2161704950 XWKRXQXGTPRSRZ-IJLUTSLNSA-N 284.360 2.023 10 10 CECE C[C@H](NC[C@@]12COC[C@@H]1C2(F)F)c1cc(F)ccc1O 2161875692 DBTCVRPUZKCWIZ-AQUOVQTQSA-N 287.281 2.464 10 10 CECE CNCc1ccc(N(C)C[C@]23COC[C@H]2C3(F)F)cc1 2161868701 DHTFMQZWMZDEAM-KGLIPLIRSA-N 282.334 2.124 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3OC(=O)N(C)[C@@H]3C2)cc1Cl 2176930453 KHRBSNZIICVTIP-BZHVJNSISA-N 296.754 2.033 10 10 CECE NCc1ccc(N2CCO[C@H]([C@@H]3CCOC3)C2)c(Cl)c1 2171755093 DAAFFJRTHQJFPY-DOMZBBRYSA-N 296.798 2.040 10 10 CECE CCN(CC)c1ccc(CNC[C@](C)(CO)OC)cc1 702527546 JVQDJEYMHMZLMJ-MRXNPFEDSA-N 280.412 2.020 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1cccn2ccnc12 2177066262 JMLPMDFQINDMJR-SNVBAGLBSA-N 270.296 2.249 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N3CC(C)C3)ccc21 704404821 QTANROVHPZBHFL-CQSZACIVSA-N 259.353 2.136 10 10 CECE C[C@H]1CCCCN(c2ccc3c(c2)N(C)C(=O)[C@H]3O)C1 705971663 SSPOAFLXRROZDD-NHYWBVRUSA-N 274.364 2.323 10 10 CECE OCc1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)cc1C(F)(F)F 2172057251 ZULGJMPSPRKOEQ-CDMKHQONSA-N 287.281 2.157 10 10 CECE NCc1ccc(N2CC(OCC(F)F)C2)c(Cl)c1 708248761 JWDPPZVSAPCWFC-UHFFFAOYSA-N 276.714 2.269 10 10 CECE CC1(C)OCC[C@H]1NCc1cc(F)cc(F)c1O 708438793 YSQZQWMZHSZIDV-LLVKDONJSA-N 257.280 2.328 10 10 CECE C[C@@H]1CCN(C(=O)CCOc2ccc(N)cc2)CCS1 379532612 YZTCCGJVRKEVGH-GFCCVEGCSA-N 294.420 2.392 10 10 CECE CCc1cccc(CNCc2nccn2CC)c1O 691433801 JIZIKAOPEAZWAB-UHFFFAOYSA-N 259.353 2.461 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@]23CCOC3)cc1O 380686707 DMJSKZDKCHPBDG-WBMJQRKESA-N 276.380 2.432 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3[C@H]4CCC[C@H]3CC4)ccc21 380734202 JNYHYMBRNVCJIA-PGUXBMHVSA-N 271.364 2.421 10 10 CECE Cc1cc(N2CC[C@H]3[C@H]2CCCN3C)ccc1CO 720468516 YURINACIVKWAHY-JKSUJKDBSA-N 260.381 2.160 10 10 CECE C[C@@H](NC[C@](C)(O)C(F)F)c1ccc(F)cc1O 698681848 JUGSMEJONINDDH-KRTXAFLBSA-N 263.259 2.198 10 10 CECE CCNCc1ccc(N2CCN3CC[C@H]2C3)c(Cl)c1 381658962 DIFPHAIOOFZSMR-ZDUSSCGKSA-N 279.815 2.344 10 10 CECE Cc1cc(N2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)ccc1CN 718250758 JYTSGZGHXFPSJX-QKPAOTATSA-N 258.365 2.067 10 10 CECE CCNCc1ccc(N2C[C@H](O)C(C)(C)C2)cc1C 388051905 AEUGOAIGXVWYSE-HNNXBMFYSA-N 262.397 2.312 10 10 CECE CCc1cccc(CN[C@H]2CCCn3ncnc32)c1O 848898591 WHXHUYALRHUWNR-ZDUSSCGKSA-N 272.352 2.171 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1CC12CCOCC2 780027046 KWRNYFCJPUMSHU-GFCCVEGCSA-N 265.328 2.438 10 10 CECE CN1CCc2cc([C@@H](O)[C@](C)(N)CC(F)(F)F)ccc21 2175097461 MGONAFBKZKUFJP-CHWSQXEVSA-N 288.313 2.382 10 10 CECE O=C(NC1CC1)c1ccnn1Cc1cc(Cl)ccc1O 2069959315 XOSPFFBVQYSMEW-UHFFFAOYSA-N 291.738 2.183 10 10 CECE CCNC(=O)c1cc(C)nn1Cc1ccc(Cl)cc1O 2070136478 IHYIKEJMDFMHJK-UHFFFAOYSA-N 293.754 2.349 10 10 CECE OCC1CC(F)(CNCc2ccc3c(c2)CCCO3)C1 2168691740 BNZDZWGEIFTVMJ-UHFFFAOYSA-N 279.355 2.212 10 10 CECE CC[C@H](c1ccccc1O)N1CC[C@@H](S(=O)(=O)CC)C1 2179906507 XVYQQNZLHBFNSV-TZMCWYRMSA-N 297.420 2.352 10 10 CECE C[C@@H](NC(=O)[C@H](N)C1CC(C)(C)C1)c1ccccc1O 2192631387 HJHLVZRQAGKMCJ-QMTHXVAHSA-N 276.380 2.333 10 10 CECE COc1ccc(CNC2CC2)cc1COC[C@H](C)OC 2183051644 BECCNDSAPNYCBC-LBPRGKRZSA-N 279.380 2.499 10 10 CECE Cc1cc(CN2CCc3cc(CN)ccc32)nnc1C 2189923180 ODSQVDIGAJRZRC-UHFFFAOYSA-N 268.364 2.115 10 10 CECE CCN[C@H]1CCCc2cc(N3CC[C@@H](CO)C3)ccc21 2184686209 FIVLPLXNEBPWBP-DYVFJYSZSA-N 274.408 2.492 10 10 CECE CN[C@H]1CCCc2cc(N3CC[C@](F)(CO)C3)ccc21 2184682778 SCTFBMUTVOYIPN-JKSUJKDBSA-N 278.371 2.194 10 10 CECE CN[C@@H]1CCCc2cc(N(C)C[C@H](O)C3CC3)ccc21 2184688334 YCSALHBBLCDILM-SJORKVTESA-N 274.408 2.491 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H]4C[C@H](C[C@@H]4O)C3)ccc21 2184721663 PDRWKOFJVYGYLI-KVPRVUCYSA-N 272.392 2.100 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)[C@H]1COCCC1(F)F 2184741714 NUWVNZIHSWTGRS-KBPBESRZSA-N 282.334 2.493 10 10 CECE COCCN(c1ccc2c(c1)CC[C@H]2O)[C@@H](C)COC 2184733790 LLYPEBPBGMWFJL-BLLLJJGKSA-N 279.380 2.154 10 10 CECE CC1(C)[C@H](O)[C@@H]2CCN(c3ccc4c(c3)CC[C@@H]4O)[C@H]21 2184737164 CEMOZSRPDZGQAX-QKPAOTATSA-N 273.376 2.262 10 10 CECE COc1cccc(CNC[C@@H]2C[C@@]23CCCOC3)c1O 2198145194 DJZBWHMDTAYIJW-XJKSGUPXSA-N 277.364 2.307 10 10 CECE COc1ccc(N(C)[C@H](CN)C(F)(F)F)cc1OC 8737805 CYJYUYGIXVYIKY-LLVKDONJSA-N 278.274 2.030 10 10 CECE COc1nc(C(=O)c2cccc3c2NCC3)cs1 2045555003 AGHBDXIIUOUSPZ-UHFFFAOYSA-N 260.318 2.351 10 10 CECE 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CC(=O)c1cnc(Sc2nnc(O)n2C2CC2)s1 2041817352 IOCZANXCSARARB-UHFFFAOYSA-N 282.350 2.129 10 10 CECE COc1ccc(N(C)[C@@H]2CCCNCC2)c(F)c1 2044291723 KSZRMZDUGCBPDB-LLVKDONJSA-N 252.333 2.413 10 10 CECE CN(C)c1ccc([C@H](NN)C2(C(F)F)CC2)cc1 2044731191 SZYFOXJAWSLKKA-NSHDSACASA-N 255.312 2.302 10 10 CECE CC(C)COCC(=O)N1CCC(CN=[N+]=[N-])CC1 2046888294 DWMGCRUFJKBUOM-UHFFFAOYSA-N 254.334 2.208 10 10 CECE C[C@H](N)c1cc(F)c(N2[C@H](CO)[C@H]3CC[C@@H]2C3)c(F)c1 2194687917 IVGHSNIILYDNOA-HFAYUQKSSA-N 282.334 2.334 10 10 CECE C[C@@H](O)c1ccc(N2CC(C[S@@](C)=O)C2)c(Cl)c1 2047834359 VNEKFHNGYRWDLI-DYBLOJMWSA-N 287.812 2.208 10 10 CECE Nc1ccc(NC(=O)COC[C@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2191071576 WXIZCHJRIZEAJO-ZPVWCCJJSA-N 272.348 2.126 10 10 CECE Cc1ccc([C@@H](C)N2CCO[C@@H](CF)C2)c(O)c1 2052033332 KOVFKYQUEOZZSB-NEPJUHHUSA-N 253.317 2.432 10 10 CECE OC[C@@H](NCc1cc(F)ccc1O)c1cccs1 2055424999 MLZFQFAAHLHWSG-LLVKDONJSA-N 267.325 2.416 10 10 CECE C[C@@H](NC[C@@H]1OCCOC1(C)C)c1ccc(F)cc1O 2186948658 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C[C@H]1C[C@H](CCNCc2ccc(F)cc2O)CO1 2084175824 NRYCRQPCBQWSMN-QWRGUYRKSA-N 253.317 2.436 10 10 CECE CC[C@H](O)c1ccc(N2C[C@H]3C[C@H]2CN(C)C3)cc1 2104387943 JETAAJXROSDTEQ-RCBQFDQVSA-N 260.381 2.270 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H]2CNC[C@@H]2CC1 2104483398 DZHFNQVEVDYERF-OKILXGFUSA-N 260.381 2.132 10 10 CECE COc1cccc(O)c1CN[C@@H]1CO[C@@H](C(C)C)C1 2104434213 RWBZAELEGLGWKG-XHDPSFHLSA-N 265.353 2.304 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@H]4CCN[C@H]4C3)ccc2O1 2106389510 MJWAXSRYLPEJDR-JMSVASOKSA-N 258.365 2.198 10 10 CECE C[C@H](C[C@H](NN)c1ccc2c(c1)CCN2C)C(F)F 2106863379 GVPOBVRBZWZQMV-SKDRFNHKSA-N 269.339 2.475 10 10 CECE CCN(CC)c1ccc([C@]2(N)CCN(C)[C@@H]2C)cc1 2106833248 IHAUAOSFIMXLQG-CJNGLKHVSA-N 261.413 2.411 10 10 CECE CCN1CCc2cc([C@]3(O)CCC[C@@H]3CN)ccc21 2106804964 IBDWMUAODWFSGY-GDBMZVCRSA-N 260.381 2.015 10 10 CECE CCN(CC)c1ccc([C@]2(O)CNCC[C@@H]2C)cc1 2107376656 GZNUYCIPEBXCDS-BBRMVZONSA-N 262.397 2.350 10 10 CECE CCOC(=O)CCCN(CC)Cc1ccc(N)cc1 2088358880 JUBBRXOWRTYOOH-UHFFFAOYSA-N 264.369 2.434 10 10 CECE Nc1ccc(CN2CCC[C@]3(CO)CCC[C@@H]23)cc1 2108943533 BHNJCXMYOGEAAJ-CVEARBPZSA-N 260.381 2.396 10 10 CECE CO[C@@H]1C[C@@H](OC)CN([C@@H](C)c2ccccc2O)C1 2109150088 RCZOYSAEFBBIOL-YNEHKIRRSA-N 265.353 2.189 10 10 CECE NCc1ccc(N2C[C@@H]3CCC[C@H](O)[C@H]3C2)cc1Cl 2094537379 CKKJBCSLUCICGM-WHOFXGATSA-N 280.799 2.396 10 10 CECE CCc1cnn(CC)c1CNCc1ccccc1O 2094569061 QUNURIQLQOALMR-UHFFFAOYSA-N 259.353 2.461 10 10 CECE Cc1cc(CN)ccc1N1CC[C@H]([C@H]2CCOC2)C1 2096710303 CTQDFIZFIHHEAH-GJZGRUSLSA-N 260.381 2.317 10 10 CECE O=C(CN1C[C@H]2CC[C@H](C2)C1)c1ccc(O)c(O)c1 2096949999 GVBRQRXBHYXDRR-PHIMTYICSA-N 261.321 2.012 10 10 CECE CCC(CC)N1CC(NCc2cc(F)ccc2O)C1 2113005069 FNTYIQBQMOIRII-UHFFFAOYSA-N 266.360 2.494 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCOC[C@@H]2CCCCO2)C1 2113471924 DOYATYKUHCPEAQ-STQMWFEESA-N 268.361 2.204 10 10 CECE COc1ccc(CNC[C@@]2(O)CCCC2(C)C)c(O)c1 2201500964 JBHCBBZAMLKODA-INIZCTEOSA-N 279.380 2.432 10 10 CECE CN(c1ccc(CN)cc1F)C1(CO)CCCCC1 2113968374 FBXOKQDATGOBEF-UHFFFAOYSA-N 266.360 2.416 10 10 CECE CCNCc1ccc(N2CCOC[C@@H](C)C2)cc1OC 2204557238 NMLRQFOEOLAHSB-ZDUSSCGKSA-N 278.396 2.277 10 10 CECE CCCO[C@H]1C=CCN(c2ccc(CO)c(OC)c2)C1 2204559241 MPWCLKAUGGIIOW-HNNXBMFYSA-N 277.364 2.359 10 10 CECE COc1cc(N(C)CC2(N(C)C)CCC2)ccc1CN 2204546584 CEGPZUPSGROZEF-UHFFFAOYSA-N 277.412 2.074 10 10 CECE COc1cc(N2C[C@H](O)C[C@H]2C)ccc1CNC(C)C 2204555208 RQXJYCVQFCKUSV-IUODEOHRSA-N 278.396 2.153 10 10 CECE Cc1ccc(CN2CCCC[C@@H]3[C@H](C(=O)O)[C@H]32)c(O)c1 2204634712 CYBRGIJFPOAXLH-SNPRPXQTSA-N 275.348 2.386 10 10 CECE C[C@@H]1C[C@@H]2CC[C@H](C1)N2CC(=O)Nc1ccc(N)cc1 2205095733 IIIBELJEMBALTE-SHHSBJBSSA-N 273.380 2.470 10 10 CECE COc1ccc(N2C[C@H](CO)C[C@H]2C)c2c1CCC2 2269165914 AISHUCUCXQAEPB-VXGBXAGGSA-N 261.365 2.391 10 10 CECE CSc1ncc(CNC(=O)CC[C@@H]2CCCCN2)s1 2269194149 ALQYDJIBBNAAAB-JTQLQIEISA-N 299.465 2.404 10 10 CECE COc1cc(N(C)C[C@H]2CCCOCC2)ccc1CO 2206783429 BKGVYPBVCSNDQW-ZDUSSCGKSA-N 279.380 2.440 10 10 CECE CN[C@H](C)c1ccc(N2CCS[C@@H](CO)C2)cc1C 2269651537 MCZXOBMPPJCSFB-TZMCWYRMSA-N 280.437 2.190 10 10 CECE CCNCc1ccc(OC)c(CN(C)C2(C)COC2)c1 2208305929 KJSRKRXVWIIFOG-UHFFFAOYSA-N 278.396 2.025 10 10 CECE CC(C)Oc1ccc(N2C[C@H](F)[C@@H](CO)C2)cc1 2219590515 ULTBATVQOMRFKZ-RISCZKNCSA-N 253.317 2.240 10 10 CECE COc1ccc(N2CC[C@H](C)[C@@](C)(O)C2)cc1F 2219608718 OBMWJCZAZOAUGI-HZMBPMFUSA-N 253.317 2.432 10 10 CECE COc1ccc(N2C[C@@H](CO)CC2(C)C)c(F)c1 2219610967 WGICZNIWQNIRFD-JTQLQIEISA-N 253.317 2.432 10 10 CECE COc1ccc(N2CCC[C@@H](CF)C2)c(CN)c1 2220407973 DOZOQXSKZOGAQH-NSHDSACASA-N 252.333 2.340 10 10 CECE OCCCC1CN(c2ccc3c(c2)CCC[C@H]3O)C1 2230519007 IZKQLFWYJCCCSV-MRXNPFEDSA-N 261.365 2.265 10 10 CECE CC1(C)NC(=O)O[C@@H]1CNCc1cccc(Cl)c1O 2230849538 WBQSFGAYJDLRDQ-SNVBAGLBSA-N 284.743 2.022 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC[C@@H]2[C@H](CO)[C@@H]2C1 2232026842 FHNKAXTWZVMXLX-BEAPCOKYSA-N 260.381 2.079 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCN2CCC[C@@H]2C1 2232096093 MYTTYENBSQYGSM-DZGCQCFKSA-N 260.381 2.333 10 10 CECE COc1ccc(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])c(O)c1 2234168447 JJZHOLCISGAGTK-MNOVXSKESA-N 276.296 2.362 10 10 CECE CCOc1ccc(N2CCO[C@@H]3C[C@H](CO)C[C@H]32)cc1 2235091379 FBZCVOPNNJFZSI-DAXOMENPSA-N 277.364 2.061 10 10 CECE C[C@H](O)CN1CCN(c2ccc3c(c2)CCCC3)CC1 2235098766 KDWCWRLIFYMDIQ-AWEZNQCLSA-N 274.408 2.068 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)OCCCO3)[C@@H]1C1CC1 2235128857 HRLDZPNCCNEXKR-XJKSGUPXSA-N 275.348 2.198 10 10 CECE OC[C@@]12CCC[C@@H]1CN(c1ccc3c(c1)OCCO3)C2 2235100228 ZNAUUFCVPJASQI-WBMJQRKESA-N 275.348 2.057 10 10 CECE Cc1ccc(Sc2ncc(C(N)=O)s2)cc1C(=O)O 2225541266 VTZAJVMHEBXXCD-UHFFFAOYSA-N 294.357 2.400 10 10 CECE COc1ccc(N(C)[C@H](C)c2cnn(C)c2)c(CN)c1 2235958647 MBGXYRNLBPHOHW-LLVKDONJSA-N 274.368 2.085 10 10 CECE COc1ccc(N2C[C@@H](C)OCC(C)(C)C2)c(CO)c1 2235999665 LURVQJKHVJSERV-GFCCVEGCSA-N 279.380 2.439 10 10 CECE COc1ccc(N(C)CCc2ccncc2)c(CO)c1 2235998691 AOARAPJQAWSFQZ-UHFFFAOYSA-N 272.348 2.261 10 10 CECE CNCc1ccc(N2C[C@H](N(C)C)C(C)(C)C2)c(F)c1 2236271232 SYWYBNXBIICJGN-HNNXBMFYSA-N 279.403 2.322 10 10 CECE Nc1ccc(CCCNC[C@H]2COC3CC2C3)cc1 2226353391 GGYYMGYNGKVKOG-BBBYJDLNSA-N 260.381 2.216 10 10 CECE CN(C[C@H](F)C1CCC1)C(=O)c1cc(O)c(O)c(O)c1 2236427547 DAQWXVIRVDAQKI-JTQLQIEISA-N 283.299 2.014 10 10 CECE OCC[C@@H]1CCCCN1c1ccc2c(c1)OCCO2 2226765373 LFSZNUVRMORCNN-LBPRGKRZSA-N 263.337 2.199 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@@H](F)[C@@H](O)C3)cc1F 2226792771 LDJDGNYKJAXYAO-QVSJOPQTSA-N 269.291 2.274 10 10 CECE C[C@@]1(O)CCCN(c2ccc3c(c2)OCCCO3)C1 2226812497 YDLFIVWEGJSETK-OAHLLOKOSA-N 263.337 2.199 10 10 CECE COc1ccc(N(C)C2CCOCC2)c(C(=O)O)c1 2227677783 NOFQJRYIXHFQKD-UHFFFAOYSA-N 265.309 2.009 10 10 CECE COc1ccc(N2[C@H]3CCC[C@H]2COC3)c(C=O)c1 2227693722 ZYNVMGSFNZHYMJ-STQMWFEESA-N 261.321 2.265 10 10 CECE COc1ccc(N(C)CC[C@H]2CCOC2)c(CO)c1 2227673242 NPIVAZPJOKANAU-LBPRGKRZSA-N 265.353 2.050 10 10 CECE COc1ccc(N(C)C[C@H](F)C2CCOCC2)c(N)c1 2238326385 IONIVXGFXYSREA-ZDUSSCGKSA-N 282.359 2.478 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2COCCO2)c(C)c1 2240766268 ZNYYUEAZGIARSD-UKRRQHHQSA-N 278.396 2.127 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](OC)[C@H](OC)C2)c(C)c1 2240829621 JHNPCSKZFQXYOF-DAXOMENPSA-N 278.396 2.125 10 10 CECE CSc1ncc(CNCC2=CC[C@H](N)C2)s1 2243843678 FFEHWBKNIZVISA-VIFPVBQESA-N 255.412 2.002 10 10 CECE C[C@@H]1C[C@@H](CC(=O)O)CN1[C@H](C)c1c(O)cccc1O 2285691918 XGNPBSRLSIYINQ-MXWKQRLJSA-N 279.336 2.344 10 10 CECE CSc1ncc(CNC[C@@H]2C[C@@]23CC[C@H]3N)s1 2248744671 SZCKJIPVSGKVLN-XRNSZHNASA-N 269.439 2.082 10 10 CECE CSc1ncc(CNC[C@H]2NCCC[C@H]2C)s1 2248739578 CZQWGRDJOOYZJL-MWLCHTKSSA-N 271.455 2.343 10 10 CECE CCO[C@@]1(CSc2ncc([C@H](C)O)s2)CCOC1 2259001411 KSJLXFRGEDRAFA-CABZTGNLSA-N 289.422 2.484 10 10 CECE O=C(O)[C@@H]1C[C@@H]2[C@H]1CCN2Cc1ccc(Cl)cc1O 2270845751 YUWBZNPXCYHCEO-QJPTWQEYSA-N 281.739 2.341 10 10 CECE C[C@]1(CNCc2cc(F)cc(F)c2O)CCC[C@H]1O 2271288203 INQOPHJDMKGEAM-TZMCWYRMSA-N 271.307 2.311 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1c(N)cccc1F 2271359654 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C[C@@H]1C[C@H]2CCC[C@@H]2N1C(=O)COc1ccc(N)cc1 2280168928 RPLBUTQKHVVMLG-JMSVASOKSA-N 274.364 2.437 10 10 CECE O=c1c2c(ccn1C[C@@H]1CCC[C@@H]1C(F)F)CCNC2 2285618287 ZVXXTLMQGCNLEU-RYUDHWBXSA-N 282.334 2.175 10 10 CECE CN1CCCc2cc([C@H](N)[C@]34COC[C@H](C3)C4)ccc21 2288770177 NHJMPKLMAIJXDE-ZLIFDBKOSA-N 272.392 2.495 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)NCC(F)(F)C(F)F 2311673429 ZKMRKTBSVWVLIP-UHFFFAOYSA-N 293.216 2.128 10 10 CECE CCOc1nc(C(=O)N[C@@H](C)c2ccccc2O)co1 827969530 OMYBNJYRESHLEE-VIFPVBQESA-N 276.292 2.270 10 10 CECE CC1(C)CC[C@@](Sc2nccs2)(C(=O)O)CN1 2306961533 AQZPWKRJCGSCPX-NSHDSACASA-N 272.395 2.221 10 10 CECE CC(C)(C)[C@H]1NCC[C@@]1(Sc1nccs1)C(=O)O 2327016064 VSTDPCIFLRPYJX-PELKAZGASA-N 286.422 2.467 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c(F)c1 2330780712 VYYNFTHULYVRGR-ANGCBRKESA-N 264.344 2.066 10 10 CECE CCc1nnsc1CN[C@@H](C)c1c(O)cccc1O 2335730899 NKBIVKFLRVKWKE-QMMMGPOBSA-N 279.365 2.363 10 10 CECE C[C@H]1C[C@@H](C)[C@]1(O)[C@H](N)c1ccc2c(c1)CCN2C 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PTUUBENOZPXKRV-KBPBESRZSA-N 266.360 2.494 10 10 CECE Nc1ccc(OCCC(=O)NCC[C@@H]2CCCS2)cc1 715948636 AEVXGZNMAFIKHJ-AWEZNQCLSA-N 294.420 2.440 10 10 CECE CCN(Cc1cc2c(cc1O)OCO2)C1CCOCC1 716482627 SQXGNXXEXPQCFN-UHFFFAOYSA-N 279.336 2.122 10 10 CECE CCCNCc1ccc(N2C[C@H](O)C[C@@H]2C)cc1C 384824501 UNGIZAZHVPLZAY-XJKSGUPXSA-N 262.397 2.454 10 10 CECE c1cc2c(cc1CN[C@H]1C[C@H]3CCCN(C1)C3)CCO2 717154959 XWWCVHTYADJNMZ-ZBFHGGJFSA-N 272.392 2.195 10 10 CECE CC[C@H]1[C@H](CO)CCN1c1ccc(CNC)cc1C 385712946 RDSPVQIURRZKSM-GJZGRUSLSA-N 262.397 2.312 10 10 CECE CC(F)(F)CCCNS(=O)(=O)Cc1ccc(N)cc1 389689025 IGIABWOJLKPCTJ-UHFFFAOYSA-N 292.351 2.124 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)c(F)c1 2178167996 HSGKMBAOKZESFM-DUUOMRMWSA-N 278.371 2.456 10 10 CECE CO[C@@H]1[C@H]2C[C@@H]3CN(c4ccc(CN)cc4C)[C@@H]1[C@H]3C2 394302205 OJDLTRUWAYWORY-IUKJFTNHSA-N 272.392 2.313 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4OC)cc1 394305048 UADWCHKEPYPZNB-HNWLLIRGSA-N 272.392 2.266 10 10 CECE Nc1ccc(O)c(CN2CCC(N3CCCC3)CC2)c1 395250185 LBTHWQGSSKYZLJ-UHFFFAOYSA-N 275.396 2.035 10 10 CECE Nc1ccc(CCCn2cnc(C3CC3)cc2=O)cc1 395802211 FNLSTNDGHAKYLW-UHFFFAOYSA-N 269.348 2.336 10 10 CECE C[C@H](N[C@H]1COC(C)(C)C1)c1ccc(O)cc1O 396552221 SMJNDKVVIOUZOI-VHSXEESVSA-N 251.326 2.316 10 10 CECE CCN(C(=O)c1ccc(C)nn1)c1ccc(N)cc1 396906742 KWXPFCWLHMXZAU-UHFFFAOYSA-N 256.309 2.034 10 10 CECE CN[C@@H](c1ccccc1O)[C@](C)(O)c1cccc(C)n1 2178428953 NXHAIHBXPWSHKN-JKSUJKDBSA-N 272.348 2.264 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H](N)C3CC=CC3)ccc21 2174013921 OSSAZXHGVMZUFF-IAGOWNOFSA-N 272.392 2.396 10 10 CECE C[C@@H](CC1CN([C@@H](C)c2c(O)cccc2O)C1)C(=O)O 2178487670 ZRFNPLDEMMBXKM-UWVGGRQHSA-N 279.336 2.201 10 10 CECE Cc1ccc([C@H](C)N[C@H]2CCCC[C@H]2C(N)=O)c(O)c1 2174107773 RGEQPAJDXZFMCF-YUTCNCBUSA-N 276.380 2.395 10 10 CECE C[C@@H]1CCc2nc(C(=O)Nc3ccc(O)c(O)c3)cn2C1 2063461942 ZRQSJJANWMIPRQ-SECBINFHSA-N 287.319 2.129 10 10 CECE O=C(Cc1cc(C2CC2)no1)Nc1ccc(O)c(O)c1 2064535342 KIYIEGKVHDXKQX-UHFFFAOYSA-N 274.276 2.144 10 10 CECE CCNCc1ccc(N(C)CC2[C@@H]3COC[C@@H]23)c(C)c1 2174637709 AIHVTJNAXSMYBI-HOTGVXAUSA-N 274.408 2.433 10 10 CECE CN(C)C1C[C@@H]2CC[C@H](C1)N2c1ccc(CO)cc1F 2174938264 DTLYJUWCVMFRIQ-PBWFPOADSA-N 278.371 2.379 10 10 CECE CN(C)Cc1cnn(Cc2c(O)cccc2Cl)c1 2069891651 AMFSALZMSFFNNS-UHFFFAOYSA-N 265.744 2.352 10 10 CECE CC[C@H](O)c1ccc(N2CCn3ncc(O)c3C2)cc1 2168337045 AIJYQAZRGYXOAV-AWEZNQCLSA-N 273.336 2.052 10 10 CECE CN(C(=O)[C@@H]1CNc2ccccc2N1)[C@@H]1CCC[C@@H]1F 2175596169 KOMOIOLNKJHISF-LEWSCRJBSA-N 277.343 2.242 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3[C@H]4C[C@H](N)C[C@H]43)ccc21 2169195103 QGYYHQKJZKPBLP-CTTHAOKLSA-N 272.392 2.086 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1ccc(F)c(O)c1 2169750864 XLVXSPDNORYHME-UHFFFAOYSA-N 274.295 2.386 10 10 CECE Cc1nc(CN(C)CCCOc2ccc(N)cc2)co1 2169886614 LLWXGHQIZIWMMH-UHFFFAOYSA-N 275.352 2.466 10 10 CECE COCCN(C(=O)Nc1ccc(N)cc1)[C@H]1CCSC1 2170150008 FCYWARSQXMBXIN-ZDUSSCGKSA-N 295.408 2.255 10 10 CECE NCc1ccc(N2CC[C@@H]3C[C@]3(O)C2)cc1C(F)(F)F 2171004756 KVZIDAJRNYOXIF-MFKMUULPSA-N 286.297 2.125 10 10 CECE C[C@H](NC(=O)C1CC2(CCOC2)C1)c1ccccc1O 2192610817 GKCJMRFPYPZOIH-FZWSLVFFSA-N 275.348 2.386 10 10 CECE COc1ccc(CN[C@H]2C[C@H](c3ncc[nH]3)C2)c(O)c1 2181599723 UGLIIMBGLUINKW-HAQNSBGRSA-N 273.336 2.160 10 10 CECE COC[C@H]1C=CCCN1CCCOc1ccc(N)cc1 2182347839 SRPDAUACXLIMSH-OAHLLOKOSA-N 276.380 2.315 10 10 CECE NCc1ccc(N2CCC=C[C@@H]2CO)c2ccccc12 2182329960 FCAQPSBFLLMEMK-CQSZACIVSA-N 268.360 2.426 10 10 CECE COc1nccc(C)c1CNCc1ccc(O)c(O)c1 2183309245 ZVFXKVDJMPTGBL-UHFFFAOYSA-N 274.320 2.100 10 10 CECE CC[C@H](O)c1ccc(N2CCCNC(=O)C2(C)C)cc1 2193695061 BYNRNDUSOMVERR-AWEZNQCLSA-N 276.380 2.235 10 10 CECE COC[C@@H]1C[C@@H]1CN1CCOc2cc(N(C)C)ccc21 2190088123 BDJADAUOOONTCF-OLZOCXBDSA-N 276.380 2.234 10 10 CECE OC[C@]1(F)CCCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2184686939 MHCHSBGRCWXPRJ-HOTGVXAUSA-N 279.355 2.357 10 10 CECE CN(CC1[C@@H]2COC[C@@H]12)c1ccc2c(c1)CCC[C@@H]2N 2184680783 WLMFFNMCNPCXRR-ULQDDVLXSA-N 272.392 2.351 10 10 CECE Cc1cnn(C)c1CN(C)c1ccc2c(c1)CC[C@H]2N 2184729356 IJIICEBBNBGJNR-OAHLLOKOSA-N 270.380 2.311 10 10 CECE CN[C@H]1CCc2cc(N3Cc4cnn(C)c4C3)ccc21 2184723098 IQAAZPUIJWCXNU-HNNXBMFYSA-N 268.364 2.147 10 10 CECE CO[C@@H]1C[C@@H](CNCc2ccc(O)c(O)c2)C12CCC2 2190403041 JUHHNOBVKYBBTD-SWLSCSKDSA-N 277.364 2.393 10 10 CECE CN1CCc2cc([C@@H](O)C34CCC(N)(CC3)C4)ccc21 2184985349 JUEHZDOMNSPEJB-KLAILNCOSA-N 272.392 2.374 10 10 CECE C[C@H](NCC(F)(F)[C@H]1CCOC1)c1c(O)cccc1O 2185209837 KKUNYIYDJDFVBA-UWVGGRQHSA-N 287.306 2.420 10 10 CECE CN(c1ccc(CN)cc1F)[C@H]1CO[C@@H](C(F)(F)F)C1 2185535928 DGLNPURXAISRFO-BXKDBHETSA-N 292.276 2.440 10 10 CECE NCc1ccc(N2C[C@@H]3CC[C@H](C2)C3O)c(Cl)c1 2048832162 KBWQQNIUXXUNDU-BVUQATHDSA-N 266.772 2.006 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@@]3(C)C[C@]3(CO)C2)c(F)c1 2194695392 UACLLFPSNDTRGH-DFKRKDTASA-N 282.334 2.193 10 10 CECE COC[C@@]12C[C@H]1CN(c1c(F)cc([C@H](C)N)cc1F)C2 2194709971 PHWCZSWYPUBLIZ-ZSGNIPIJSA-N 282.334 2.457 10 10 CECE C[C@@H](N)c1cc(F)c(N2Cc3cnn(C)c3C2)c(F)c1 2194705004 SUXXHPFEQBSDJG-MRVPVSSYSA-N 278.306 2.238 10 10 CECE CCOC(=O)CCCCNCc1ccccc1O 2058286859 BXUZSFRNVJDOKQ-UHFFFAOYSA-N 251.326 2.215 10 10 CECE CCc1cccc(CNC[C@H]2OCC[C@H]2F)c1O 2058663030 HZMYGTLLVDTWAO-CHWSQXEVSA-N 253.317 2.171 10 10 CECE COc1ccc(N2CCOCCC2(C)C)c(N)c1 2062049833 YGMRLYBZMXSJAT-UHFFFAOYSA-N 250.342 2.283 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@@H]2C2(O)CC2)cc1O 2187045319 USZWMCMDEZCMEG-XHDPSFHLSA-N 277.364 2.329 10 10 CECE NCc1ccc(N2C[C@H]3CC(O)C[C@@H]3C2)cc1Cl 2065486270 YZTMUSZLLSDJTG-GHMZBOCLSA-N 266.772 2.006 10 10 CECE CO[C@@H]1CC[C@@H]1CCNCc1c(O)cccc1F 2066809400 BGIGWSIRLIDPEW-QMTHXVAHSA-N 253.317 2.436 10 10 CECE C[C@@H]1CCN(CCCOc2ccc(N)cc2)C[C@]1(C)O 2192180858 LIQDHJNXBOLDHF-CJNGLKHVSA-N 278.396 2.131 10 10 CECE CCCN1C[C@H]2C[C@H]1CN2c1ccc2c(c1)CC[C@H]2O 2187613266 TZSMWWVYPPXAHU-ZMSDIMECSA-N 272.392 2.339 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1CCCS1 2071429478 MAUYELNAGGOUBM-UWVGGRQHSA-N 272.374 2.104 10 10 CECE C[C@@H]1CC[C@@](C)(NCc2ccc(O)c(O)c2O)C1 2073010227 YFKUMTWZDFLFAE-YMTOWFKASA-N 251.326 2.472 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H]3CCNC3(C)C)ccc21 2198667776 OHXVRICWTFUKMQ-GDBMZVCRSA-N 273.424 2.457 10 10 CECE COC(=O)[C@@H]1CC[C@H](CN(C)Cc2ccccc2O)C1 2192592976 VIFRPFBTBXGUAV-QWHCGFSZSA-N 277.364 2.413 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C[C@H]2C[C@]23CCCOC3)C1 2077712111 WJTAQYJBDKSSJR-XQQFMLRXSA-N 250.346 2.435 10 10 CECE CCN(C(=O)C[C@H]1CO[C@H](C)C1)c1ccc(N)cc1 2103196656 SQWXXEMIMCEDJA-NEPJUHHUSA-N 262.353 2.437 10 10 CECE Cc1cc(N2CCC[C@@]3(C)COC[C@@H]23)ccc1CN 2103594464 KANPVDWNPKAJLL-CVEARBPZSA-N 260.381 2.459 10 10 CECE CN1CCc2cc([C@H](O)[C@@H](N)CC(C)(F)F)ccc21 2106796488 RCTFGQLPCPMPCK-AAEUAGOBSA-N 270.323 2.085 10 10 CECE CC[C@H](CCN)[C@@H](O)c1ccc2c(c1)CCN2CC 2106804741 FLTLNXHRJZOYJY-MLGOLLRUSA-N 262.397 2.477 10 10 CECE CCN1CCc2cc(N3CCC[C@@](C)(N)C3)ccc21 2106804738 FLGHEAQTKGNGQC-MRXNPFEDSA-N 259.397 2.387 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@@H]1CCCCN1 2106831904 VFAWSHWULMCOEO-HOTGVXAUSA-N 260.381 2.462 10 10 CECE CN1CCc2cc([C@H](N)COCC(F)(F)F)ccc21 2106801766 PTBBGZULKNCMPU-LLVKDONJSA-N 274.286 2.258 10 10 CECE COCc1ocnc1CN(C)Cc1ccc(N)cc1 2107286421 YJSCCUGSQFXISZ-UHFFFAOYSA-N 261.325 2.035 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]3CC)ccc21 2088659439 KWFCYAGIFKDWBZ-HZMBPMFUSA-N 259.353 2.278 10 10 CECE Cc1cccc(N)c1N[C@H](C)[C@@H]1CCCS(=O)(=O)C1 2089890273 HRKBVAZGNRAOTB-VXGBXAGGSA-N 282.409 2.202 10 10 CECE CNCCC[C@@H](C)N(C)[C@@H](C)c1ccc(O)cc1O 2111823650 YFDQIBGWTLOZCY-NEPJUHHUSA-N 266.385 2.479 10 10 CECE CN[C@H]([C@H](O)c1ccc2c(c1)CCN2C)C(C)(C)C 2092187222 DPUVRWURDLCXCC-HUUCEWRRSA-N 262.397 2.346 10 10 CECE COc1ccc(N2CCCC[C@@]23CCOC3)c(N)c1 2093606308 OIPMJVGGTZCBHV-HNNXBMFYSA-N 262.353 2.427 10 10 CECE Nc1cc2c(cc1N1CC(C(F)(F)F)C1)OCCO2 2095975747 ONLHJONXNOZFNM-UHFFFAOYSA-N 274.242 2.039 10 10 CECE CN1CCCc2cc([C@H](N)C[C@H]3CCOC3)ccc21 2098415432 WUTHLQSMYSXGGX-IUODEOHRSA-N 260.381 2.495 10 10 CECE CN(Cc1cccc(F)c1O)C[C@]1(C)CCCN1C 2098742066 OGCYSSDBJNQSKW-HNNXBMFYSA-N 266.360 2.447 10 10 CECE CC1(C)CCCN(Cc2ccc(O)c(O)c2)[C@@H]1C(=O)O 2201039658 ZXOMLHBYMYBZST-CYBMUJFWSA-N 279.336 2.173 10 10 CECE COCc1cc(CN(C)Cc2ccc(N)cc2)on1 2112639060 OIBLTHRGVMYQAW-UHFFFAOYSA-N 261.325 2.035 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](O)CC23CC3)cc1 2113569035 DLLFQCVPTFPLLP-SWLSCSKDSA-N 260.381 2.461 10 10 CECE CN[C@H]1CCCc2cc(N3C[C@@H]4C[C@@]4(CO)C3)ccc21 2200841200 DWBLTKRCCBEFFN-JQFCIGGWSA-N 272.392 2.102 10 10 CECE CCOC(=O)C(F)(F)CCN1CCC[C@H](N=[N+]=[N-])C1 2121978243 FVFDQCSQEKJYQF-VIFPVBQESA-N 276.287 2.350 10 10 CECE CC[C@H](O)[C@H]1CCCCN1c1ccc(CO)c(OC)c1 2204545766 SYURYGLDSGJMMV-CABCVRRESA-N 279.380 2.317 10 10 CECE COc1cc(N(C)[C@@H]2CCOCC[C@@H]2C)ccc1CN 2204543032 IFYNOJKGYURQLE-SWLSCSKDSA-N 278.396 2.405 10 10 CECE COCCNCc1ccc(N2CCC[C@@H]2C)cc1OC 2204542780 FJZOPGLQHVDYHL-ZDUSSCGKSA-N 278.396 2.420 10 10 CECE O[C@H]1C[C@H]2CC[C@H]1[C@H](NCc1ccc3c(c1)CCO3)C2 2204616247 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2223923678 ZSCZIDIGZDYXLB-CYBMUJFWSA-N 250.386 2.484 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[S@](=O)[C@H](C)C1 2223982904 HWQKDEYXRCJKIL-SOZUMNATSA-N 267.394 2.006 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@H]2CCC[C@@H](C(=O)O)C2)CC1 2234171446 LXTBRWAQDBFXNW-VHSXEESVSA-N 280.328 2.179 10 10 CECE CCNCc1cc(OC)ccc1N(C)C[C@@H](O)C(C)C 2235964031 VFUITCGYWFNNJM-MRXNPFEDSA-N 280.412 2.258 10 10 CECE CC[C@@H](N)Cc1cc(OC)ccc1N(C)CCCOC 2235970496 QJSMRQIBHDFPDR-CQSZACIVSA-N 280.412 2.448 10 10 CECE COc1ccc(N2CCC[C@H]2c2nncs2)c(CO)c1 2235960166 BEFPNDMYYBVUEQ-ZDUSSCGKSA-N 291.376 2.381 10 10 CECE COc1ccc(N2CC[C@H]2[C@@H](C)O)c(CNC(C)C)c1 2235962178 FSFOJRGICWRKAW-DOMZBBRYSA-N 278.396 2.153 10 10 CECE O[C@@H]1CCCN(c2ccc3c(c2)OC(F)(F)O3)CC1 2226699369 GMWFQKAYQSCILI-SNVBAGLBSA-N 271.263 2.359 10 10 CECE CCCOc1ccc(N2C[C@@H](OC)C[C@H]2CO)cc1 2226765395 LIVYYRQRHABXOI-ZFWWWQNUSA-N 265.353 2.061 10 10 CECE C[C@H]1Cc2cc(N3CC4(CC(CO)C4)C3)ccc2O1 2226701639 VUCVQFUPWIVBTD-NSHDSACASA-N 259.349 2.219 10 10 CECE 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10 10 CECE Cc1cc(N2CCN(C)C3(CC3)C2)ccc1[C@H](C)N 2269669206 KBXPYYMUXWIEBE-ZDUSSCGKSA-N 259.397 2.299 10 10 CECE CS[C@H]1CN(c2ccc([C@H](C)N)c(C)c2)C[C@H]1N(C)C 2285121145 KIRSKZXDAGVKQX-MAZHCROVSA-N 293.480 2.497 10 10 CECE Cc1cc(N2CC[C@@H]3OCCO[C@@H]3C2)ccc1[C@@H](C)O 2285167312 AFPMMSIBAVYKMX-UHOFOFEASA-N 277.364 2.042 10 10 CECE Cc1cc(N2CCO[C@@H]3COCC[C@H]32)ccc1[C@@H](C)O 2285159560 FQODSMSGBMJETF-DAXOMENPSA-N 277.364 2.042 10 10 CECE CN(CCc1ccc(N)cc1)[C@H](CO)c1ccccc1 2296482526 PUKGDGSCRRDGAO-QGZVFWFLSA-N 270.376 2.477 10 10 CECE COc1cc(OC)c(N2CCC[C@@H](O)CC2)c(OC)c1 2287067342 GAYMPYFRYDZNLN-LLVKDONJSA-N 281.352 2.064 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1cc(OC)c(OC)c(OC)c1 2288884619 CSMVPUWQLZCQQC-NEPJUHHUSA-N 281.352 2.062 10 10 CECE C[C@@H](CN(C)C)N(C)Cc1cc(Cl)ccc1O 2306892168 NAKWQHWWUMTTQJ-JTQLQIEISA-N 256.777 2.428 10 10 CECE CCN[C@@H]1C[C@@H](OC)[C@@H](OC)[C@H]1Sc1nccs1 2309537633 VLQZMOIKPLCDJM-DBIOUOCHSA-N 288.438 2.016 10 10 CECE NCC12CC(CCN1Cc1c(O)cccc1Cl)C2 2318137681 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2.304 10 10 CECE Oc1cc(Br)cc(C[C@@H]2CCCNC2)c1O 219033050 QWFSJPUTBVCZJT-QMMMGPOBSA-N 286.169 2.402 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(Cl)nc1 1291738882 PTRQRLRKVZJQGZ-UHFFFAOYSA-N 292.722 2.005 10 10 CECE C[C@H](N)c1ccc(N2CC3(C2)CC3(F)F)cc1O 1914967829 DJFVXCLMBSXQLK-QMMMGPOBSA-N 254.280 2.257 10 10 CECE Cc1cnc([C@H](C)NC(=O)c2c(F)ccc(O)c2O)s1 1457697493 UPNCIWOFJCLPHT-ZETCQYMHSA-N 296.323 2.493 10 10 CECE OCc1ccc(N2CC[C@]23CCOC3)cc1Cl 1915336622 ZTAHCHRFMBCBEM-CYBMUJFWSA-N 253.729 2.202 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@H]1C[C@@H]1C1CCCC1 2135670356 MBTWYTZSCIKDMW-GRYCIOLGSA-N 266.345 2.254 10 10 CECE C[C@H](N)CCN(C)c1ccc2c(c1)OCCCO2 258741807 LCCJJSLGZBUNDZ-NSHDSACASA-N 250.342 2.021 10 10 CECE CCC1CC(CN(C)S(=O)(=O)Cc2ccc(N)cc2)C1 1921254674 HUDSUEFMUOTDCJ-UHFFFAOYSA-N 296.436 2.467 10 10 CECE CN(C)[C@@H]1CCC[C@H]1N[C@H]1CCc2cccc(O)c21 1922044436 ONDAPJIBHXFEAX-HZSPNIEDSA-N 260.381 2.452 10 10 CECE C/C(=C\c1ccco1)C(=O)NCCc1ccc(O)c(O)c1 1622753014 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2139758975 GCJNRIWUHGRFIC-OAHLLOKOSA-N 263.337 2.134 10 10 CECE CNCCN(Cc1ccc(C)cc1O)CC(F)(F)F 2139756757 ZACRCFHRESISDY-UHFFFAOYSA-N 276.302 2.284 10 10 CECE CNCC[C@H]1CCCCN1Cc1ccc(F)cc1O 2139755468 DRFFCKLJQJYVJX-CQSZACIVSA-N 266.360 2.495 10 10 CECE COc1cc(F)c(N(C)CCNC2CC2)cc1F 258932618 POJOSLZEIKOTEQ-UHFFFAOYSA-N 256.296 2.162 10 10 CECE NC(=S)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 33508093 GLABRHLMYRPACB-UHFFFAOYSA-N 282.324 2.118 10 10 CECE CC1=C(C)CN([C@H](C)C(=O)Nc2ccc(N)cc2)C1 2140696963 VAANTRGJNJIHNZ-GFCCVEGCSA-N 259.353 2.248 10 10 CECE N[C@@H]1CC[C@@H]2CN(c3ccc4c(c3)CCO4)C[C@@H]2C1 2141240946 FTZBBGMNFVCGIL-HZSPNIEDSA-N 258.365 2.185 10 10 CECE CCN(C(=O)c1ccc(O)c(O)c1)c1cccc(O)c1 233459194 XJHDFZSKUCCGRZ-UHFFFAOYSA-N 273.288 2.470 10 10 CECE CC[C@@H](N)CCCC(=O)N(C)Cc1ccccc1O 2141090656 KLCVWMCVNRKUGS-CYBMUJFWSA-N 264.369 2.258 10 10 CECE CC[C@H]1CN[C@H](CC)CN1Cc1cc(F)ccc1O 233956616 YDDIDCVIRQZQLP-KGLIPLIRSA-N 266.360 2.494 10 10 CECE CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(N)cc1 234048533 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CN(Cc1cccc(F)c1O)[C@@H]1CCN2CC[C@H]1C2 1877839231 JEYILFSEXFRUJJ-SMDDNHRTSA-N 264.344 2.057 10 10 CECE CN1[C@H]2CC[C@@H]1CN(c1ccc(C=CC(=O)O)cc1)C2 2143549803 JKXHMWHGJLGADT-GASCZTMLSA-N 272.348 2.067 10 10 CECE C[C@H](O)c1cc(F)c(N(C)C[C@H]2CCOC2)c(F)c1 1880483042 UUJYUGZTEZZEES-VHSXEESVSA-N 271.307 2.491 10 10 CECE C[C@H](N)c1cc(F)c(N(C)C[C@H]2C[C@@H](O)C2)c(F)c1 1880923152 DZQZFTCQBYNBHT-ATZCPNFKSA-N 270.323 2.192 10 10 CECE Oc1cccc(F)c1CNCc1cnn(CC(F)F)c1 896637205 IUYVHZXVRYWEKT-UHFFFAOYSA-N 285.269 2.283 10 10 CECE CCn1cc(CNCc2c(O)cccc2F)c(C)n1 896636719 BAPXXDABYCFQPE-UHFFFAOYSA-N 263.316 2.346 10 10 CECE COC1(OC)CC(CNCc2cccc(F)c2O)C1 1184398616 KMQJIEQRDFHGQD-UHFFFAOYSA-N 269.316 2.020 10 10 CECE CC(C)CS(=O)(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1949748090 AMWMQZOHPNGCOU-SNVBAGLBSA-N 260.363 2.137 10 10 CECE CC(C)C[C@H](CNCc1ccc(O)cc1O)N(C)C 20201269 CFEWJLRNIHHQDE-CYBMUJFWSA-N 266.385 2.164 10 10 CECE COc1cccc(O)c1CNC[C@@H](CO)C(C)(C)C 1967698330 AWTILPXAIPWLFX-NSHDSACASA-N 267.369 2.145 10 10 CECE CCc1cccc(CN[C@@H](CO)[C@H](C)CC)c1O 1970425553 GFVICTGCRHOSFT-RISCZKNCSA-N 251.370 2.451 10 10 CECE C[C@H](N[C@H]1CCO[C@]12CCOC2)c1ccc(F)cc1O 2144692110 UUYMKKWUCSFEIS-LKTVYLICSA-N 281.327 2.130 10 10 CECE C[C@H]1CN(C)CC[C@H]1NCc1ccc2c(c1)CCO2 252895787 ZXHNLLDCNGRJRB-SWLSCSKDSA-N 260.381 2.051 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@H]3C[C@@H]32)c(Cl)c1 2004410662 ATKFTIPUPMWKKO-JCOFBHIZSA-N 252.745 2.337 10 10 CECE CC[C@H](c1ccccc1O)N1CC[C@@H]2CC(=O)N[C@@H]2C1 2145060929 VTDMCGXSXBPKPI-MRVWCRGKSA-N 274.364 2.054 10 10 CECE CC(C)(C)n1nccc1[C@H](O)[C@@H](N)c1ccccc1O 2149842145 JWXWFNMYEFUOTJ-KBPBESRZSA-N 275.352 2.077 10 10 CECE C[C@@H]1CCC[C@@H]1CS(=O)(=O)NCCc1ccc(N)cc1 2149977432 UMKPVOQDRWUEHP-TZMCWYRMSA-N 296.436 2.167 10 10 CECE CCOc1cccc(CNCCc2cnoc2C)c1O 2146001081 GGFBJQPYWQUVCO-UHFFFAOYSA-N 276.336 2.420 10 10 CECE CCOC(=O)C[C@@H](N)c1ccc(N2CCCC2)c(F)c1 260186657 HYMTVBRNUJUWFE-CYBMUJFWSA-N 280.343 2.379 10 10 CECE Nc1cccc(Br)c1N[C@H]1C[C@H]2CN[C@H]1C2 1989344245 GGMJDCOOJAAHME-SWPVVBRQSA-N 282.185 2.194 10 10 CECE CO[C@H](CN[C@H](C)c1ccccc1O)[C@H]1CCCOC1 2150212870 BMEJBASDHXYTIG-DVOMOZLQSA-N 279.380 2.484 10 10 CECE C[C@@H](CN[C@H](C)c1cc(O)ccc1O)c1ccn(C)n1 2147080406 OVYCCIKWKKDWPU-WDEREUQCSA-N 275.352 2.286 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)N)c(Cl)c2)[C@@H]2COC[C@@H]12 2158354027 QEWQELWBIODKCN-ZEQHWRKHSA-N 296.798 2.210 10 10 CECE Nc1ccc(OCC(=O)NCCC2CCCC2)cc1 40305793 BATZTJKEYHZDKY-UHFFFAOYSA-N 262.353 2.344 10 10 CECE c1cc2c(cc1N1CC[C@H]3OCCO[C@@H]3C1)CCCN2 2151739663 RDCQMABBNDUWMQ-HZPDHXFCSA-N 274.364 2.039 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3OCCO[C@@H]3C2)c(Cl)c1 2151736378 GPCZQXILRRCJMO-COLVAYQJSA-N 296.798 2.354 10 10 CECE CN(C[C@@H]1CCCCCO1)C(=O)c1cccc(O)c1O 2152631683 KJBKVGJCJPEORZ-NSHDSACASA-N 279.336 2.129 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2C[C@H](O)C2(C)C)c(O)c1 2154214275 LGVSBCAIKMRBMO-PGUXBMHVSA-N 279.380 2.458 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CC[C@@H]1N 49707962 ONGDUDJWMPRRAD-SCZZXKLOSA-N 270.279 2.182 10 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COc1ccc(O)c(CN2CCC[C@@]3(CCOC3)C2)c1 825133468 GQFYFBWBLVXCDF-MRXNPFEDSA-N 277.364 2.403 10 10 CECE Cc1cnc(CCN(C)C(=O)Cc2ccc(N)cc2)s1 831451949 GFOOLSQKEGZVGJ-UHFFFAOYSA-N 289.404 2.277 10 10 CECE Nc1cc(O)ccc1NS(=O)(=O)c1ccc(Cl)cc1 236349142 NGNSZTOGJRAOAU-UHFFFAOYSA-N 298.751 2.429 10 10 CECE C[C@@H]1CN(C)CCN1c1ccc(CN)c2ccccc12 235306857 NHTWGFXOYPDWFI-CYBMUJFWSA-N 269.392 2.439 10 10 CECE NC1CCC(NCc2ccc(Cl)cc2O)CC1 1942494858 QKZJZCQEJNBSAT-UHFFFAOYSA-N 254.761 2.405 10 10 CECE C[C@]12CC[C@H]1CN(C(=O)CCc1ccc(N)cc1)C2 2143198795 YODCKSJPRXKXOL-XJKSGUPXSA-N 258.365 2.460 10 10 CECE Nc1ccc(NC(=O)O[C@@H]2[C@@H]3[C@H]4C[C@@H]5[C@H]([C@H]43)[C@@H]52)cc1 2143304738 PESYBFDZFRTYBO-MFVQWFCYSA-N 256.305 2.328 10 10 CECE CN(c1ccc(CN)cc1F)[C@@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]([C@H]23)[C@@H]41 2143312062 NWNBCQDKWYVWFW-ZHBACIFWSA-N 258.340 2.231 10 10 CECE Oc1ccc(-c2nc(Cc3cccnc3)no2)cc1O 236572093 ZWOCJTSCRRKIPH-UHFFFAOYSA-N 269.260 2.134 10 10 CECE COC1(OC)CC(CNCc2c(C)cccc2O)C1 1963414588 HXJJIZNTCACKOY-UHFFFAOYSA-N 265.353 2.189 10 10 CECE CC[C@@]1(C)CCN(C(=O)Nc2ccc(N)cc2)C1=O 1876165453 NQHRMKGNIRZSBB-AWEZNQCLSA-N 261.325 2.449 10 10 CECE Nc1ccc(CNc2ccc(N)c(C(=O)O)c2)cc1 1876475723 PEHBRGPRMYMOCU-UHFFFAOYSA-N 257.293 2.161 10 10 CECE Oc1c(Br)cccc1CNCc1ccnnc1 1946499913 LJGBWFNKOMUTIW-UHFFFAOYSA-N 294.152 2.235 10 10 CECE C[C@@H](N)c1cccnc1N(C)Cc1ccccc1O 1877524552 RXWUSWBPFKOTTA-LLVKDONJSA-N 257.337 2.443 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC[C@@H](C(=O)N(C)C)C2)c1 2143695815 WFONRNLHEWTTTH-QWHCGFSZSA-N 276.380 2.172 10 10 CECE C[C@H](N)c1cc(F)c(N(C)[C@@H]2CCN(C)C2)c(F)c1 1880927312 LRVXXEFSXLBMAJ-GXSJLCMTSA-N 269.339 2.125 10 10 CECE CN1CC[C@@H](CCNCc2ccc(Cl)cc2O)C1=O 1880960312 IYSJOQVPVFABHX-SNVBAGLBSA-N 282.771 2.004 10 10 CECE CO[C@H]1CN(c2c(F)cc([C@H](C)N)cc2F)C[C@@H]1F 1880930753 FAWGYNLMXJHOBT-QILRFPOHSA-N 274.286 2.158 10 10 CECE CN(C)c1ccc([C@@H](N)[C@H](O)c2ccccc2)cc1 1962724225 LYBGFIOBHLKCJT-HZPDHXFCSA-N 256.349 2.486 10 10 CECE CC[C@H](N[C@@H]1CCO[C@]12CCOC2)c1ccccc1O 2144688520 BQKWNOBITYZAGS-IMJJTQAJSA-N 277.364 2.381 10 10 CECE CCn1ccnc1Sc1ncc(C[C@H](C)N)s1 1949620216 PEOLSZFZDHBKRE-QMMMGPOBSA-N 268.411 2.400 10 10 CECE CCn1ccnc1Sc1ncc(C[C@@H](C)N)s1 1949620215 PEOLSZFZDHBKRE-MRVPVSSYSA-N 268.411 2.400 10 10 CECE CCNCc1ccc(N2C[C@H]3CCCN3C[C@H]2C)cc1 250161186 GHDCSYSKCKPUFJ-RHSMWYFYSA-N 273.424 2.469 10 10 CECE Nc1ccc(OCc2cn(C[C@H]3CC3(F)F)nn2)cc1 1964702670 SWNCHJPJNPGULJ-SECBINFHSA-N 280.278 2.095 10 10 CECE CC1(C)CCN(c2ccc(CN)c(F)c2F)C[C@@H]1CO 2148680962 GPVZHOKDTLOLLI-LLVKDONJSA-N 284.350 2.268 10 10 CECE CN(CCS[C@H]1CCOC1)Cc1ccccc1O 1966158137 JFLGRKIGROIMEM-ZDUSSCGKSA-N 267.394 2.346 10 10 CECE COc1ccc(O)c([C@H](C)N(C)[C@H]2CCCNC2)c1 251227714 AHHHYTUSECEYPG-RYUDHWBXSA-N 264.369 2.146 10 10 CECE COC[C@H](CCNC(=O)Cc1ccc(N)cc1)C(C)C 1967151131 KKHMYLZUKMVXSL-AWEZNQCLSA-N 278.396 2.236 10 10 CECE C[C@]1(CNCc2ccc3c(c2)CCCO3)CCCN1 1967980771 AIJHBRDKVXGHFV-MRXNPFEDSA-N 260.381 2.243 10 10 CECE CC[C@@H](C)N(CC)c1ccc2c(c1)N(C)C(=O)[C@H]2N 251849822 MVZHCCWGYFEDPE-YGRLFVJLSA-N 261.369 2.288 10 10 CECE CCn1nccc1Cn1ccc2ccc(CCN)cc21 2150677133 QYLAINYFPSQQHX-UHFFFAOYSA-N 268.364 2.407 10 10 CECE C[C@@]1(C(F)F)C[C@@H]1C(=O)NCc1ccccc1O 1969154487 NMHSATRVIWZEPJ-NOZJJQNGSA-N 255.264 2.300 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@@H]2CNC[C@H]2[C@H]1C 252552457 CYAFKOSTEUEOFR-LGWLGOQQSA-N 273.424 2.353 10 10 CECE CN1CCc2cc([C@@H](O)[C@H](N)Cc3cccs3)ccc21 2147531898 QOTFFXMFIPXVLP-GDBMZVCRSA-N 288.416 2.344 10 10 CECE C[C@@H](O)c1ccc(N2CCNC(=O)C(C)(C)C2)c(Cl)c1 2150390220 CSYXHWKIMFKQQI-SNVBAGLBSA-N 296.798 2.356 10 10 CECE C[C@@]1(O)CCCN(c2ccc(CNC3CC3)cc2)C1 163376235 BSSZIGLAHQDGOA-MRXNPFEDSA-N 260.381 2.290 10 10 CECE C[C@H]1CN(c2ccc(CN)cc2C(F)(F)F)CCN1C 163716400 ZUOBZHMCRZMQSX-JTQLQIEISA-N 287.329 2.304 10 10 CECE CN1CCc2cc(CN[C@@H]3C[C@@]4(C)CCO[C@H]34)ccc21 2154145933 NSMREZCWDJWMAG-DJIMGWMZSA-N 272.392 2.336 10 10 CECE COc1cc(CN2CCC[C@H]2CN=[N+]=[N-])sn1 2009447555 YGMNMVKPKOAWJO-QMMMGPOBSA-N 253.331 2.426 10 10 CECE CNC(=O)CCOc1ccc(CNCC(C)C)cc1C 2155012562 IKDJXBDDDRPXQM-UHFFFAOYSA-N 278.396 2.256 10 10 CECE C[C@@H]1C[C@H](CO)CN1c1ccc(CO)c(C(F)(F)F)c1 2156552667 OLYTZLSDGCNMJB-ZJUUUORDSA-N 289.297 2.405 10 10 CECE Cc1cccnc1C(=O)N(C)Cc1ccc(N)cc1 51790659 QFOZMXHXNPVCOJ-UHFFFAOYSA-N 255.321 2.244 10 10 CECE C[C@@H]1CN(c2ccc(CN)cc2F)[C@H](C)CCO1 2031632781 IWBFYOZVEBBCHE-GHMZBOCLSA-N 252.333 2.288 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCc2nnc(C)n2C)c1 2160417079 WGLFHDKGUYOCTP-LLVKDONJSA-N 274.368 2.031 10 10 CECE CCCN(CCOC)c1c(F)cc(CN)cc1F 2036717415 HUVOVYKJFUQDKU-UHFFFAOYSA-N 258.312 2.286 10 10 CECE CCN(CC)C(=O)CN1CCC[C@@H](N=[N+]=[N-])CC1 2038007532 PPEVJOPSDPCDCP-LLVKDONJSA-N 253.350 2.020 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@@H]1CCCC1(F)F 2160522241 QFGBDSBUUGWXFF-NEPJUHHUSA-N 282.290 2.296 10 10 CECE [N-]=[N+]=NC1CN(C(=O)[C@H]2CC[C@]3(C2)CC3(F)F)C1 2038573820 AMWCCIJKZVCERK-XVKPBYJWSA-N 256.256 2.333 10 10 CECE CCNCc1ccc(N2CCN(C3CC3)C[C@@H]2C)cc1 402682269 HZNNWFULHJPDOW-AWEZNQCLSA-N 273.424 2.469 10 10 CECE C[C@@H]1OC[C@H](NCc2ccc3c(c2)CCN3C)[C@H]1C 405592845 BGSLWYFTJPEUBR-HUBLWGQQSA-N 260.381 2.192 10 10 CECE COc1ccc([C@@H](C)NC[C@](C)(O)C(C)C)c(O)c1 312017417 XUDMJAOPLYLSSN-ABAIWWIYSA-N 267.369 2.458 10 10 CECE O=C(O)[C@H]1C[C@@H]2CN(Cc3cc(F)ccc3O)C[C@@H]2C1 2158865829 AARHPNVFSKADSS-JGPRNRPPSA-N 279.311 2.074 10 10 CECE C[C@@H]1CN([C@H](C)c2c(O)cccc2O)CC[C@@H]1C(=O)O 312793671 GDDKTZBLVRHFJV-MXWKQRLJSA-N 279.336 2.201 10 10 CECE COCCOC[C@@H]1CCN(c2ccc(CN)c(Cl)c2)C1 2159080005 MTVWQWFWIQHXGG-GFCCVEGCSA-N 298.814 2.288 10 10 CECE CNCc1ccc(N2C[C@@H]3CCC[C@@]3(CO)C2)c(C)c1 2159396697 JIQXXZRXMAEPNB-RDJZCZTQSA-N 274.408 2.313 10 10 CECE CC[C@H](NS(=O)(=O)Cc1ccc(N)cc1)C1CCC1 325001082 ZKVQGTDCHPVMQM-AWEZNQCLSA-N 282.409 2.267 10 10 CECE C[C@@]1(C(F)(F)F)C[C@@H]1C(=O)NCc1cc(N)ccc1O 2161806688 HGQANTRFVSOJPX-BXKDBHETSA-N 288.269 2.179 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CCC3(CCC3)C2)cc1 2161859209 DEHLBVROKMVHNO-ZDUSSCGKSA-N 274.364 2.487 10 10 CECE CNCc1ccc(N(C)Cc2ccnn2C)c(Cl)c1 701677819 HBEYXJZBQSIZPX-UHFFFAOYSA-N 278.787 2.429 10 10 CECE CC(C)[C@@H](CN(C)C)NCc1ccc(F)c(F)c1O 703230925 YDUVXVAJDCIGAC-GFCCVEGCSA-N 272.339 2.346 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccc2n[nH]cc2c1 706392893 NJPSBVJSSZGRFM-UHFFFAOYSA-N 258.285 2.383 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@]3(CNC(=O)C3)C2)cc1Cl 2163342770 QNALFFYAFKNCDR-ZUZCIYMTSA-N 294.782 2.110 10 10 CECE C[C@H]1CN(C)CCN(c2ccc3c(c2)CCCN3)C1 707591892 VXKQGALPGCSIIL-ZDUSSCGKSA-N 259.397 2.433 10 10 CECE CCOc1cccc(CNC2(CO)CC(C)(C)C2)c1O 2163541340 RSTSGBKOAQOKPC-UHFFFAOYSA-N 279.380 2.432 10 10 CECE CN1CCc2cc(CNCC3=CCCOC3)ccc21 372360416 RQRLDRPJEZMESG-UHFFFAOYSA-N 258.365 2.115 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCC[C@@H]1C1CC1 709940655 FJHUABKQNFCMOJ-DGCLKSJQSA-N 266.345 2.398 10 10 CECE C[C@H](c1ccccc1O)N1C[C@H]2CC[C@H]1[C@H]1CNC[C@@H]21 709951206 YXKYJDIQSVKIBH-WOOFSFRISA-N 272.392 2.383 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@H]1CCC(=O)O 380327835 QHNQAYPTRZISMN-MNOVXSKESA-N 279.336 2.488 10 10 CECE COC[C@H](C)CN(C)CCCOc1ccc(N)cc1 388861796 CVHQEUVQMGFHSI-CYBMUJFWSA-N 266.385 2.252 10 10 CECE COc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C)c(O)c1 720467685 REUFSARSRNFESN-HUUCEWRRSA-N 276.380 2.069 10 10 CECE C[C@@H](NCc1cccnc1O)c1c(O)cccc1O 714956954 QANVZUXFGHQCRM-SECBINFHSA-N 260.293 2.049 10 10 CECE CCC1(O)CN(c2ccc(CNC(C)C)cc2C#N)C1 384039231 JDNGMWQBUUJIMX-UHFFFAOYSA-N 273.380 2.017 10 10 CECE CCCOc1cc(N2CC(O)(CCC)C2)ccc1N 384072900 PFZYQTGPHARICT-UHFFFAOYSA-N 264.369 2.409 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H](O)[C@H]2C)cc1O 384774512 SLLUTGWGQAWFJF-GYSYKLTISA-N 264.369 2.022 10 10 CECE COc1ccc(O)c(CN[C@H]2CC23CCOCC3)c1 387367724 XBJJRPVDZOPYGB-AWEZNQCLSA-N 263.337 2.060 10 10 CECE Nc1ccc(CS(=O)(=O)NC2(C3CCC3)CC2)cc1 697415942 BXKNBKLCERGMQB-UHFFFAOYSA-N 280.393 2.021 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CC23CCOCC3)C1 821906681 NUHIOKICBWTPBY-MNOVXSKESA-N 264.329 2.104 10 10 CECE CN(C[C@@H]1OCC[C@@H]1F)c1ccc(C=CC(=O)O)cc1 2179105231 WZNLSFLXYXMVSV-KBPBESRZSA-N 279.311 2.348 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H](C)O[C@@H](CCO)C2)cc1 2179384170 WBBSGEKXMVEDHA-RCBQFDQVSA-N 278.396 2.073 10 10 CECE CN1CCN(c2ccc(CN)cc2C(F)(F)F)[C@@H]2C[C@@H]21 2168359646 KKCVVUXHPJATPF-QWHCGFSZSA-N 285.313 2.057 10 10 CECE COC(=O)c1cn([C@@H](C)c2c(O)cccc2OC)nc1C 2070247206 UOIVPPGRJOQKRZ-JTQLQIEISA-N 290.319 2.302 10 10 CECE Oc1nn(Cc2cccc(F)c2O)cc1Br 2070616942 BXEFCYDLFIQXDI-UHFFFAOYSA-N 287.088 2.244 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)C2CC3(COC3)C2)C1 2176486850 YFEOJNMKTIYXAF-NSHDSACASA-N 278.356 2.352 10 10 CECE C[C@H](C[C@@H](C)C(=O)N(C)Cc1ccccc1O)C(=O)O 2176682078 JZFJUXNINPBPHG-GHMZBOCLSA-N 279.336 2.098 10 10 CECE CN(C)c1ccc(CN2CC[C@@H]3NCCC[C@@H]3C2)cc1 1237381676 JKMKGGUHBXERNB-WBVHZDCISA-N 273.424 2.327 10 10 CECE O=C(NC[C@@H]1[C@@H]2CCC(F)(F)[C@H]21)c1ccc(O)c(O)c1 2170873065 GXPFFMFKLHFONP-YGOYTEALSA-N 283.274 2.119 10 10 CECE CN(C)c1ccc(CN2CC=C(CC(=O)O)CC2)cc1 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2.287 10 10 CECE [N-]=[N+]=NCCCS(=O)(=O)c1cc(F)cc(F)c1 2247636735 PCXYTYZNIXNSKB-UHFFFAOYSA-N 261.253 2.439 10 10 CECE C[C@H](NCc1cc2c(cc1O)OCO2)C1(F)CC1 1922359987 KWFGMNJYQYSASD-QMMMGPOBSA-N 253.273 2.101 10 10 CECE C[C@H](NC[C@@]1(O)CC[C@@H](C)C1)c1ccc(O)cc1O 2136916562 XJENUDMYGRBNFF-JRPNMDOOSA-N 265.353 2.300 10 10 CECE CSCCCCNC(=O)CCOc1ccc(N)cc1 229172996 QJUFTTJCXKEXDR-UHFFFAOYSA-N 282.409 2.297 10 10 CECE COc1cccc(CN[C@@]23CCC[C@@H](C2)OC3)c1O 1925100080 QEZZUOJESQUOGB-WFASDCNBSA-N 263.337 2.202 10 10 CECE C[C@H]1CCCC[C@H]1OCC(=O)NCc1cc(O)ccc1O 1644753913 MBWDFOKAKRMXKN-XHDPSFHLSA-N 293.363 2.309 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1C[C@H]1c1ccco1 1647289423 CVHHRWABSSKMJX-NXEZZACHSA-N 273.288 2.111 10 10 CECE CCOc1ccc(N(CC)CC(=O)N=c2cc[nH]cc2)cc1 1657727917 ADAMMQCYRPYUIA-UHFFFAOYSA-N 299.374 2.367 10 10 CECE Oc1cc(Cl)ccc1CNC[C@@H](O)C1CCC1 1659460985 ICJDDDFBZQSSBF-CYBMUJFWSA-N 255.745 2.296 10 10 CECE COCc1cccc(C(=O)NCc2c(O)cccc2O)c1 1597568527 GFGROPMNKPLFPR-UHFFFAOYSA-N 287.315 2.174 10 10 CECE COc1cccc(CN2CC[C@H](CCC(=O)O)C2)c1O 134706985 CYTSYCFVWYMCDK-NSHDSACASA-N 279.336 2.088 10 10 CECE COc1cc(N2CC[C@H](OC)C2(C)C)ccc1CN 2139698537 KEQOITRQYAQZNV-AWEZNQCLSA-N 264.369 2.158 10 10 CECE CCCNCc1ccc(OC)c(CN(C)[C@@H]2CCOC2)c1 158889432 XRGFPQSIKWQAKB-MRXNPFEDSA-N 292.423 2.416 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](CO)OC(C)(C)C2)cc1 163206371 YHLQRWBEIFYETF-CZUORRHYSA-N 292.423 2.333 10 10 CECE COc1ccc(CNCc2nnc3ccccn23)cc1C 35052670 VXVDWLGLKXEKTM-UHFFFAOYSA-N 282.347 2.336 10 10 CECE CCN(CC)CCNCc1cc(Cl)ccc1O 19919490 JUPAXNWAMKRPFO-UHFFFAOYSA-N 256.777 2.477 10 10 CECE NCc1ccc(N2CC3(CSC3)C2)cc1Br 1937085640 MGPAAEGBHPQQDB-UHFFFAOYSA-N 299.237 2.461 10 10 CECE OCc1ccc(N2[C@H](CO)CCC23CCC3)c(F)c1 2140846667 ZFNMMFUGUXCHJA-LBPRGKRZSA-N 265.328 2.202 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCC[C@@H](OC)C2)cc1 234763039 HGDYHTFMZVJIPN-CVEARBPZSA-N 278.396 2.418 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)C1(CCO)CCC1 2140935812 WZZNTFDWRYGZMH-HNNXBMFYSA-N 260.381 2.374 10 10 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10 10 CECE OC[C@@H]1CCN(c2c(F)cc(CNC3CC3)cc2F)C1 167874586 RSGOBOMMBGLYQB-SNVBAGLBSA-N 282.334 2.035 10 10 CECE C[C@H]1N(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)CCC1(C)C 2146667618 VDHQYXONMVEJMG-QMTHXVAHSA-N 273.380 2.288 10 10 CECE CCC[C@@H](C)N(C)c1cc2c(cc1N)OCC(=O)N2 36790138 STHJRTLHYPBAQK-SECBINFHSA-N 263.341 2.225 10 10 CECE Oc1c(Br)cccc1CNC[C@@H]1CC[C@@H]1O 1994680787 ZIZBSZINYMOSNH-KWQFWETISA-N 286.169 2.015 10 10 CECE Cc1c(C(=O)N(C)[C@@H](C)c2ccccc2O)cnn1C 38089670 LWFPXBRPXWWIRX-JTQLQIEISA-N 273.336 2.267 10 10 CECE Nc1ccc(CCCN2C[C@@H]3CCC[C@H](O)[C@H]3C2)cc1 2150925965 FTBSRVRBSRBIRL-XIRDDKMYSA-N 274.408 2.294 10 10 CECE CC(C)c1cc(NCc2cc(N)ccc2O)ncn1 40766670 OFBNHXMLKXWTOQ-UHFFFAOYSA-N 258.325 2.500 10 10 CECE Nc1ccc(NC(=O)CC[S@@](=O)c2ccccc2)cc1 40961112 JIVVEASAFATGIE-FQEVSTJZSA-N 288.372 2.405 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC[C@H](N)C(F)(F)C1 2151608183 LHJLGAPWSSDCDR-FZMZJTMJSA-N 283.366 2.482 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cc(Br)n[nH]2)C1 2016278064 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297.402 2.407 10 10 CECE COc1ccc(N(C)Cc2ccc(C(N)=S)nc2)cc1 2160314641 BZJJFOSTUXMTCR-UHFFFAOYSA-N 287.388 2.361 10 10 CECE O=C(O)c1nc(CNCc2ccc3c(c2)CCO3)cs1 2160558650 CWQCRNYGFHZEIG-UHFFFAOYSA-N 290.344 2.066 10 10 CECE CCN1CCCN(Cc2cc(OC)ccc2O)[C@@H](C)C1 320482682 HBNAJZQGBSFJRL-ZDUSSCGKSA-N 278.396 2.317 10 10 CECE CC[C@H](NC)c1ccc(N2CCC[S@@](=O)CC2)cc1 321570764 CGBGMHRVGOKFER-HNAYVOBHSA-N 280.437 2.316 10 10 CECE CNCc1ccc(N2C[C@@H]3CN(C)C[C@@]3(C)C2)cc1C 702400761 LGZFDTOXSCMEOH-RDJZCZTQSA-N 273.424 2.102 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)C12CCCN(CCC1)C2 705921354 DSIIZOIMFODZSP-LBPRGKRZSA-N 277.372 2.164 10 10 CECE Cc1nc[nH]c1CNCc1c(O)cccc1Br 706821679 LZQVAYMCHQFUFA-UHFFFAOYSA-N 296.168 2.476 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@H](CN(C)C)C2)cc1 688492849 GLQWVIMPUJZQOA-CZUORRHYSA-N 261.413 2.484 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](C)O[C@H](CCO)C2)c(Cl)c1 2179381757 LZWIBFADZDKMHU-NTZNESFSSA-N 299.798 2.369 10 10 CECE CC(C)(C)N(CCO)CCCOc1ccc(N)cc1 708521407 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CN[C@H](C)c1ccc(N2CCO[C@@H]([C@H](C)O)C2)c(Cl)c1 2174152999 VMEQYAWZVKSQMY-JRPNMDOOSA-N 298.814 2.206 10 10 CECE CN(Cc1ccc(N)cc1)C[C@@]1(F)CC[C@H](C(=O)O)C1 2174499844 YGTDKYWUUQGCLU-SWLSCSKDSA-N 280.343 2.294 10 10 CECE CCOC(=O)c1cnn([C@H](C)c2c(O)cccc2OC)c1 2069967786 MIDXYZOSLUIZFY-SNVBAGLBSA-N 290.319 2.383 10 10 CECE OCCC1CC(NCc2cccc(Cl)c2O)C1 898008858 XRQJICREMVHVSW-UHFFFAOYSA-N 255.745 2.296 10 10 CECE CCN(C)C1CN(c2ccc(CN)c3ccccc23)C1 2169445769 GSZAILDPJVJSPH-UHFFFAOYSA-N 269.392 2.439 10 10 CECE N[C@@]12CCCC[C@@H]1CN(c1ccc3c(c1)COCC3)C2 2169632808 ZFFBMCSCMHLZFF-NVXWUHKLSA-N 272.392 2.467 10 10 CECE CC[C@H](N)c1ccc(N2CCC[C@H](OCCO)C2)cc1 2170217225 YSUIQFOTMZREHP-HOTGVXAUSA-N 278.396 2.074 10 10 CECE C[C@H](F)[C@H]1CCCN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2181089885 HQKZLKJOKFGEFL-HOCOFYGGSA-N 282.290 2.138 10 10 CECE CC(C)[C@@H]1CNC(=O)CN1c1ccc([C@@H](C)N)c(Cl)c1 2181163862 UTZMSUOZZCYMSK-YGRLFVJLSA-N 295.814 2.321 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC[C@H]2[C@H](C)O)cc1O 2193594763 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COc1ccc(N2CC[C@H](CN)C2(C)C)c(F)c1 2044796851 GMGDCUCLLJTPIW-SNVBAGLBSA-N 252.333 2.398 10 10 CECE C[C@@H]1C[C@H]1S(=O)(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2045244864 MQKXNRDOFKGUJM-GMTAPVOTSA-N 272.374 2.137 10 10 CECE COC[C@@]12C[C@@H]1CN(c1ccc(CO)cc1Cl)C2 2046793158 JAWGWMVPRBBFLI-RISCZKNCSA-N 267.756 2.305 10 10 CECE C[C@@H]1CO[C@H](CN[C@@H](C)c2ccc(O)cc2O)C1 2047501990 JCJLQTJYVYFCOJ-NHCYSSNCSA-N 251.326 2.173 10 10 CECE CCOC1(CN[C@@H](C)c2cc(O)ccc2O)CC1 2047788334 FNWCPBFLUNUMFZ-JTQLQIEISA-N 251.326 2.318 10 10 CECE COC12CC(C1)N(c1ccc(C=CC(=O)O)cc1C)C2 2185472503 ZBBNKWHRPQHZFV-UHFFFAOYSA-N 273.332 2.460 10 10 CECE C[C@H](O)c1ccc(N2CC[S@@](=O)[C@H](C)C2)c(Cl)c1 2051906008 QTSSOUFZLALRTJ-AUSHCKSDSA-N 287.812 2.351 10 10 CECE C[C@H]1CC[C@H](O)CN1c1cc(Cl)c(CN)cc1F 2057249023 KWFZJIJZNBRWOL-WPRPVWTQSA-N 272.751 2.287 10 10 CECE Oc1c(F)cc(F)cc1CN1CCNC[C@H]1C(F)(F)F 2186680588 CXUAFOGHVALTTA-JTQLQIEISA-N 296.239 2.007 10 10 CECE C[C@H](N[C@@]1(C)CCC[C@@H]1O)c1ccc(F)cc1O 2062582583 OMLRLRPRDGWMFK-HERUPUMHSA-N 253.317 2.485 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CC[C@H]2C2CCC2)cc1 2191884348 NYPFPDAAFFIHTE-GJZGRUSLSA-N 274.364 2.343 10 10 CECE CC(C)C(F)(F)CNC(=O)c1ccc(O)c(O)c1 2065509318 JYFZTQLGPWBLRQ-UHFFFAOYSA-N 259.252 2.119 10 10 CECE CC(=O)N1C[C@H]2C[C@H]1CN2[C@H](C)c1ccc(C)cc1O 2192239387 QECKCBLHZYBHLR-BNOWGMLFSA-N 274.364 2.067 10 10 CECE O=C1Nc2cc(N3CC[C@H]4C=C[C@H]3C4)c(Cl)cc2[C@H]1O 2199424036 MIZZYWBAJJTUTC-TVLCNXBWSA-N 290.750 2.480 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@@](C)(CO)C2)cc1Cl 2199841438 IAUSGSYTDSBWKH-XHDPSFHLSA-N 298.814 2.195 10 10 CECE C[C@@H]1CCO[C@H]1CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2101077901 OBLNRRKMQGFISY-WOPDTQHZSA-N 266.345 2.493 10 10 CECE COc1ccc(N(C)C2CCNCC2)c(F)c1F 2081856444 IBHBVIGBZONXME-UHFFFAOYSA-N 256.296 2.162 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@@H](C)NCC1(C)C 2102326689 DCBUSULLOYGCGD-MNOVXSKESA-N 264.369 2.231 10 10 CECE CN(C[C@@H]1C[C@H]1C(F)F)C(=O)c1cccc(O)c1O 2103527269 PVBQHYCDMCIZNM-IONNQARKSA-N 271.263 2.071 10 10 CECE COc1cc(N2CC3(CC(F)C3)C2)ccc1CO 2084013216 BBKOPPWSBQTFGY-UHFFFAOYSA-N 251.301 2.126 10 10 CECE CN1CCCN(Cc2ccc(F)cc2O)CCC1 2084097424 RBQHTLDDBBTBSE-UHFFFAOYSA-N 252.333 2.059 10 10 CECE CC[C@@H](C)[C@H](NCc1c(O)cccc1F)C(=O)OC 2104478393 SBYOJSMOSPIHCG-RNCFNFMXSA-N 269.316 2.209 10 10 CECE CN(C)c1ccc(CN[C@@](C)(CO)C(F)(F)F)cc1 2105096852 RBGFUWKKDRZIID-LBPRGKRZSA-N 276.302 2.156 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3OCC[C@H]3C)ccc21 2106793902 RNPAIJIXIWOJNZ-RLCCDNCMSA-N 260.381 2.494 10 10 CECE CN1CCCc2cc([C@H](O)C[C@@H](N)C3CC3)ccc21 2106827296 BIXPNUQJSPDMNF-GDBMZVCRSA-N 260.381 2.230 10 10 CECE CN1CCCc2cc([C@H](N)C(C)(C)N(C)C)ccc21 2106821040 QHFBUADCWLDWDJ-HNNXBMFYSA-N 261.413 2.409 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@H]2C[C@H]2OC)cc1 2106867571 IEUFAQFLQRUNQY-ZNMIVQPWSA-N 263.385 2.072 10 10 CECE CN(C)c1ccc([C@H](O)[C@H](N)C2C[C@@H]3C[C@H]3C2)cc1 2107676030 RQZPXUMNLGOAIZ-RKLWJJNISA-N 260.381 2.159 10 10 CECE CO[C@@H]1CC[C@@H]2CN(c3ccc(CO)c(C)c3)C[C@H]21 2087915868 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10 10 CECE COC(=O)C1=C(C)N(C(C)C)C(=O)C1=Cc1ccco1 2313541524 MXXNYXYVBSBUQL-UHFFFAOYSA-N 275.304 2.361 10 10 CECE O=C(O)[C@@]1(Sc2nccs2)CCCCNCC1 2306960723 SGJIUPYLWMOKET-LLVKDONJSA-N 272.395 2.222 10 10 CECE CC[C@H](O)c1ccc(N2CCOC[C@@H](F)C2)cc1 2315062586 AUXAKXUOGUNDKR-JSGCOSHPSA-N 253.317 2.305 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@@H]2C[C@H]1C[C@@H]2F 2329126435 HPLQEYNQIPMTMO-HHVGHTAVSA-N 265.328 2.152 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H]3[C@@H]4CCCO[C@@H]43)ccc21 2330716841 KEPINOVFNJZMBS-HNKHHVNMSA-N 259.349 2.137 10 10 CECE CN(C[C@@H]1CO[C@]2(C)C[C@H]1C2)c1ccc(CO)cc1 2337641012 PCEFIUMRNSAEIC-FMKPAKJESA-N 261.365 2.430 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@]12CCCC[C@@H]1OCC2 2337776835 IMZBCUHCQXRSMK-WCQYABFASA-N 266.345 2.495 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1cccc([N+](=O)[O-])c1 2337778169 SUQJOOGSQPPIKU-UHFFFAOYSA-N 263.257 2.367 10 10 CECE CSCC[C@@](C)(O)[C@H](N)c1ccc2c(c1)CCN2C 2340087790 NVCJDOVFUHLGFZ-HUUCEWRRSA-N 280.437 2.183 10 10 CECE 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CC[C@H](O)[C@@H](CC)NCc1cccc(OC)c1O 313096653 DMRQVIIMUFRSGZ-NEPJUHHUSA-N 253.342 2.040 10 10 CECE Nc1ccc(OCCC(=O)N[C@H]2C[C@@H]2C(F)(F)F)cc1 2161754876 HHDAXXADEUVRBM-QWRGUYRKSA-N 288.269 2.105 10 10 CECE C[C@H](NC[C@@]12COC[C@@H]1C2(F)F)c1ccc(F)cc1O 2161877742 UOYLOSZFABKXTC-AQUOVQTQSA-N 287.281 2.464 10 10 CECE Cc1cc([C@@H](N)c2ccc3c(c2)CCCN3C)ncn1 2177311716 JKAFFGMUTCAHBK-INIZCTEOSA-N 268.364 2.216 10 10 CECE CN(C[C@@]12COC[C@H]1C2)c1ccc(CO)c(Cl)c1 701839350 SQKHGFUPYCFQHI-RISCZKNCSA-N 267.756 2.305 10 10 CECE Cc1ncc(CNCc2ccc(F)c(F)c2O)n1C 703257033 MXKHQRPBAZVBON-UHFFFAOYSA-N 267.279 2.002 10 10 CECE O=C(O)[C@@H]1C[C@@]12CC[C@@H]2NCc1cc(F)cc(F)c1O 2172489631 OPGYGCHRWTZGBF-CHIMOYNISA-N 283.274 2.013 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](O)C[C@@H]2C)c(F)c1 705988816 SUDKCJMDUBBPGI-GXSJLCMTSA-N 270.323 2.034 10 10 CECE CCN1CCc2cc([C@]3(O)CCN[C@H]4CC[C@@H]43)ccc21 2177702948 DSNZRTCVJRUTRS-YQQAZPJKSA-N 272.392 2.029 10 10 CECE CCN1CCc2cc([C@H](O)[C@@]34CC[C@@H]3CCN4)ccc21 2163072522 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SLBJXCNTHIOXSL-KGLIPLIRSA-N 268.788 2.409 10 10 CECE C[C@H]1CSCCN([C@H](C)C(=O)Nc2ccc(N)cc2)C1 379530878 XLIOMEWUGJLKBL-VXGBXAGGSA-N 293.436 2.281 10 10 CECE CCN(CC)C1[C@H]2CN(c3ccc(CN)cc3F)C[C@H]12 384556620 OICZVBJIFUSRHF-STQMWFEESA-N 277.387 2.061 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@H](C)O[C@@H]2C)c1O 384978270 UHNODNVPYPEYIF-DMDPSCGWSA-N 265.353 2.446 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2CC(CO)C3)c(N)c1 719155618 QSBXEJSAGIXQEY-RYUDHWBXSA-N 262.353 2.017 10 10 CECE NN[C@@H](c1ccc(N2CCCCC2)cc1)[C@@H]1CCOC1 2163107494 SPNGPBMEGIDYSU-ZBFHGGJFSA-N 275.396 2.218 10 10 CECE CNCc1ccc(N2CCCOC[C@H]2C)c(F)c1 398879136 GSPYBZHKLRYYEF-LLVKDONJSA-N 252.333 2.160 10 10 CECE CCNCc1ccc(N2CCC3(CN(C)C3)C2)cc1C 398940054 VRJIDVLGMOSZHE-UHFFFAOYSA-N 273.424 2.246 10 10 CECE O=C(O)[C@@H]1C[C@]12CC[C@@H]2NCc1cc(F)cc(F)c1O 2172489633 OPGYGCHRWTZGBF-NURSFMCSSA-N 283.274 2.013 10 10 CECE CCc1cc(C(=O)OC)n(Cc2cc(F)ccc2O)n1 2069952102 TUTCNDBBNCXIEH-UHFFFAOYSA-N 278.283 2.125 10 10 CECE COc1cnn([C@H](C)c2ccc(F)cc2O)c1O 2070203509 PJCUXSHRNMQZEP-SSDOTTSWSA-N 252.245 2.051 10 10 CECE Cc1ncncc1CN(C)c1c(F)cc(CN)cc1F 2178809108 ZMJOFNFLZZITET-UHFFFAOYSA-N 278.306 2.158 10 10 CECE CCc1cccc(CN2CCOC[C@]2(C)COC)c1O 2168249745 XCORQYXSYSKFKH-INIZCTEOSA-N 279.380 2.192 10 10 CECE CO[C@@H](CCO)CNCc1c(O)ccc2ccccc12 2168519947 ONYOBPVYVBLFJO-ZDUSSCGKSA-N 275.348 2.032 10 10 CECE COc1ccc(N(C)[C@@H](C(=O)O)C(C)C)c([N+](=O)[O-])c1 2174975191 QZDNEZYIWFMZHK-GFCCVEGCSA-N 282.296 2.149 10 10 CECE CCN1CCN(c2ccc(CNC)cc2F)C(C)(C)C1 2175034649 RDGSQAICKBIROA-UHFFFAOYSA-N 279.403 2.466 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@@H](COC)C2)cc1O 2175251868 KODJBYKAEANDEE-YNEHKIRRSA-N 278.396 2.391 10 10 CECE COC(=O)c1cccc(CN2CCC[C@@H]2CN=[N+]=[N-])n1 2179617691 USMKLCDEGCYRFD-LLVKDONJSA-N 275.312 2.143 10 10 CECE CC[C@H](c1ccccc1O)N(C)CC1COCCOC1 2188034555 XJGUTUGKDFOJEZ-OAHLLOKOSA-N 279.380 2.438 10 10 CECE C[C@@H](NC(=O)CSC1CCNCC1)c1ccccc1O 2192621546 DFYWUIMJWYOBPQ-LLVKDONJSA-N 294.420 2.055 10 10 CECE CC[C@H](N[C@@H]1CC(=O)N2CCC[C@@H]12)c1ccccc1O 2188498383 JETHWJNDWLIFFO-MJBXVCDLSA-N 274.364 2.196 10 10 CECE C[C@H](N[C@@H]1CCN2CC[C@H]1C2)c1ccc(N(C)C)cc1 2192805018 PACBGCBZYFAZTD-JLJPHGGASA-N 273.424 2.497 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2[C@H]3CC[C@@H](O3)[C@H]21)c1ccc(O)cc1O 2188730480 HPLMTBFIGLXHIB-SBHGQNAGSA-N 275.348 2.314 10 10 CECE CSCC1(C)CN([C@@H](C)C(=O)Nc2ccc(N)cc2)C1 2182701211 HODDZLGXOAKHGR-NSHDSACASA-N 293.436 2.281 10 10 CECE NCc1ccc(N2CC(O)(c3ccsc3)C2)c(F)c1F 2193349997 GBOKLBBXHPGOGA-UHFFFAOYSA-N 296.342 2.193 10 10 CECE COc1ccc(N2CCC[C@H]([C@@H](C)N)C2)c(F)c1 2044288047 BHAFDFNVTRUOHK-MNOVXSKESA-N 252.333 2.398 10 10 CECE COc1ccc(N2C[C@H](C)[C@@H](CCN)C2)c(F)c1 2044345434 VKKKXOHEXYZBQO-QWRGUYRKSA-N 252.333 2.255 10 10 CECE C[C@@H]1CCCC[C@H]1NC(=O)NCc1cc(N)ccc1O 2196546730 VTBQIHBDZGTXFS-ZWNOBZJWSA-N 277.368 2.352 10 10 CECE C[C@@H](CC(=O)NCCOc1ccc(N)cc1)P(C)(C)=O 2196546577 AAQWNSHAFBZSJP-NSHDSACASA-N 298.323 2.165 10 10 CECE C[C@H]1CCNC[C@@H]1N(C)Cc1c(O)cccc1Cl 2045222936 UPNSTUXCOZELIG-GWCFXTLKSA-N 268.788 2.475 10 10 CECE OC[C@@H]1CC2(CC2)CN1c1ccc2c(c1)CCC[C@H]2O 2184683711 DFVIVKGDFMSIIX-GOEBONIOSA-N 273.376 2.408 10 10 CECE CCCOC1(C(=O)N2CCC(N=[N+]=[N-])CC2)CC1 2047759468 VCUAIRGCXVONSA-UHFFFAOYSA-N 252.318 2.247 10 10 CECE N[C@H]1CCc2cc(N3[C@H]4CC[C@H]3CC(CO)C4)ccc21 2184741395 JAWXUTBBPXRQLP-ZQIUZPCESA-N 272.392 2.372 10 10 CECE Nc1ccc(CCNCC(F)(F)C2CCOCC2)cc1 2185385589 XVBIZPSYDYONGW-UHFFFAOYSA-N 284.350 2.463 10 10 CECE CCC[C@@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)CO1 2185621295 WOWFCMJXHXXPRE-WDEREUQCSA-N 279.336 2.127 10 10 CECE CCn1nc(CN(C)c2ccc(OC)cc2N)cc1C 2185740209 YJUZOSXLACFTAW-UHFFFAOYSA-N 274.368 2.439 10 10 CECE CCCc1nc(CN2CCC[C@@H]2CN=[N+]=[N-])no1 2059053297 LLIULJYNZCJPAQ-SECBINFHSA-N 250.306 2.297 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CCO[C@H]1CCCCO1 2059053425 MOUVDMHYOSCTOK-NEPJUHHUSA-N 254.334 2.304 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](CO)C[C@@H](C)C2)c(F)c1 2194513361 UDIUKZAQOQTENY-VWYCJHECSA-N 285.334 2.473 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC(OCC(F)F)C2)c(F)c1 2194510194 JDUWWZBDOUZOGO-SSDOTTSWSA-N 293.260 2.488 10 10 CECE CNCc1ccc(N(C)C[C@H]2CCN2C)c(Cl)c1 2066394692 JTSBAZDAPSGCBJ-GFCCVEGCSA-N 267.804 2.200 10 10 CECE Nc1ccc(OC[C@H](O)CO[C@H]2CC[C@H]3C[C@@H]2C3)cc1 2198396837 ZLWLYNGALBFPAP-LMWOUKEDSA-N 277.364 2.214 10 10 CECE CC1(C)OCCC[C@H]1[C@H](NN)c1ccccc1O 2066877063 GLZLAALVCBDNMP-WCQYABFASA-N 250.342 2.102 10 10 CECE CN1C[C@H]2CC[C@H]1CN2c1ccc2c(c1)CCC[C@@H]2N 2186668984 NOASHHZBFIJBJN-UXLLHSPISA-N 271.408 2.306 10 10 CECE CCCOc1cc(N2CC[C@@]3(CCNC3)C2)ccc1N 2191590797 TYJUCNWPXPORFG-MRXNPFEDSA-N 275.396 2.247 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)Cc2ncno2)c(F)c1 2194708521 JFEHZBCXQIMZKG-QMMMGPOBSA-N 282.294 2.265 10 10 CECE CN(C[C@@H]1C[C@H]1CF)C(=O)Nc1ccc(N)cc1 2071380376 MACCZVXJKTZSNY-UWVGGRQHSA-N 251.305 2.338 10 10 CECE CN(c1ccc(CO)cc1Cl)[C@H]1COCC1(F)F 2076374572 PDNGJFIAMNRYCG-NSHDSACASA-N 277.698 2.303 10 10 CECE COc1ccc(N2CCC[C@@H](N)[C@@H]2C)c(F)c1F 2081859250 GNYDZXHHJMKZIX-DTWKUNHWSA-N 256.296 2.289 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@H](C(F)F)[C@@H](N)C1 2102496807 WYPGINYCSAFAQH-SDDRHHMPSA-N 270.323 2.368 10 10 CECE Nc1ccc(CC(=O)NC[C@@H]2C[C@@H]2C(F)(F)F)cc1 2103536030 KCZUYLLQOVTVTC-ONGXEEELSA-N 272.270 2.126 10 10 CECE CN(C[C@@H]1C[C@@H]1C(F)F)C(=O)c1ccc(O)c(O)c1 2103531007 XSTYRYZBGUMQIK-IUCAKERBSA-N 271.263 2.071 10 10 CECE Cc1cc(C(=O)NCc2cccc(C)c2O)sn1 2084058033 BMHJGWJOBIQEHP-UHFFFAOYSA-N 262.334 2.396 10 10 CECE CNCc1ccc(N2C[C@@H](C)[C@@H](F)C2)cc1OC 2084004560 KIBHJZGFKMZMPO-MFKMUULPSA-N 252.333 2.209 10 10 CECE COc1cc(N2CC[C@H](C(F)F)C2)ccc1CO 2084003085 ARKCOPDRRGBPER-VIFPVBQESA-N 257.280 2.279 10 10 CECE COc1cccc(O)c1CN1CC[C@@H](OC)C[C@@H]1C 2104433776 LVXWECYKKTWOHQ-NWDGAFQWSA-N 265.353 2.400 10 10 CECE CC[C@H]1CCN(Cc2c(C)cccc2O)[C@@H]1C(=O)O 2104509533 SINQGCAKSFCJLF-FZMZJTMJSA-N 263.337 2.386 10 10 CECE CC(C)C[C@H](N)C[C@@H](O)c1ccc2c(c1)CCN2C 2106791264 QCJKSBOLXBYICL-GOEBONIOSA-N 262.397 2.476 10 10 CECE Cc1nnsc1[C@H](N)c1ccc(N2CCCC2)cc1 2106848289 GREQVLVIRKHZJF-CYBMUJFWSA-N 274.393 2.495 10 10 CECE CN1CCc2cc([C@@H](N)[C@H](O)c3ccsc3)ccc21 2106861097 XCEGUXJODXEPIH-HUUCEWRRSA-N 274.389 2.474 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H](O)c1ccoc1 2106850185 GDYTVCCXUQUEKB-GJZGRUSLSA-N 260.337 2.340 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCCO2)[C@]1(C)CCN1 2107310164 BLIVDIMYBBVPIY-WBMJQRKESA-N 260.381 2.242 10 10 CECE C[C@@H]1C[C@@H](C)N(c2ccc3c(c2)OCCO3)CCN1 2108182476 OZLODEDUIYQJAP-VXGBXAGGSA-N 262.353 2.035 10 10 CECE Cc1cc(CO)ccc1N1CC2(CC(N(C)C)C2)C1 2108165355 RKWPPKHWYRBFMM-UHFFFAOYSA-N 260.381 2.018 10 10 CECE Cc1ccc(CN(C)c2ccc(CN)cc2F)nn1 2089553665 GOFYEKVMOFUMEA-UHFFFAOYSA-N 260.316 2.019 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)[C@@H]2C[C@H]2[C@H]2C[C@H]21 2110332213 GOTJIGGKAROCCG-QIDIWCQUSA-N 259.349 2.060 10 10 CECE CN1CCCc2cc([C@@H](N)[C@@H](CO)C3CC3)ccc21 2110682783 MTWPYFUXGGTAPF-GOEBONIOSA-N 260.381 2.087 10 10 CECE CC[C@]1(C)C[C@@](O)([C@@H](N)c2ccccc2O)CCO1 2091868251 QQOWZLBWLFKKCY-RRFJBIMHSA-N 265.353 2.102 10 10 CECE C[C@H](c1ccccc1O)N1CC[C@H]2CCNC[C@H]2C1 2092523514 IOAZLBWSMUEUHH-MCIONIFRSA-N 260.381 2.385 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)cc1 2095040729 JPCTUMZQFQWLPC-UKMLZYKCSA-N 260.381 2.174 10 10 CECE NC(=O)NC1CCC(Nc2c(N)cccc2Cl)CC1 2096550389 YNFUFTQIVQFUQE-UHFFFAOYSA-N 282.775 2.314 10 10 CECE Nc1ccc(CCCN2C[C@@H](O)CC23CCC3)cc1 2099386133 NDEOHPSMSNTXID-HNNXBMFYSA-N 260.381 2.191 10 10 CECE CC(C)Oc1ccc(N2CC[C@@H](OCCN)C2)cc1 2112692703 ISNOHBBOSQOVDU-OAHLLOKOSA-N 264.369 2.028 10 10 CECE CNCc1ccc(N2CC[C@H]3OCCC[C@H]3C2)cc1 2113890443 GAKCGIJAFGAISL-GOEBONIOSA-N 260.381 2.411 10 10 CECE Nc1ccc(CCN2CC[C@@H]3OCCC[C@H]3C2)cc1 2113908233 JOZWUBNEFYSUGZ-HOCLYGCPSA-N 260.381 2.312 10 10 CECE COc1cc(N2CC[C@@](C)(O)C2)ccc1CNC(C)C 2204556429 DNFRGUIQIWTXQX-MRXNPFEDSA-N 278.396 2.154 10 10 CECE Cc1cccc(CNC(=O)c2cc(O)cc(O)c2)c1O 2204619502 CLVCIUPAZNSKOZ-UHFFFAOYSA-N 273.288 2.042 10 10 CECE Cc1ccc(CNCc2ccc3nncn3c2)c(O)c1 2204633822 JRWBAUFSXMJGAN-UHFFFAOYSA-N 268.320 2.033 10 10 CECE C[C@@H]1C[C@@H]2CN(c3cc4c(cc3Cl)[C@H](O)C(=O)N4)C[C@H]21 2206418250 XFAJVRUKXGFJBH-LMDOXVSESA-N 292.766 2.418 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@@H]3[C@H]2CO)cc1Cl 2270420819 LOSXVQMQCFYHRN-HOTUBEGUSA-N 283.755 2.174 10 10 CECE CCCNCc1cc(OC)ccc1N1CC(F)C1 2220414247 KWFBUNJOVPRTOG-UHFFFAOYSA-N 252.333 2.353 10 10 CECE CCc1nsc(CN(C)Cc2cc(N)ccc2O)n1 2273168056 OLFHWANEFUGMKC-UHFFFAOYSA-N 278.381 2.020 10 10 CECE Cc1cc(N(C)C2COC2)ccc1CNC1CCC1 2231462472 DVNYGHDQFXKBTO-UHFFFAOYSA-N 260.381 2.472 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCc2c[nH]nc2O)c1 2231836229 OBYYCMNVMZXPCS-SNVBAGLBSA-N 261.325 2.023 10 10 CECE CS(=O)(=O)C1(CSCCc2ccc(N)cc2)CC1 2222015716 AMLJHHRNOLZTLR-UHFFFAOYSA-N 285.434 2.122 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H](C)C[S@@](C)=O)c(C)c1 2232094644 VENHJVMENDMNES-XEKQOVJPSA-N 282.453 2.479 10 10 CECE C[C@H](N)c1ccc(N(C)CCc2cnn(C)c2)c(F)c1 2234097046 MUNLGEXQDHGQRG-NSHDSACASA-N 276.359 2.258 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](CCCO)C2)cc1O 2234174503 RNOVUQVHYOHVQS-OLZOCXBDSA-N 278.396 2.401 10 10 CECE C[C@H]1CN(c2ccc(OC(F)(F)F)cc2)C[C@@H](CO)O1 2234899888 PJSDDMFLYGJNSV-CABZTGNLSA-N 291.269 2.171 10 10 CECE CO[C@@H]1C[C@@H](CO)N(c2ccc(OC(F)(F)F)cc2)C1 2234898680 BBRRPQZTYUXBJS-CMPLNLGQSA-N 291.269 2.171 10 10 CECE CCOc1ccc(N2CCC3(CC2)C[C@@H](O)CO3)cc1 2235094382 ODTMEZTYQIRFQK-CQSZACIVSA-N 277.364 2.206 10 10 CECE CCc1ncncc1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2225802148 XYEYSEKHNVNHJV-WDEREUQCSA-N 260.301 2.000 10 10 CECE COc1ccc(N(C)CC2CCOCC2)c(CCN)c1 2235970901 VKANCUVIYYTACG-UHFFFAOYSA-N 278.396 2.059 10 10 CECE CNCc1cc(OC)ccc1N1C[C@@H](COC)[C@@H](C)C1 2235963653 OQZYTMRSQGUEQV-JSGCOSHPSA-N 278.396 2.133 10 10 CECE COc1ccc(N(C)C[C@@]23CCOC[C@H]2C3)c(CO)c1 2235964629 UGLJYAULAGMOTG-CJNGLKHVSA-N 277.364 2.050 10 10 CECE COc1ccc(N2CC[C@H](O)C(F)(F)CC2)c(C=O)c1 2235984884 COHDSARBALXRJW-ZDUSSCGKSA-N 285.290 2.104 10 10 CECE COc1ccc(N2CCC[C@H]2c2nncs2)c(CN)c1 2235975949 ZQCQEXFRIWGULW-ZDUSSCGKSA-N 290.392 2.347 10 10 CECE COc1ccc(N(CC(C)C)[C@H]2CCOC2)c(CO)c1 2236000602 AVSNQDLWSLMMFT-AWEZNQCLSA-N 279.380 2.439 10 10 CECE CO[C@@H]1CC[C@@H]1C(=O)N(C)[C@@H](C)c1ccccc1O 2227814222 VMZDQSHZYFJMIB-VHRBIJSZSA-N 263.337 2.337 10 10 CECE Cc1cc(N2C[C@@H](N(C)C)C(C)(C)C2)ccc1CO 2228105389 PPUGQKBBUIXRPW-OAHLLOKOSA-N 262.397 2.264 10 10 CECE CN(C[C@@H](F)[C@H]1CCOC1)c1c(F)cc(CO)cc1F 2238342585 IGAZMUNPARXOES-GXFFZTMASA-N 289.297 2.268 10 10 CECE COc1ccc(N(C)C2CSCCSC2)c(CN)c1 2228762686 VSEKLLYLHHGMPA-UHFFFAOYSA-N 298.477 2.439 10 10 CECE CC[C@H](C)NCc1ccc(N(CC)CC(N)=O)c(F)c1 2240038162 QJVAKCZWLWEMFN-NSHDSACASA-N 281.375 2.025 10 10 CECE C[C@]1(CO)C=CCCN1c1ccc(CO)c(Cl)c1 2253445921 XHVZDJDMDJEAJZ-CQSZACIVSA-N 267.756 2.350 10 10 CECE CO[C@H](C[S@@](=O)CCc1ccc(N)cc1)C(C)C 2256653225 CPKIPGKFXHLVAE-KDOFPFPSSA-N 269.410 2.231 10 10 CECE CSc1ncc(CN=c2cc(C)[nH]c(C)c2N)s1 2257098200 BFKUZKUKTLPUDG-UHFFFAOYSA-N 280.422 2.493 10 10 CECE Cc1cc(N2CCO[C@H](CF)C2)ccc1[C@H](C)N 2257461222 XIABBQGCRAOXPM-WCQYABFASA-N 252.333 2.189 10 10 CECE COc1cc(OC)c(N2C[C@H](C)[C@@H](N)C2)cc1Cl 2258055429 MNQLTCLUCWFIPG-WPRPVWTQSA-N 270.760 2.141 10 10 CECE COc1ccc(N(C)C[C@H]2CC[C@H](CO)S2)cc1 2258267278 WLSSFTDKJWYBND-ZIAGYGMSSA-N 267.394 2.388 10 10 CECE O[C@@H](CCCCF)c1ccc(N2CCNCC2)cc1 2270551813 ZMUWVJQDZLPSCD-HNNXBMFYSA-N 266.360 2.269 10 10 CECE NC[C@@]12C[C@@H]1CN(c1ccc(OCC(F)F)cc1)C2 2272656004 USKYJEHKOGSBBW-QMTHXVAHSA-N 268.307 2.116 10 10 CECE FC(F)Oc1ccc(N2CC[C@@H]3CNC[C@H]32)cc1 2263907911 CPDNKEPYQKVALL-BXKDBHETSA-N 254.280 2.086 10 10 CECE Cc1cccc(O)c1CN1CCC[C@@](F)(C(=O)O)C1 2265825198 MNFMKSKOYLEHDF-AWEZNQCLSA-N 267.300 2.089 10 10 CECE COC[C@@H]1CC[C@@H](N(C)c2ccc(OC)cc2)C[C@@H]1O 2279054964 VPRJOFHKRZNGRD-BJJXKVORSA-N 279.380 2.307 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H](C(=O)O)[C@H]1C1CC1 2279472114 JNFLWTZILPIBPC-IUODEOHRSA-N 275.348 2.386 10 10 CECE Cc1cc(N2C[C@@H](CO)C3(CC3)C2)ccc1[C@@H](C)O 2269672552 GJSRTMNQKWOWCJ-OLZOCXBDSA-N 261.365 2.257 10 10 CECE CN[C@@H](C)c1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@H]3O)c(F)c1 2286200905 GDHYSYJJPZXVFX-CNXMPWRQSA-N 282.334 2.062 10 10 CECE C[C@@]12CC[C@@](C)(CN1c1ccc3c(c1)NC(=O)[C@H]3O)C2 2287575639 YXTFZALCAUBPDP-IMJJTQAJSA-N 272.348 2.441 10 10 CECE CCCN(C(=O)c1ncncc1F)c1ccc(N)cc1 2289491922 HRRBZOZCLMBPKF-UHFFFAOYSA-N 274.299 2.255 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)c1ccco1 1186855903 HMCKGCLGROLKOO-UHFFFAOYSA-N 267.306 2.403 10 10 CECE CC=CC=CC(=O)NCc1ccc2c(c1)CCN2C 2321299401 SQWJGAITOOWVBY-UHFFFAOYSA-N 256.349 2.427 10 10 CECE CO[C@@H]1CC[C@H]1CC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333819 BOODSFDCAJSILX-ZRUFSTJUSA-N 252.318 2.149 10 10 CECE CSc1ncc(CNCCC[C@H]2C[C@H]2C(=O)O)s1 2315740451 GDEVATFIUOCVLD-WCBMZHEXSA-N 286.422 2.456 10 10 CECE OC[C@@H]1C[C@H]2CC[C@@H]1N2c1ccc2c(c1)CC[C@@H]2O 2331551599 NUMBMOLXFAAFSK-YOENINGUSA-N 259.349 2.016 10 10 CECE C[C@@H](c1ccccc1O)N1[C@H]2CC[C@H](C2)[C@H]1C(=O)O 2332932413 YTRIZJXCORAZSQ-MIJXAVMKSA-N 261.321 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DHVYVBIXRZKNLQ-BBRMVZONSA-N 279.380 2.141 10 10 CECE COc1ccc(N2CC[C@@H](O)C[C@@H]2CO)cc1C(C)C 2235143124 KVIRETNWENMGDG-ZIAGYGMSSA-N 279.380 2.141 10 10 CECE O[C@@H]1CN(c2ccc3c(c2)OCCCO3)C2(CCC2)C1 2235123998 GURKQJUVTXKEGP-ZDUSSCGKSA-N 275.348 2.342 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)[C@H]1CC2(CCC2)CO1 2225795147 LFFOSXUUOABPBA-GMTAPVOTSA-N 264.329 2.293 10 10 CECE COc1ccc(N2C[C@@H](O)C2(C)C)c(CNC(C)C)c1 2235963386 MOVXOLSTTBHHIK-OAHLLOKOSA-N 278.396 2.153 10 10 CECE CCNCc1cc(OC)ccc1N1CCCOC[C@H]1C 2235954068 JSLNGNJIELNJPB-CYBMUJFWSA-N 278.396 2.420 10 10 CECE CCC[C@@H]1COCCN1c1ccc(OC)cc1CNC 2235953572 CLNAAYANNCIIAP-CQSZACIVSA-N 278.396 2.420 10 10 CECE COc1ccc(N2CC[C@H](OC)[C@H]2C2CC2)c(CO)c1 2235964575 UAVABXQINDMDBD-JKSUJKDBSA-N 277.364 2.191 10 10 CECE COc1ccc(N2CCC[C@H](CO)CC2)c(OC)c1 2226803734 DGIIHPWAJOKDHO-LBPRGKRZSA-N 265.353 2.303 10 10 CECE COc1ccc(N2C[C@@H](O)[C@H](C3CC3)C2)c(F)c1F 2226925320 SECVGTFGRAFJBB-GXSJLCMTSA-N 269.291 2.181 10 10 CECE CC(C)[C@@H](N)CCCC(=O)NCc1ccccc1O 2227070290 CXGAAJFTXMMPTI-ZDUSSCGKSA-N 264.369 2.162 10 10 CECE COc1ccc(N2CC3(CC(F)C3)C2)c(CCN)c1 2227688882 WUXRYUBWYXXJBQ-UHFFFAOYSA-N 264.344 2.135 10 10 CECE COc1ccc(N(C)CC[C@@H](C)OC)c(C(=O)O)c1 2227669524 DBXOHWIDQMYLQX-SNVBAGLBSA-N 267.325 2.255 10 10 CECE COc1ccc(N2CC(C)(C3CC3)C2)c(CCN)c1 2227684549 WMNQGNNDWRNVDZ-UHFFFAOYSA-N 260.381 2.433 10 10 CECE CCN(C[C@H]1CCOC1)c1ccc(OC)cc1CN 2227686153 PDDUVMUOSUUIRY-GFCCVEGCSA-N 264.369 2.017 10 10 CECE Cc1cc(C(=O)N2CCC(N=[N+]=[N-])CC2)cc(O)n1 2227789253 NLMJHFLEICFZRA-UHFFFAOYSA-N 261.285 2.011 10 10 CECE COc1ccc(N2CCC[C@@H](OC)[C@@H]2C)c(CO)c1 2227712439 ZKKJABHISVALDW-XHDPSFHLSA-N 265.353 2.191 10 10 CECE COc1ccc(N2C[C@@H](CCO)C(C)(C)C2)c(C=O)c1 2238455145 UQASVXDRXLDUMK-CYBMUJFWSA-N 277.364 2.353 10 10 CECE CC[C@H](CC(F)F)Cn1ccc2c(c1=O)CNCC2 2228432699 ZYYZLRODIRPWGI-SNVBAGLBSA-N 270.323 2.175 10 10 CECE Cc1cc(N2CC([S@@](C)=O)C2)ccc1CNC1CCC1 2240044235 SIHSFPVFQGAYIX-HXUWFJFHSA-N 292.448 2.204 10 10 CECE CCOC[C@H]1CN(c2ccc([C@H](C)N)cc2C)CCO1 2240744315 PYQQZCQCOFLODQ-DZGCQCFKSA-N 278.396 2.256 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)[C@@H]1CCC(=O)N(C)C1 2240835332 BPXYYFFZGUMGGN-TZMCWYRMSA-N 275.396 2.072 10 10 CECE CNC(=O)[C@@H]1CCCN(c2ccc([C@@H](C)O)cc2C)C1 2240834533 ATKIWPZIVYTFPN-TZMCWYRMSA-N 276.380 2.011 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)O)c(C)c2)C[C@@H]1F 2257464574 NBPCGJAKKVVUIA-BPNCWPANSA-N 253.317 2.221 10 10 CECE CSc1ncc(CNC[C@H]2CCC[C@@H](N)C2)s1 2248728375 KICQRWFXQRHJJW-VHSXEESVSA-N 271.455 2.472 10 10 CECE CSc1ncc(CNC[C@@H](N)C2CCCC2)s1 2248734180 JUEAMKLWKRCUSP-LLVKDONJSA-N 271.455 2.472 10 10 CECE CC1(C)[C@H]2CO[C@@]1(CNCc1ccc(O)c(O)c1)C2 2273308065 MOIROLNCDHJDHN-IAQYHMDHSA-N 263.337 2.003 10 10 CECE C[C@]1(CN)CCN(c2ccc(OC(F)F)cc2)C1 2263918841 PAKCSFOUYSXJKB-CYBMUJFWSA-N 256.296 2.463 10 10 CECE C[C@@H]1C[C@H]1CCCCn1ccc2c(c1=O)CNCC2 2265785623 PUIRCENQKYOJNK-TZMCWYRMSA-N 260.381 2.320 10 10 CECE Cc1cc(F)cnc1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2266440711 OJYWRXYDILGCBN-JTQLQIEISA-N 263.276 2.444 10 10 CECE CN1CCCc2cc(CNCC[C@H]3CCO3)ccc21 2278592523 UTRZXYKSNSPWNO-HNNXBMFYSA-N 260.381 2.338 10 10 CECE COc1ccc(N2CC3(CC[C@@H]3O)C2)c2c1CCC2 2269171114 IKVCFEDTCWJFPM-HNNXBMFYSA-N 259.349 2.145 10 10 CECE Cc1cc(N2CC[C@H](C)[C@@H](CO)C2)ccc1[C@H](C)N 2269651121 HMZAJVNMKGTYBI-FPMFFAJLSA-N 262.397 2.469 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@](CF)(C(=O)O)C1 2281246297 MESGMKDYXCZTNT-YMTOWFKASA-N 285.290 2.339 10 10 CECE CN[C@H](C)c1ccc(N2CC(F)(F)C[C@H]2CO)cc1C 2285144760 WMRQOIQTHBGBHR-YPMHNXCESA-N 284.350 2.482 10 10 CECE COc1cc(OC)c(N2CCCC[C@H](N)C2)cc1OC 2289361999 HYYDHTOHSNYLCC-NSHDSACASA-N 280.368 2.030 10 10 CECE CN(Nc1nc2cc(Cl)ccc2s1)S(C)(=O)=O 2301528273 JLJIVXXOHCCSKE-UHFFFAOYSA-N 291.785 2.168 10 10 CECE CNCc1ccc(N(C)[C@@H](C)CN(C)C)cc1Cl 2326780173 TXGRXTYIWDEEOB-NSHDSACASA-N 269.820 2.446 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1[C@H]2CC[C@@H]1C[C@H]2CN 2330484104 KXXOPJLKGPJUSX-XVMOGABASA-N 264.344 2.404 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CCCO3)[C@@H]2CC[C@H]12 2333684697 DJWYBLLYOIBAOD-ZNMIVQPWSA-N 259.349 2.361 10 10 CECE CCc1nnsc1CNCc1cccc(OC)c1O 2336010631 VFJXZLJYVMPDGR-UHFFFAOYSA-N 279.365 2.105 10 10 CECE NCc1ccc(N2CCOC[C@H]2CF)cc1C1CC1 2339158299 UJZKUUBSOKEOSU-CQSZACIVSA-N 264.344 2.197 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC3(CC[C@H]3O)C2)c1C 2340850181 DTJGQYSLDDAFSO-IUODEOHRSA-N 261.365 2.318 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[S@](=O)C[C@@H]2C)c1C 2340852705 ZPRRFTVQXPLFRF-JXBWDGJFSA-N 280.437 2.280 10 10 CECE COc1cc(Cl)c(N2C[C@@H](F)C[C@@H]2CN)c(OC)c1 2342300202 NZEMUBCBJDNJES-DTWKUNHWSA-N 288.750 2.233 10 10 CECE COc1cc(Cl)c(N2CC[C@H](O)[C@H](F)C2)c(OC)c1 2342416433 GYNDQNNIOXPMRS-MNOVXSKESA-N 289.734 2.266 10 10 CECE COc1ccc(CO)cc1OCc1ccc(N)cc1 2345129482 ULSFRISWPLZZGL-UHFFFAOYSA-N 259.305 2.349 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3[C@@H]4CC[C@H]3NC4)ccc21 2354644950 AIHRSYXJHDOFRA-SRABZTEZSA-N 272.392 2.100 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@@H]2C[C@H]1C[C@]2(C)O 2355729161 LVZDUEAUBAYBSI-NLZNIHBBSA-N 277.364 2.040 10 10 CECE NC1C[C@@H]2CC[C@@H](C1)N2c1ccc2c(c1)OC(F)(F)O2 107907836 UADGTIPKVJUNDB-UWVGGRQHSA-N 282.290 2.467 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]3CC[C@@H]2C3)c1 104562038 FSEIZOXYKWQUQK-BREBYQMCSA-N 260.337 2.027 10 10 CECE Nc1ccc(NC(=O)CSc2nnc3ccccn23)cc1 61405701 BILLCEFRKDLKCL-UHFFFAOYSA-N 299.359 2.042 10 10 CECE CN1CC[C@H](NCc2cc(Cl)cc(Cl)c2O)C1=O 120549233 OEQVSHDOKRDVPJ-JTQLQIEISA-N 289.162 2.019 10 10 CECE CCC(CC)NC(=O)c1ccn(-c2ccc(N)cc2)n1 35427784 VPMFGEAHQYNDEC-UHFFFAOYSA-N 272.352 2.373 10 10 CECE C[C@H]1CO[C@H](C)CN1c1ccc(CN)cc1Cl 219394582 WKQPANFDMVEKAX-VHSXEESVSA-N 254.761 2.412 10 10 CECE CN(C)c1ccc(CNC(=O)c2cnccc2N(C)C)cc1 183476647 FSYLXEMPBMSKJK-UHFFFAOYSA-N 298.390 2.144 10 10 CECE O=C(Nc1ccsc1C(=O)O)c1cccc(O)c1O 125988239 APPCLCRYHAQSAG-UHFFFAOYSA-N 279.273 2.110 10 10 CECE COc1cc(O)c([C@@H](C)N)c(F)c1Br 218178785 JFMQXNKJYZSTTE-SCSAIBSYSA-N 264.094 2.322 10 10 CECE COc1ccc(CNCCOCC(C)C)c(O)c1 134229122 BYGOVWXHSZSOQH-UHFFFAOYSA-N 253.342 2.163 10 10 CECE CCOC(=O)c1coc(N(CC)Cc2ccc(N)cc2)n1 228328958 VCBUDFADMYLERT-UHFFFAOYSA-N 289.335 2.460 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CCC[C@@H]1C(=O)O 86726493 AUOJQWUQEGVDMD-BXUZGUMPSA-N 262.353 2.363 10 10 CECE CCC[C@@H]1CN(c2ccc3c(c2)OCCO3)CCN1 86124469 LYAMOYFGBKBFMT-GFCCVEGCSA-N 262.353 2.036 10 10 CECE CN1CCC[C@@H]2CN(CCOc3ccc(N)cc3)CC[C@H]21 227328010 UVBPOONREWLXCR-RHSMWYFYSA-N 289.423 2.064 10 10 CECE COc1cc(Cl)cc(CNCc2cn[nH]c2)c1O 229051158 XPQPMIRATYJYSH-UHFFFAOYSA-N 267.716 2.067 10 10 CECE Fc1cc(OCC[C@@H]2CCCO2)ccc1N1CCNCC1 87439226 OXUHPDWMPJYTDM-ZDUSSCGKSA-N 294.370 2.183 10 10 CECE N[C@@]1(c2ccc(N3CCOCC3)cc2)CC=CCC1 1952496569 WVILMRRHNBVJOW-INIZCTEOSA-N 258.365 2.417 10 10 CECE CCN(CC)C(=O)C[C@H](C)NCc1cc(OC)ccc1O 89725839 KRCBTWKWXLHFGS-LBPRGKRZSA-N 294.395 2.137 10 10 CECE CC(C)(CCCO)CNCc1cccc(F)c1O 226618720 IPDYKBSOCSAYLO-UHFFFAOYSA-N 255.333 2.420 10 10 CECE CN1C(=O)/C(=C/c2cc(C#N)n(C)c2)c2ccccc21 190237278 UHYZDUHNMXSRKT-RIYZIHGNSA-N 263.300 2.414 10 10 CECE CN(C)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 194232454 DPIDTURIWCHQBN-CYBMUJFWSA-N 278.352 2.055 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@](C)(O)C2)c(F)c1 234455771 NAZYLMYEORTKEL-IINYFYTJSA-N 252.333 2.067 10 10 CECE CC[C@@H]1CCC[C@](NCCN=[N+]=[N-])(C(=O)OC)C1 90256839 YOVUICNURCZGSP-ZYHUDNBSSA-N 254.334 2.398 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCC[C@H](CN)C1 94621885 ALKNHEGKYZPTTO-WDEREUQCSA-N 252.333 2.263 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1ccsc1 90259380 WOXBPGVNAKYSBK-SECBINFHSA-N 254.315 2.252 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N(C)C[C@H]1CNCCO1 250990552 YOQOUJVTXAATDD-MCIONIFRSA-N 290.407 2.169 10 10 CECE CC[C@@H]1[C@H]2CNC[C@H]2CN1c1ccc(OC)cc1[N+](=O)[O-] 251603755 KPAHNRLYMYQXKM-WCFLWFBJSA-N 291.351 2.038 10 10 CECE Nc1ccc(OCCC(=O)OCC2CCOCC2)cc1 52146657 MKPFQXOYYSWHNX-UHFFFAOYSA-N 279.336 2.008 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N1CCO[C@H]([C@H](C)N)C1 252692085 ZYDGHUJEMKIXRX-OSFYFWSMSA-N 290.407 2.297 10 10 CECE CCOc1cccc(CN2C[C@H]3CNC[C@H]3C2(C)C)c1O 250502711 AOVSKIQFTUOLPN-ZIAGYGMSSA-N 290.407 2.221 10 10 CECE C[C@H](N)Cc1ccc2ccn(CO[C@H]3CCOC3)c2c1 383626251 WWFPYIZIBUNBLG-WFASDCNBSA-N 274.364 2.294 10 10 CECE CNCc1cc(F)c(N2CCCC[C@@]2(C)CO)c(F)c1 722968743 IWMOKTWHXQLNOD-HNNXBMFYSA-N 284.350 2.426 10 10 CECE CNCc1ccc(N2CCN(C3CCC3)CC2)c(F)c1 381017192 BATNQLVCQUVIRJ-UHFFFAOYSA-N 277.387 2.220 10 10 CECE CCN1CCc2cc([C@]3(O)CCN(C4CC4)C3)ccc21 2163076490 OARNNITUOOJEOW-KRWDZBQOSA-N 272.392 2.125 10 10 CECE CN1CCCc2cc(N3CC[C@H]4NCC[C@@H]4C3)ccc21 2163101697 DHZPMMQBBOKHSM-GDBMZVCRSA-N 271.408 2.257 10 10 CECE CN1CCCc2cc([C@H](N)[C@H]3[C@H]4COCC[C@@H]43)ccc21 2163106794 LNGIJVBZQPWSRB-DIECFANBSA-N 272.392 2.351 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2OCC[C@H]2C)cc1 2163152194 QPDYNSGMGVSYQZ-UHOFOFEASA-N 277.412 2.462 10 10 CECE Nc1ccc(N2C(=O)NCCC3(CCCC3)C2=O)cc1 2163223051 HBPUYYAVRXLNSH-UHFFFAOYSA-N 273.336 2.276 10 10 CECE COc1ccc(N(C)[C@@H]2CNCC[C@@H]2C)c([N+](=O)[O-])c1 2163611253 BNVPPZFOQPWHNF-IINYFYTJSA-N 279.340 2.038 10 10 CECE COCC1(N(C)c2ccc(/C=C/C(=O)O)cc2)CC1 706357234 PARPSZTUSNFDTM-VMPITWQZSA-N 261.321 2.400 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(Br)cc1C 808505894 DEEZVIOSDIUOFX-UHFFFAOYSA-N 299.120 2.072 10 10 CECE CCN(CC)c1ccc([C@@H](N)[C@H](O)c2cnsn2)cc1 2167134600 WKOYANGGMBYIJG-ZIAGYGMSSA-N 292.408 2.118 10 10 CECE CCOc1ccc(N2C[C@H]3CC[C@]3(N)C2)cc1OCC 2162662865 VMYHAXBUYOYREH-WBMJQRKESA-N 276.380 2.412 10 10 CECE CN(Cc1ccccc1C(=O)O)c1ccc(CN)cc1 2162690808 NHUFZRQEYXBUOF-UHFFFAOYSA-N 270.332 2.480 10 10 CECE C[C@H](N[C@@H]1CCNC[C@@H]1C)c1ccc(N(C)C)cc1 817972402 WVJRJMVXTJUGLR-HEHGZKQESA-N 261.413 2.401 10 10 CECE Cc1cc(N(C)C)ccc1CNC[C@]1(O)C[C@H]2C=C[C@H]1C2 827190558 WSPPPHQNXNEZSG-QILLFSRXSA-N 286.419 2.478 10 10 CECE COc1c([N+](=O)[O-])ccc(CN[C@@H]2[C@H]3CCC[C@H]32)c1O 827480296 AMJIQEABOCKFNB-IAZYJMLFSA-N 278.308 2.197 10 10 CECE COc1cc(CN(C)CCOc2ccc(N)cc2)sn1 722401608 YIVPQCXBYKQYRW-UHFFFAOYSA-N 293.392 2.245 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@@H]2[C@H](C(=O)O)[C@@H]2C1 721195868 WGUKTKHFJGIVQN-HIPMNCMDSA-N 279.311 2.245 10 10 CECE COc1cccc(O)c1CN1CCC[C@@](O)(C2CC2)C1 827151752 IZZNVUQSEZQZRZ-INIZCTEOSA-N 277.364 2.138 10 10 CECE CCc1cccc(CN2C[C@H](C)C(O)[C@@H](C)C2)c1O 827147212 NXOGNNZGBBOLSF-RYUDHWBXSA-N 263.381 2.403 10 10 CECE CN(C)c1ccc(/C=C/CNCc2cc[nH]n2)cc1 835036254 NWTUTZUGKZFXJR-ONEGZZNKSA-N 256.353 2.279 10 10 CECE COc1ccc2c(c1)c1c(n2CC(=O)N(C)C#N)CCCC1 593137374 YFOVJODMOMZJJB-UHFFFAOYSA-N 297.358 2.468 10 10 CECE C[C@]1(O)C[C@@H](NCc2c(O)ccc(Cl)c2F)C1 841891983 ROFHPZMFLBWHQK-OGXFKERWSA-N 259.708 2.188 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@H]2C[C@]23CCCOC3)CC1 1894279139 MIPDDMFEPHCLES-MFKMUULPSA-N 264.329 2.010 10 10 CECE N[C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2ccccc2O)C1 844909977 FWWXHOBGLXYQRJ-VYDXJSESSA-N 290.407 2.253 10 10 CECE CO[C@@H]1CCC[C@H]1N(C)CCOc1ccc(N)cc1 687438570 RWEZRWVSWXSPQA-HUUCEWRRSA-N 264.369 2.147 10 10 CECE CCCN1CCN([C@@H](C)c2ccc(OC)cc2O)CC1 131689450 FNKNYYBYZBVMMT-ZDUSSCGKSA-N 278.396 2.489 10 10 CECE CC(=O)c1cc(Cl)cc(CN[C@H](CO)C2CCC2)c1O 852321080 QWKZABGQSVUIFP-CQSZACIVSA-N 297.782 2.499 10 10 CECE C[C@@H]1C[C@H]1NC(=N)NCc1ccc2c(c1)CCCN2C 864457806 UZCSHDRFYJGLAO-BXUZGUMPSA-N 272.396 2.091 10 10 CECE C[C@@H]1COCCCN1Cc1cc2c(cc1O)CCC2 772821718 NQSMYQDELLJPGU-GFCCVEGCSA-N 261.365 2.492 10 10 CECE C[C@@H]1CC[C@H](NC(=O)C(F)(F)F)CN1CCCN=[N+]=[N-] 1957243998 KVTAHFQHDAWZBI-BDAKNGLRSA-N 293.293 2.218 10 10 CECE Nc1ccc(OCCCN2C(=O)CNc3ccccc32)cc1 76887743 AWNWUVHHSNKITD-UHFFFAOYSA-N 297.358 2.496 10 10 CECE Oc1cc2c(c(O)c1O)CCN[C@H]2c1cccc(F)c1 83658244 CVVAUYAFYZFJLP-ZDUSSCGKSA-N 275.279 2.178 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC([C@H](C)O)C1 719783257 HGPAUYARXKLHSK-LBPRGKRZSA-N 260.381 2.064 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCC[C@H](F)C2)cc1 689480862 LYKLIJUMRORWCJ-ZFWWWQNUSA-N 265.376 2.186 10 10 CECE CC(C)(C)OC(=O)N1CC(CNCc2ccccc2O)C1 397742915 JEMZXVRYUPUZFV-UHFFFAOYSA-N 292.379 2.349 10 10 CECE CCc1nnc(COC(=O)CCc2ccc(N)cc2)s1 702697037 ZMSSDQCUZIDXML-UHFFFAOYSA-N 291.376 2.359 10 10 CECE Cc1cc(N(C)[C@H](C)c2cn(C)cn2)ccc1CO 710530744 JPAKAVKGNWDJPF-GFCCVEGCSA-N 259.353 2.418 10 10 CECE CC1(C)CC[C@H](CNC(=O)c2cccc(O)c2O)OC1 711237215 KHKJKSOVARMYCN-SNVBAGLBSA-N 279.336 2.033 10 10 CECE CNCc1ccc(N2CCC[C@H]([C@H](C)O)C2)cc1C 688964312 RLHDTUNMQIJDFK-ZFWWWQNUSA-N 262.397 2.312 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H]1CCSC1 718290695 GHXJKLLPLOKSBP-GFCCVEGCSA-N 266.410 2.333 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@H]1CCCS1 718265317 TVAMUSPVBHWBKJ-BXUZGUMPSA-N 293.436 2.423 10 10 CECE CSC[C@@H](C)CNC(=O)CCOc1ccc(N)cc1 69427401 MOGKICCTIITUFG-NSHDSACASA-N 282.409 2.153 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@H]1CCCSCC1 692358360 WZZZLCLATTZBOG-JTQLQIEISA-N 281.377 2.456 10 10 CECE Nc1ccc(-n2ccc(C(=O)OCCC3CC3)n2)cc1 88493315 ISWCPLRFVRPCES-UHFFFAOYSA-N 271.320 2.411 10 10 CECE C[C@@H](NCC(C)(C)S(C)(=O)=O)c1ccc(F)cc1O 93520407 VMPMIKPHGDWUEK-SECBINFHSA-N 289.372 2.005 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)c(O)c2)CC(C)(C)O1 93671294 DXYSKWCPWORUBC-WDEREUQCSA-N 264.369 2.416 10 10 CECE C[C@@H](NC(=O)c1nnc2ccccc2n1)c1ccccc1O 1302532938 VSSMTLZLTFFGSJ-SNVBAGLBSA-N 294.314 2.221 10 10 CECE CCO[C@@]1(C)C[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1301057487 DORAJVVXVUPGLQ-RISCZKNCSA-N 290.323 2.146 10 10 CECE COc1ccc(CNC[C@@]2(C)CCCCO2)c(O)c1 1659583819 ONUMTRZZGZRMIS-OAHLLOKOSA-N 265.353 2.450 10 10 CECE C[C@H]1CN(c2cc(Cl)c(CN)cc2F)C[C@H]1N(C)C 2120880833 FJSRULCLTFDKRQ-LKFCYVNXSA-N 285.794 2.324 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(Cc2cc(CO)on2)C1 2125444908 PRMRBFIVTQLAAM-JTQLQIEISA-N 265.317 2.079 10 10 CECE CCN(c1ccc2c(c1)CC[C@H]2NC)C(C)(C)CO 2128296922 IUVAWAAWMQVLNL-OAHLLOKOSA-N 262.397 2.491 10 10 CECE C[C@@H]1CN(C)CCN(c2ccc3c(c2)CC[C@H]3N)C1 2128315530 SUDVWTANCCDUJO-MLGOLLRUSA-N 259.397 2.021 10 10 CECE CC(C)[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3N)CCO1 2128326965 CMMHRXUHJJAFPL-HOTGVXAUSA-N 260.381 2.494 10 10 CECE CC[C@@](C)(COC)NC(=O)CCc1ccc(N)cc1 2131087126 SWJJIUSAHFKYKP-HNNXBMFYSA-N 264.369 2.133 10 10 CECE CNCc1ccc(N2C[C@H]3COC[C@@H](C3)C2)c(F)c1 2132519571 KONOBSQACDGQFQ-STQMWFEESA-N 264.344 2.018 10 10 CECE CC[C@@H](C)NC(=O)NCc1cnc(SC)s1 2243809944 FTXCJNJMYFDSDY-SSDOTTSWSA-N 259.400 2.463 10 10 CECE CCOC(=O)C1(NCCN=[N+]=[N-])CC2(C1)CC2(F)F 2131189916 LPUAOYXDACVOHX-UHFFFAOYSA-N 274.271 2.007 10 10 CECE CCC[C@@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)CO1 2129161812 MZGQGLHAGWWECX-CHWSQXEVSA-N 263.341 2.348 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)NC1CCSCC1 2254177354 NZYKFDKQLRYNKD-SNVBAGLBSA-N 269.374 2.366 10 10 CECE O=C(CN1CC[C@H]2CC[C@@H]2C1)c1ccc(O)c(O)c1 2131874358 LEXJRAYJWHYNON-ZYHUDNBSSA-N 261.321 2.012 10 10 CECE CN(C[C@H]1CC12CC2)c1ccc(CO)c([N+](=O)[O-])c1 2132058559 QKGPIVXIFNDODN-LLVKDONJSA-N 262.309 2.323 10 10 CECE CCc1cccc(CN[C@@H]2CC[C@H]3C[C@]32CO)c1O 2132154411 DLFJVUJBWFKWME-LZWOXQAQSA-N 261.365 2.205 10 10 CECE CC(C)N(CC1[C@@H]2COC[C@@H]12)c1ccc(CN)cc1 2132396856 JKFAJMIQNXYCQF-HOTGVXAUSA-N 260.381 2.253 10 10 CECE Oc1ccc([C@H](O)CNCc2cc(F)ccc2O)cc1 1912675604 DYWUZHGGGCRQCG-OAHLLOKOSA-N 277.295 2.060 10 10 CECE CN(C)c1ccc([C@@H](N)[C@]2(O)CCC3(CC3)C2)cc1 1906316415 NTXRQCRFUPYAEF-ZBFHGGJFSA-N 260.381 2.448 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1ccc(Br)o1 1912175567 NMBXMKXLOYTOGY-UHFFFAOYSA-N 273.090 2.424 10 10 CECE COC(=O)[C@](C)(CCC(F)(F)F)NCCN=[N+]=[N-] 1912172172 CFHIPKGRZKVMJW-QMMMGPOBSA-N 268.239 2.161 10 10 CECE CC1(C)C[C@@H](CCN2CCC(CN=[N+]=[N-])CC2)C(=O)N1 1912155824 MJSZQTLNKDNMOD-GFCCVEGCSA-N 279.388 2.314 10 10 CECE Cc1ccccc1NC(=O)CN1CC[C@@H](N=[N+]=[N-])C1 1912197330 RWWHVGNHVHVVFK-LLVKDONJSA-N 259.313 2.318 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(S(=O)(=O)C2CC3(CC3)C2)C1 1912176325 XPIWNDYUERPGKC-JTQLQIEISA-N 284.385 2.281 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)C[C@@H]1CN2CCC1CC2 1912173754 QGLBMOOJGNZRAX-CHWSQXEVSA-N 277.372 2.020 10 10 CECE [N-]=[N+]=NCCCNC(=O)[C@@H]1CC[C@H]2[C@H](C1)C2(F)F 1912207236 NEGXVKZWVVIOQS-VGMNWLOBSA-N 258.272 2.484 10 10 CECE OCc1ccc(N2[C@H]3CC[C@H]2[C@H](F)[C@H](O)C3)c(Cl)c1 2134130833 BPYDKRHXOYXWTD-WTDIUWLJSA-N 285.746 2.272 10 10 CECE C[C@H](CS(=O)(=O)N1CC(N=[N+]=[N-])C1)c1ccccc1 1912205163 DNUOPDRKJMNPIV-SNVBAGLBSA-N 280.353 2.114 10 10 CECE CC[C@H]1C[C@@H]1CN(C)CC(=O)c1ccc(O)c(O)c1 2135293456 PPOCSTZZVCAWBF-CMPLNLGQSA-N 263.337 2.258 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2CC(N)C3)c(OC)c1 107908032 GFBYNBPWIUMYEC-RYUDHWBXSA-N 262.353 2.162 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C23CCC3)c(F)c1 1914400855 AKQNZIPVRQLTMT-HNNXBMFYSA-N 278.371 2.429 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC4(C3)CC4(F)F)c(Cl)cc21 1914924709 VXNMEVXLJHHZRB-JTQLQIEISA-N 299.708 2.137 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1CC12CCCC2 1456235178 MBPPQYAQIWTZCB-NSHDSACASA-N 261.321 2.294 10 10 CECE CC[C@@H]1CN(CCCOc2ccc(N)cc2)CCN1C 110703497 YFHMINSUQCTBHB-OAHLLOKOSA-N 277.412 2.064 10 10 CECE CCN[C@@H](CC)c1ccc(N(C)[C@@H](C)C(=O)NC)cc1 1916818924 QWUFQARRZXPRBQ-WFASDCNBSA-N 277.412 2.318 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCC[C@]23CCNC3)cc1 1918247672 BUEVCUHUBDZEPO-IAGOWNOFSA-N 273.424 2.374 10 10 CECE Cc1cc(N2CC[C@@H](C)[C@@H]2CO)ccc1CNC1CC1 227062154 DSIGTQLPGBYSNZ-PXAZEXFGSA-N 274.408 2.454 10 10 CECE O=C(c1ccc2cccnc2n1)N1Cc2cccc(O)c2C1 1558035894 PIUPZSHCQXJMMF-UHFFFAOYSA-N 291.310 2.491 10 10 CECE CC1(C)C[C@@H](O)CN(c2ccc(CN)c(F)c2F)C1 1923154185 WMKGXHTZDFSARA-SNVBAGLBSA-N 270.323 2.021 10 10 CECE CON(C)c1nnc(C)n1CCCSc1nccs1 1555760546 QDVUFDMACCHTRN-UHFFFAOYSA-N 299.425 2.223 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)N1Cc2ccc(O)cc2C1 1557561096 DQCXGSJVJCBGTM-KXFIGUGUSA-N 297.310 2.359 10 10 CECE CSc1ncc(CNCC2(CC(=N)NO)CC2)s1 2257087370 WQNSSHSSZFKTMV-UHFFFAOYSA-N 286.426 2.081 10 10 CECE COc1ccc(N(C)[C@@H]2CNC[C@@]3(CCCO3)C2)cc1 1924313268 NXRHODFEQQQAJK-GOEBONIOSA-N 276.380 2.043 10 10 CECE Cc1cccc(O)c1C(=O)NCc1c(O)cccc1F 1635366990 USAAPLAFPDSIJX-UHFFFAOYSA-N 275.279 2.475 10 10 CECE O=C1C[C@@H](C(=O)NCc2c(O)cccc2O)c2ccccc21 1639292548 HIYJHQOYNIIGGT-GFCCVEGCSA-N 297.310 2.084 10 10 CECE Cn1ccc(C(=O)NCc2c(O)ccc3ccccc23)n1 1652705969 SBRSYHDWYXBDLE-UHFFFAOYSA-N 281.315 2.209 10 10 CECE CCNC(=O)CN(C)c1ccc2c(c1)CC[C@H](C)N2 122969964 ORWUEDNYIWTLIM-NSHDSACASA-N 261.369 2.006 10 10 CECE CCOC[C@@H]1CCCN1c1ccc(CN)c(OC)c1 2139682223 DZJRQTKFZCPJTJ-AWEZNQCLSA-N 264.369 2.159 10 10 CECE COCCC1(C(=O)NCc2cccc(C)c2O)CC1 2139757058 CUJGGDJQCYPHBD-UHFFFAOYSA-N 263.337 2.134 10 10 CECE CC(C)[C@@H](C)[S@@](=O)CCC(=O)Nc1ccc(N)cc1 232684519 LVYKWPSQQVOVIT-WYRIXSBYSA-N 282.409 2.391 10 10 CECE COCCN[C@@H](c1ccccc1)c1ccc(O)c(O)c1O 19881657 DXNNSOTYGUTQFC-AWEZNQCLSA-N 289.331 2.129 10 10 CECE CCC[C@H]1CN(c2ccc(CNC)cc2)C[C@H]1CO 2140881010 FGFDHSCTJIJJNP-GJZGRUSLSA-N 262.397 2.251 10 10 CECE CCCCC[S@@](=O)CC(=O)N(C)c1ccc(N)cc1 232956025 YVRTVFSPEZYIML-LJQANCHMSA-N 282.409 2.171 10 10 CECE CC[C@@H]1OCC[C@@H]1CNCc1cccc(OC)c1O 233916415 ZRKUIMUMTOIHEE-YPMHNXCESA-N 265.353 2.306 10 10 CECE CN(C)c1ccc(CN2CCC[C@]3(CCNC3)C2)cc1 843123474 JZSWGZIGMXROMT-QGZVFWFLSA-N 273.424 2.328 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)cc2Cl)C[C@H]1OC 234989460 QGRSFUZXCNWBNL-QCZZGDTMSA-N 284.787 2.210 10 10 CECE Cc1cccc(CNC[C@@H]2C[C@H](O)C23CCC3)c1O 1875443753 NPVHVOOETRDHGS-KBPBESRZSA-N 261.365 2.341 10 10 CECE COc1ccc(N(CCCN)C[C@@H]2C[C@@H]2CF)cc1 1875927160 HOUFJHQCVZYNPN-OLZOCXBDSA-N 266.360 2.456 10 10 CECE Cc1cc(CNC(C)C)ccc1N1[C@H]2COC[C@H]1C2 1899653934 MEDDXTOOQITCMZ-HUUCEWRRSA-N 260.381 2.471 10 10 CECE CN(c1ccc(CO)cc1F)[C@@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]([C@H]23)[C@@H]41 2143327614 PECSKZYGBYLDLC-ZHBACIFWSA-N 259.324 2.265 10 10 CECE C[C@H]1[C@@H](N(C)c2ccc(CN)cc2)C2CCN1CC2 1877871841 KTZLRYVJMUMVAA-BLLLJJGKSA-N 259.397 2.064 10 10 CECE CN(CCNCc1ccc2c(c1)CCO2)C(C)(C)C 1878918288 HDHXAFHIJSZMDC-UHFFFAOYSA-N 262.397 2.441 10 10 CECE CCCN(CCN(C)C1CC1)c1ccc(CN)cc1 1879258275 HHQHISBINMYOPK-UHFFFAOYSA-N 261.413 2.456 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@H](CO)[C@H]2C)c(F)c1 1880488243 VAGIIXYUKNJDTG-UTLUCORTSA-N 271.307 2.225 10 10 CECE C[C@@H](O)CN(c1c(F)cc([C@@H](C)O)cc1F)C1CC1 1880479964 RTTQIJJPLDXAQC-RKDXNWHRSA-N 271.307 2.368 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCC[C@H](O)[C@H]2C)c(F)c1 1880923234 FVUDRXFJBVWJII-KKFJDGPESA-N 270.323 2.334 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)CCCC(=O)N(C)C 2143696438 AYSQGJNDKNEPIQ-NSHDSACASA-N 282.359 2.393 10 10 CECE CC1(C)CN(Cc2ccc(Cl)cc2O)[C@H](C(=O)O)CO1 1962972396 OYZWTAIBMQRXHP-NSHDSACASA-N 299.754 2.110 10 10 CECE CC(C)(C)OC(=O)N1CC(F)([C@@H](N)c2ccccc2O)C1 1885120617 IUVFDSVLBITNPP-LBPRGKRZSA-N 296.342 2.351 10 10 CECE NCc1ccc(N2CC[C@H](c3nncs3)C2)c(F)c1 1886549289 ILAKNDFMPIWADG-JTQLQIEISA-N 278.356 2.130 10 10 CECE CN1CCC[C@@H](CNCc2ccc(Cl)cc2O)C1 1964044254 YFHZMVQDBAJVGD-NSHDSACASA-N 268.788 2.477 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)C(C)(C)[C@H]1CCCO1 2151473567 MQHRMYNTZIUOBR-KFWWJZLASA-N 279.380 2.219 10 10 CECE Nc1ccc(OCc2cn(C[C@@H]3CC3(F)F)nn2)cc1 1964702671 SWNCHJPJNPGULJ-VIFPVBQESA-N 280.278 2.095 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)c1ccc(F)cc1 20374284 VAFIABCDEMDEHK-UHFFFAOYSA-N 280.324 2.233 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H]2CCN(C)C2)cc1O 251495715 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[N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2OC[C@@H]3CCCC[C@H]32)C1 2233192127 VAQBPPZNEIGTRM-UMSGYPCISA-N 278.356 2.493 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)[C@@H]2OC[C@@H]3CCCC[C@H]32)C1 2233192099 VACGNHBQKACDLK-WUHRBBMRSA-N 278.356 2.350 10 10 CECE CCc1nn[nH]c1CN[C@H](C)c1ccc(C)cc1O 2274592828 YJUCTRIGKULOGM-SNVBAGLBSA-N 260.341 2.232 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 2234173554 YGLLQFWJAMMQPJ-CHWFTXMASA-N 278.312 2.001 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCN1CCCO1 2234117919 HGAUKZVIFRFMPD-STQMWFEESA-N 276.380 2.476 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)CC2(C(=O)O)CCCC2)C1 2234171985 QEUNIRFHICLJMS-SNVBAGLBSA-N 280.328 2.180 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)[C@H]2CCCC[C@H]2C(=O)O)C1 2234172003 QIRIQYUZMIVCNE-GARJFASQSA-N 280.328 2.036 10 10 CECE C[C@H]1Cc2cc(N3CC[C@H](CO)C(F)(F)C3)ccc2O1 2235065617 BBPKNPWEYBYMKM-CMPLNLGQSA-N 283.318 2.464 10 10 CECE COc1ncccc1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2225797526 FTMODYJKLKAGEP-NXEZZACHSA-N 261.285 2.051 10 10 CECE COc1ccc(N2CCc3ccncc3C2)c(C=O)c1 2235990220 XNTPTKPBGBYWJF-UHFFFAOYSA-N 268.316 2.465 10 10 CECE CNCc1cc(OC)ccc1N(C)C[C@H]1CCCCO1 2235969063 ZKFYESOZAMLMQI-OAHLLOKOSA-N 278.396 2.420 10 10 CECE CC[C@@H]1CCN(c2ccc(OC)cc2C(=O)O)CCO1 2235947742 JRDFZCFVOLWDPY-LLVKDONJSA-N 279.336 2.399 10 10 CECE C[C@@H](NC[C@@H]1CO[C@H]2C[C@@H]1C2)c1ccc(O)cc1O 2226341420 AWYGPYSFVUPEAM-UZWSLXQKSA-N 263.337 2.173 10 10 CECE Cc1cc(N(C)C[C@]23COC[C@H](C2)C3)ccc1CCN 2236413712 ADIOBWCVXRZNPA-KDYLLFBJSA-N 274.408 2.359 10 10 CECE C[C@H]1C[C@@H]1CCN(C)CC(=O)N(C)c1ccc(N)cc1 2236497050 RWDSVNOVPAELGU-STQMWFEESA-N 275.396 2.210 10 10 CECE C[C@@H](Nc1ncncc1[N+](=O)[O-])c1ccccc1O 2226992368 DMDLLSVFRYHKAF-MRVPVSSYSA-N 260.253 2.264 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](C)N(C)C[C@@H]2C)cc1 2229732520 ZVJRXKQLTWNWFX-HZSPNIEDSA-N 261.413 2.496 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@H](F)[C@H]1CCOC1 2229952978 PTXYNYGHFJKYJO-ZFWWWQNUSA-N 266.360 2.465 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC(c2cnn(C)c2)C1 2240833261 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Cc1cc(N2[C@H]3CC[C@H]2[C@H](F)[C@H](O)C3)ccc1[C@H](C)O 2285157750 KEMGKLJWBPOBPY-QJXWRWMASA-N 279.355 2.488 10 10 CECE O[C@H]1[C@H]2C[C@@H]1CN(c1ccc(CNC3CC3)c(Cl)c1)C2 2286195510 OYRWMDYSWHKKFK-DRXBFXEBSA-N 292.810 2.409 10 10 CECE COC(C)(C)[C@H]1CCCN1C(=O)c1cccc(O)c1O 1148214769 WUALOQLDJACEIK-GFCCVEGCSA-N 279.336 2.127 10 10 CECE CC[C@@H](O)c1ccc(N2CCOC[C@H](F)C2)cc1 2315065200 AUXAKXUOGUNDKR-TZMCWYRMSA-N 253.317 2.305 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H](C)[C@H]1CCCCO1 2315987078 MYBOVVQGGOUBGL-GHMZBOCLSA-N 254.334 2.350 10 10 CECE CO[C@H]1C[C@@H]2C[C@@H](NCc3c(O)cccc3F)C[C@@H]21 2331960850 QYAREBJPPPHQJM-DDIVZENXSA-N 265.328 2.434 10 10 CECE CN[C@@H]1CN([C@H](C)c2ccc(O)cc2O)CC1(C)C 2336378869 UWNFSTZSQCZTLD-QMTHXVAHSA-N 264.369 2.089 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)c1C 2340847769 HSUQRPDZDNXNJD-NCZKRNLISA-N 261.365 2.174 10 10 CECE Cc1c([C@H](C)O)ccc(N2CCN(C)[C@@H]3C[C@@H]32)c1C 2340858535 ZLUGSNXDTJONAU-MAZHCROVSA-N 260.381 2.249 10 10 CECE 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CECE CCN(CC)c1ccc(OC2CCNCC2)c(O)c1 1951397991 GDNHRRUCOSEYFG-UHFFFAOYSA-N 264.369 2.369 10 10 CECE COc1ccc(N2CCC(N(C)C)CC2)c(C=O)c1 118862219 FBWFKINGKYJTEH-UHFFFAOYSA-N 262.353 2.038 10 10 CECE CN(C)C[C@@H]1CCCCN1CCOc1ccc(N)cc1 404977272 LQHBFPUYURCXLZ-HNNXBMFYSA-N 277.412 2.064 10 10 CECE COc1ccc(O)c(CN[C@H]2CCC[C@H]2n2ccnc2)c1 37106284 IIKQDEMHBIDJJD-LSDHHAIUSA-N 287.363 2.481 10 10 CECE CCNC(=O)c1ccc(NCc2ccc(O)cc2O)cc1 37089503 QLQDAAONXBYXNT-UHFFFAOYSA-N 286.331 2.460 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3CCC[C@H]3C2=O)c(Cl)c1 128365990 BKGZAOMPJLVTFW-RKDXNWHRSA-N 264.712 2.212 10 10 CECE Cc1cc(C)c(O)c(CN2CCO[C@@]3(CCOC3)C2)c1 184286050 MFTNHEZLUANXCN-INIZCTEOSA-N 277.364 2.000 10 10 CECE C[C@H](NN1CCN(C)CC1)c1ccc2ccccc2c1O 214416268 CBVLQHUIISCOHV-ZDUSSCGKSA-N 285.391 2.358 10 10 CECE Nc1cccc(NC(=O)CSc2nccs2)c1 40676549 TVNIBWUQDVBVSV-UHFFFAOYSA-N 265.363 2.456 10 10 CECE CCCC[S@@](=O)CCC(=O)Nc1ccc(N)cc1 40971002 RRYOBHAOBOVZRS-SFHVURJKSA-N 268.382 2.146 10 10 CECE 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GXQXXBDJWLGMAH-VXGBXAGGSA-N 252.333 2.003 10 10 CECE CC(C)(CC(F)F)NCc1ccc(O)c(O)c1O 2070029636 DXJRIAZYOQFNOT-UHFFFAOYSA-N 261.268 2.327 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@H]1[C@@H](C)[C@H]1C 2070822509 BTNABQKTXBHNKZ-LMLFDSFASA-N 254.334 2.110 10 10 CECE CN(Cc1cncc(C(N)=S)c1)Cc1ccccc1O 2192594157 NUVSRAQPUZJGKO-UHFFFAOYSA-N 287.388 2.053 10 10 CECE COc1ccc(N(C)C[C@]2(CN)CC2(F)F)cc1 2075925731 FAJTXKGZZAWADE-GFCCVEGCSA-N 256.296 2.116 10 10 CECE C[C@@H]1CCCN([C@H](C)c2cc(O)ccc2O)[C@@H]1C(=O)O 2201051621 UGXOLMAGOSXSRO-RULNRJAQSA-N 279.336 2.344 10 10 CECE NCCC1CN(c2ccc(OC(F)(F)F)cc2)C1 2078782372 UMEHPCSNCUQRCB-UHFFFAOYSA-N 260.259 2.370 10 10 CECE COc1ccc(N(C)Cc2ccc(=N)[nH]c2)c(F)c1F 2201639929 QSBJHFRHGNJFJL-UHFFFAOYSA-N 279.290 2.417 10 10 CECE CC[C@H](C)[C@@H](CO)N[C@H](C)c1cc(O)ccc1O 2081309438 KXNLWEDOONBGTO-OPQQBVKSSA-N 253.342 2.155 10 10 CECE CC[C@@H]1CC[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)O1 2081613187 AVHHBEROPRIXQH-AXFHLTTASA-N 252.318 2.245 10 10 CECE CNC[C@H]1CCCN1c1ccc(OC)c(F)c1F 2081863826 QCTWWLABZVHZQF-SECBINFHSA-N 256.296 2.162 10 10 CECE CCCOC1CN(CCCOc2ccc(N)cc2)C1 2102492390 IDFQYVUNAJKSFA-UHFFFAOYSA-N 264.369 2.149 10 10 CECE Cc1cc(CN)ccc1N(C)[C@H]1CCN(C2CC2)C1 2103767819 JUGMXLIPHKWTGK-HNNXBMFYSA-N 259.397 2.127 10 10 CECE C[C@@H]1CCN(Cc2ccc(F)cc2O)[C@H](CN)C1 2084080913 WLCWFPDXZLSINB-MFKMUULPSA-N 252.333 2.091 10 10 CECE Cc1cccc(O)c1CN[C@@H]1C[C@@H]2C[C@@]2(C(=O)O)C1 2104507175 JYJVODQVRNUFFV-UEKVPHQBSA-N 261.321 2.044 10 10 CECE Cc1cccc(O)c1CN1CCC[C@H]2C[C@]21C(=O)O 2104508813 HTFLJUKDRMBQTE-XHDPSFHLSA-N 261.321 2.140 10 10 CECE COC1(C)CCC(NCCCN=[N+]=[N-])(C(=O)O)CC1 2105176206 CWGPHZVJQFEQIJ-UHFFFAOYSA-N 270.333 2.079 10 10 CECE N[C@H]1CCCN(c2ccc3c(c2)OC(F)(F)O3)CC1 2106393719 COJSHGPSGBVZSM-VIFPVBQESA-N 270.279 2.326 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2C[C@]23CCCNC3)cc1 2106788424 PLAQFIUGRSRRQS-PMPSAXMXSA-N 260.381 2.176 10 10 CECE CC(C)[C@@H]1COC[C@@]1(O)c1ccc2c(c1)CCN2C 2106793657 PEGOPMVYVNFXSE-GOEBONIOSA-N 261.365 2.169 10 10 CECE CCN[C@H](CN(C)C)c1ccc(N2CCCC2)cc1 2106831357 PLBIBBHLKGORLZ-MRXNPFEDSA-N 261.413 2.499 10 10 CECE C[C@@H]1CSCCCN1c1ccc(CO)cc1[N+](=O)[O-] 2087308300 NEFAPPIUMAVXSW-SNVBAGLBSA-N 282.365 2.419 10 10 CECE Oc1ccc(CNCC2([C@H]3CCCO3)CC2)c(O)c1 2108110246 MDOVOLCMMBXYSD-CQSZACIVSA-N 263.337 2.147 10 10 CECE Nc1ccc(CN[C@@H]2CCC[C@@]34C[C@@H](CO3)[C@H]24)cc1 2088067253 VWXFEBBYPPMUTL-XZDPQHSOSA-N 258.365 2.316 10 10 CECE CC(C)(F)COc1ccc(N2CCNCC2)c(F)c1 2088049134 VUIAMGSKGWKNIF-UHFFFAOYSA-N 270.323 2.362 10 10 CECE CN1CCCc2cc([C@H](N)[C@H](CO)C3CC3)ccc21 2110682785 MTWPYFUXGGTAPF-ZBFHGGJFSA-N 260.381 2.087 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H](N)CC2CC=CC2)cc1 2091780761 MVWPUYGMZINWDL-HOTGVXAUSA-N 260.381 2.470 10 10 CECE CN(Cc1ccc(N)cc1)c1cccnc1[N+](=O)[O-] 2092471545 GBGOFTPYWZTLHH-UHFFFAOYSA-N 258.281 2.208 10 10 CECE Nc1ccc(O)c(CN2CCC[C@@]3(CCCO3)C2)c1 2094393426 BGQCKTRLYTWOCF-OAHLLOKOSA-N 262.353 2.119 10 10 CECE CCC[C@]1(O)CCN(c2c(F)cc(CO)cc2F)C1 2094374275 FNUDYMKIEPESRM-AWEZNQCLSA-N 271.307 2.198 10 10 CECE O=c1c2c(ccn1CCSC1CCCC1)CCNC2 2094406550 HLEHEILUYWJPLA-UHFFFAOYSA-N 278.421 2.170 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@@H]2C[C@H](N)C3)cc1 2094906081 FSNIFKCQDOASOR-RBVVOMGSSA-N 259.397 2.207 10 10 CECE COc1ccc(N(C)[C@@](C)(CN)c2cscn2)cc1 2099549274 NEJLGVLSLABVHY-AWEZNQCLSA-N 277.393 2.462 10 10 CECE CCOc1cccc(C(=O)Cc2ccc(N)cc2)n1 2112522300 DKOCHMLMCVPPNH-UHFFFAOYSA-N 256.305 2.488 10 10 CECE C[C@H](c1ccc(O)cc1O)N(C)[C@@H]1CCCCNC1 2112838189 KCGIFJZOVPKIFG-VXGBXAGGSA-N 264.369 2.233 10 10 CECE CCC1(N(C)c2ccc3c(c2)N(C)C(=O)[C@H]3O)CC1 2112842426 GJNPQAPKMNVCJK-ZDUSSCGKSA-N 260.337 2.075 10 10 CECE NCc1ccc(N2CCCO[C@@H]3CCC[C@@H]32)c(F)c1 2113808183 LDFMMWMJQIEKKP-LSDHHAIUSA-N 264.344 2.432 10 10 CECE C[C@@H](NC(=O)Nc1ccc(N)cc1)[C@@]12CC[C@@H](CO1)C2 2201803044 YNTKLJPKXWWKLW-HFAKWTLXSA-N 275.352 2.348 10 10 CECE COc1cc(N(C)Cc2c(Cl)cnn2C)ccc1CN 2204551212 VQWFBMHRJXSBPQ-UHFFFAOYSA-N 294.786 2.177 10 10 CECE COc1cc(N(C)C[C@@H]2CCCCN2C)ccc1CN 2204548861 LPRWHOKPQYHRQC-HNNXBMFYSA-N 277.412 2.074 10 10 CECE CCCN1CC[C@@H](N(C)c2ccc(CO)c(OC)c2)C1 2204555523 YRSHDHNZUCNSEP-OAHLLOKOSA-N 278.396 2.108 10 10 CECE CCCNc1cn[nH]c(=NCc2cccc(C)c2O)c1 2204628904 CCTSFGYOQLNBHQ-UHFFFAOYSA-N 272.352 2.347 10 10 CECE COCC12CC(NCc3ccc(OC)c(C)c3)(CO1)C2 2206058061 JEBJPRZKCSBRNK-UHFFFAOYSA-N 277.364 2.041 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CC[C@H](O)C1(C)C 2207122337 URPAYHBHGDPROB-NEPJUHHUSA-N 278.352 2.017 10 10 CECE CC[C@](C)(CC(=O)N(C)CCCN=[N+]=[N-])C(=O)O 2218738110 NAAGTEWKCVCFHE-LLVKDONJSA-N 256.306 2.036 10 10 CECE COc1ccc(N2CCC[C@H](O)CC2)c(F)c1F 2219767875 YTXVYPUNJXOLFL-VIFPVBQESA-N 257.280 2.325 10 10 CECE COc1ccc(N2CCC(F)(CO)CC2)cc1C 2219722441 XDWKCGKESOJXMD-UHFFFAOYSA-N 253.317 2.304 10 10 CECE CN1CCCc2cc(N3CC(CCCO)C3)ccc21 2230520439 ZANUQSDYTGUFEY-UHFFFAOYSA-N 260.381 2.278 10 10 CECE OCc1ccc(N2[C@H](CO)C[C@H]3CCCC[C@H]32)cc1 2231983312 MTJCBHWJADFECW-VNQPRFMTSA-N 261.365 2.309 10 10 CECE COCCN(CCOC)c1ccc([C@H](C)O)cc1C 2232098030 JIVFYWFVSGCDPY-ZDUSSCGKSA-N 267.369 2.148 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC[C@H]2COC[C@@H]2C1 2232102555 MVXAOMQVAWNZLZ-SNPRPXQTSA-N 260.381 2.487 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCN(C)[C@H]2CC[C@H]21 2232106595 OLZRHIVDWCSYRZ-UHOFOFEASA-N 259.397 2.298 10 10 CECE Cc1cc([C@H](C)O)ccc1N1C[C@H](C)[C@@H](N(C)C)C1 2232107081 WBJXHUDEAYDNRW-XEZPLFJOSA-N 262.397 2.435 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2OC[C@H]3CCC[C@@H]32)c1O 2233163436 ALPFVSQDTHILOX-VNHYZAJKSA-N 275.348 2.132 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)C[C@@H](CC(=O)O)C2CC2)C1 2234171258 KNSGYLLRPAPILI-KOLCDFICSA-N 280.328 2.036 10 10 CECE Cc1cccc(CN[C@@H]2CCCC[C@H]2S(C)(=O)=O)c1O 292850871 UBLQOESHWAGZHD-ZIAGYGMSSA-N 297.420 2.146 10 10 CECE FC1(F)Oc2ccc(N3[C@H]4CCC[C@@H]3CNC4)cc2O1 2234675632 UKRZJGXCTFJJKR-PHIMTYICSA-N 282.290 2.339 10 10 CECE CC(C)NCc1ccc(N2C[C@H](O)C[C@@H](F)C2)c(F)c1 2234663814 QZFCWKZWIVGUNY-CHWSQXEVSA-N 284.350 2.233 10 10 CECE CCOc1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)cc1OCC 2234882801 ZGNGVCPDTFJLAR-XBFCOCLRSA-N 277.364 2.444 10 10 CECE CCOc1ccc(N2CCSC[C@H]2CO)cc1OCC 2234902266 LJAMRJKNCKOEJX-CYBMUJFWSA-N 297.420 2.398 10 10 CECE Nc1ccc(N2CC[C@@H]3[C@H]2C[C@]3(O)C(F)(F)F)cc1 2225421745 MGARIZBAYALWPU-IJLUTSLNSA-N 272.270 2.161 10 10 CECE CC(C)[C@H](CC(=O)O)CC(=O)N1CC[C@H](N=[N+]=[N-])C1 2225796620 YVQMLICSYFSYOW-UWVGGRQHSA-N 268.317 2.035 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1CCCC[C@H]1C(=O)O 2225794138 CTKFQKAMORUXRZ-VHSXEESVSA-N 268.317 2.084 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H]3C[C@@H]3CO2)c(C=O)c1 2235986335 HZMKPQFWCAPHFU-LNSITVRQSA-N 275.348 2.369 10 10 CECE C[C@@H](NC[C@H]1COC2CC1C2)c1c(O)cccc1O 2226355350 KCKTXFFHKLKRAH-ZYGVAYEYSA-N 263.337 2.173 10 10 CECE OC[C@H]1CN(c2ccc(OC(F)(F)F)cc2)C[C@H]1F 2226542487 WJQRLKNMTFXMBR-LDYMZIIASA-N 279.233 2.352 10 10 CECE OC[C@H]1C[C@@]2(CCN2c2ccc3c(c2)CCCO3)C1 2226666138 SCTDVFNKHOUZNW-YGUOUDRMSA-N 259.349 2.363 10 10 CECE O[C@H]1CC[C@H]2C[C@H]1CN2c1ccc2c(c1)COCC2 2226711945 XYUDFCQUMWGYFP-RCBQFDQVSA-N 259.349 2.109 10 10 CECE CCOCCN(CC)c1ccc(OC)cc1CCN 2227681109 GUMDRZSPKVPOFE-UHFFFAOYSA-N 266.385 2.059 10 10 CECE C[C@@H]1CCC[C@@H](S(=O)(=O)Nc2ccc(O)c(N)c2)C1 2227843250 PIFDFPDZHBBZTQ-MWLCHTKSSA-N 284.381 2.295 10 10 CECE CN(C)C[C@@H]1C=CCN1c1ccc(CNC2CC2)cc1 2239081833 QBGCBQXDRCZHMN-KRWDZBQOSA-N 271.408 2.245 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1 2240028702 LMOHEFUWSQDESC-VZEFYGNVSA-N 274.408 2.249 10 10 CECE CN(Cc1nncs1)c1ccc2c(c1)CC[C@H]2O 2255260117 ILCGWOARVBKALI-GFCCVEGCSA-N 261.350 2.154 10 10 CECE CSc1ncc(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3)s1 2248706597 ZBZQUGOEFOGSNV-MYJAWHEDSA-N 269.439 2.238 10 10 CECE CCN(C)[C@@](C)(CC(=O)O)c1ccc(N(C)C)cc1 2270454569 XYGLIYIDYNIXAV-HNNXBMFYSA-N 264.369 2.394 10 10 CECE CP(C)(=O)[C@H]1CN(Cc2cc(F)ccc2O)CCO1 2273564895 PVHCLYUKLSMQGY-ZDUSSCGKSA-N 287.271 2.312 10 10 CECE O[C@@H]1C[C@@H]2CN(c3ccc(OC(F)F)cc3)C[C@H]21 2263939993 XERQOKPIZKQGRE-GGZOMVNGSA-N 255.264 2.105 10 10 CECE COc1ccc(N2C[C@H]3CC[C@@]3(CN)C2)c(C)c1C 2269170838 GQKZVSXFQLISAX-CZUORRHYSA-N 260.381 2.487 10 10 CECE COc1cc(C)c(N2C[C@H]3CC[C@@]3(CN)C2)c(C)c1 2269574771 FLAIEOAJPYQZHU-CZUORRHYSA-N 260.381 2.487 10 10 CECE COC[C@H](CN(C)c1ccc([C@H](C)O)c(C)c1)OC 2269674961 SKWANSOKLMCTHI-JSGCOSHPSA-N 267.369 2.146 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@@]1(CF)CCNC1 2281235044 HLSAOHBTRAKOCQ-JKSUJKDBSA-N 278.371 2.269 10 10 CECE COC[C@]1(C)[C@@H]2C[C@@H]2CN1c1ccc(OC)cc1CN 2284630728 QFZLYFPZBNUOTC-XNRPHZJLSA-N 276.380 2.015 10 10 CECE C[C@H](CF)N(C)c1ccc(C=CC(=O)O)c([N+](=O)[O-])c1 2285709154 VKHIASCTLHKHPO-SECBINFHSA-N 282.271 2.487 10 10 CECE CC1(C)C[C@@H]1CNCc1ccc(N2CCNCC2)cc1 2286073708 QHNOLCPWFYXYOY-OAHLLOKOSA-N 273.424 2.232 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@H]2C[C@@H]1C[C@]2(C)O 2296757000 LVZDUEAUBAYBSI-MSIPSHCFSA-N 277.364 2.040 10 10 CECE CN1CCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1O 373143471 XFFQLSFUKCXDPB-CABCVRRESA-N 260.381 2.451 10 10 CECE Cc1ccc(/C=C/C(=O)N2CCOc3ncccc32)cn1 492470974 IJDVLGQTNZJBTP-VOTSOKGWSA-N 281.315 2.224 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)c1cc(N)ccc1C 1174563515 XUSOEDHXZHIPNL-UHFFFAOYSA-N 292.360 2.392 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C[C@H]2CC[C@@H]3C[C@H]2CO3)C1 2312773554 BPYZSYRKOVLDQE-QNWHQSFQSA-N 250.346 2.434 10 10 CECE CCS(=O)(=O)N(C)Nc1nc2c(s1)CCCCC2 2317484841 NVCOXTAJDKPCDO-UHFFFAOYSA-N 289.426 2.020 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1F 2325321980 GBINBLKWTNOMPY-XDTLVQLUSA-N 251.301 2.184 10 10 CECE CSc1cc(N2CC(O)(C(C)C)C2)ccc1CN 2328535661 AASHUBOZKQBOAO-UHFFFAOYSA-N 266.410 2.074 10 10 CECE FC(F)(F)Oc1cccc(N=NN2CCNCC2)c1 2330242060 ZLTWHHARGXFYGM-UHFFFAOYSA-N 274.246 2.489 10 10 CECE O=C(O)[C@H]1[C@@H]2CC[C@@H]2CN1Cc1cc(Cl)ccc1O 2329040442 QNMBECXFOFPTBD-XTWCZFFVSA-N 281.739 2.341 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)cc1 2329486791 NBESIWIHVHFJKE-NMHRLERGSA-N 259.349 2.209 10 10 CECE CN[C@H]1CN(c2ccc3c(c2)C[C@H](C)O3)CC1(C)C 2336296770 QXNZBTHGJGSJNL-NHYWBVRUSA-N 260.381 2.444 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C[C@@H](CC(=O)O)C(C)C 2337777267 RITJOQBHLBFUGP-JTQLQIEISA-N 270.333 2.282 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@H]1CSC2(CNC2)C1 2339809622 UGXAFBNDLRTYIY-VXGBXAGGSA-N 278.421 2.233 10 10 CECE Cc1c([C@H](C)N)ccc(N(C)Cc2ncon2)c1C 2340849589 XNTDMAVWGWCSIW-NSHDSACASA-N 260.341 2.343 10 10 CECE C[C@@H](O)CN(c1ccc(CN)cc1F)C1CCCC1 2342916710 XMAZISFGXPZBNT-LLVKDONJSA-N 266.360 2.414 10 10 CECE COC1(C(F)F)CC(C(=O)Nc2ccc(N)cc2)C1 2343013690 HIQFLJXLCUCCHT-UHFFFAOYSA-N 270.279 2.268 10 10 CECE CSc1cc(N2CC(F)(F)C[C@H]2CO)ccc1CN 2353848496 JEGHHSZISIRKMJ-NSHDSACASA-N 288.363 2.074 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(CN)c(F)c1F 2354998341 PIUORMBRMNFVOA-LOWVWBTDSA-N 282.334 2.427 10 10 CECE CC(=O)N[C@@H](C)CN=NNc1cc(F)ccc1F 1860496806 YIQODSJIRRCAJJ-ZETCQYMHSA-N 256.256 2.269 10 10 CECE Oc1ccccc1CN1CCN(c2nccs2)CC1 179555142 FZDJLIBCNJHKAO-UHFFFAOYSA-N 275.377 2.171 10 10 CECE CCN(CC)c1ccc(O[C@@H]2CCCNC2)c(O)c1 1951599201 VVHTXDZLHFSGLE-CYBMUJFWSA-N 264.369 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ZIBBQMHUXCWEEL-HNNXBMFYSA-N 262.397 2.408 10 10 CECE CCCn1nccc1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1912198974 MPDOFLVCLXJRJE-NSHDSACASA-N 276.344 2.456 10 10 CECE [N-]=[N+]=NC1CN(Cc2nc(-c3cccs3)no2)C1 1912210448 JSPDTVHCQBTIJW-UHFFFAOYSA-N 262.298 2.293 10 10 CECE Cc1cc(O)nc(CN2CCCC[C@H](CN=[N+]=[N-])C2)n1 1912200918 NHRYMIZLBCFHQO-LLVKDONJSA-N 276.344 2.403 10 10 CECE COC(=O)[C@@](C)(CSC(C)C)NCCCN=[N+]=[N-] 1912204407 JRORJFNIKSDQTR-LLVKDONJSA-N 274.390 2.350 10 10 CECE CN(C)c1ccc([C@@H](N)[C@](C)(O)C2CC=CC2)cc1 2134293002 KFRCQUMATYTKQL-HZPDHXFCSA-N 260.381 2.470 10 10 CECE CC[C@@]1(C(=O)O)CCCN1[C@@H](C)c1c(O)cccc1O 233978750 MCFKGMMFBJAMIZ-BONVTDFDSA-N 279.336 2.488 10 10 CECE CC[C@@H](CC(F)F)C(=O)NCc1cccc(O)c1O 1350299675 HAWBUJVWMADUHD-QMMMGPOBSA-N 273.279 2.395 10 10 CECE Cc1cc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)ccc1N 105707855 YMQZSQYIOXGAPD-TXEJJXNPSA-N 258.321 2.257 10 10 CECE Cc1cc(N(C)CCCN(C)C)ccc1C=CC(=O)O 1912085252 SLRSASDESRQJCX-UHFFFAOYSA-N 276.380 2.481 10 10 CECE COc1cccc(CN2CC[C@H](OC)[C@@H]2C)c1O 1914342766 AQNCEGFKNZHMHB-JQWIXIFHSA-N 251.326 2.010 10 10 CECE C[C@H](N)c1ccc(N(C)C2CC(O)C2)c(Br)c1 1914590684 PNWPLWSUWDPJND-PUSIOWJLSA-N 299.212 2.428 10 10 CECE OCc1ccc(N2CC3(CCOC3)C2)cc1C(F)(F)F 1915314903 MBPVSCVPISTGRR-UHFFFAOYSA-N 287.281 2.424 10 10 CECE c1cc(N2CCOCC23CC3)ccc1CNC1CC1 1915587971 QRDBIOZKHLURNJ-UHFFFAOYSA-N 258.365 2.308 10 10 CECE COCC1CN(c2ccc(CN)c3ccccc23)C1 1916897886 AJVHLJOUSAMTKY-UHFFFAOYSA-N 256.349 2.381 10 10 CECE NCc1ccc(N2CC3(CCOC3)C2)cc1Br 1915823635 LMRNJYQFBFTNIZ-UHFFFAOYSA-N 297.196 2.135 10 10 CECE COCCNCc1ccc(N2CCC[C@@H]3C[C@H]32)cc1 1916845557 CGPSOLSBDYILNH-GDBMZVCRSA-N 260.381 2.411 10 10 CECE CCOc1ccc(NN=NCCNC(C)=O)cc1 1860490821 YXPJCVDJGGQQCJ-UHFFFAOYSA-N 250.302 2.001 10 10 CECE O=C(O)[C@@H](NCc1cccnc1)c1cc(Cl)ccc1O 211830599 PEHDAQLIZBMTNS-ZDUSSCGKSA-N 292.722 2.356 10 10 CECE O=C(NCc1c(O)cccc1F)c1ccc2nccnc2c1 1471974578 GEMQSAIQXMPCNM-UHFFFAOYSA-N 297.289 2.405 10 10 CECE CCN(CC)c1ccc(CN(C)CCC(=O)O)cc1OC 212681095 ZEULJRKCTCVCGS-UHFFFAOYSA-N 294.395 2.448 10 10 CECE CCN1CC[C@H](CNCc2cc(Cl)cc(OC)c2O)C1 228671435 IVZQNPBEIDZPOI-LLVKDONJSA-N 298.814 2.486 10 10 CECE CCn1cc(C(=O)NCc2ccc3cccnc3c2O)cn1 1557121971 DRRAKMRKOYZGES-UHFFFAOYSA-N 296.330 2.087 10 10 CECE CNCc1cc(F)c(N(C)Cc2ccno2)c(F)c1 2137781040 NBCVEMFCAYLJGU-UHFFFAOYSA-N 267.279 2.309 10 10 CECE CNC[C@@H](CN(C)c1ccc2c(c1)OCO2)C(C)C 258886086 CQSFPCZEJJGIGK-LBPRGKRZSA-N 264.369 2.343 10 10 CECE Nc1ccc(CC(=O)C[C@]23CO[C@](CF)(C2)C3)cc1 2137989817 DFNFQRLSHDHWPP-GASCZTMLSA-N 263.312 2.289 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@@H](c1ccccn1)C1CC1 1645127404 WDNHSJDPRHHILP-QGZVFWFLSA-N 298.342 2.303 10 10 CECE COc1cccc2c1CN(C(=O)Cc1ccc(O)c(O)c1)C2 1643689945 RRXONMUMNJDPNU-UHFFFAOYSA-N 299.326 2.191 10 10 CECE Cc1ccc(C(=O)NCc2ccc(O)cc2O)cc1O 1570462325 OJXXZFDILIQXHI-UHFFFAOYSA-N 273.288 2.042 10 10 CECE C[C@@H](CCc1ccco1)NC(=O)Cc1ccc(O)c(O)c1 1587285161 RCRPGKRRLHSKEJ-NSHDSACASA-N 289.331 2.371 10 10 CECE C[C@@H](CCCN)C(=O)N(C)Cc1ccc(N(C)C)cc1 122287641 UJNBVKVZKFMLFT-ZDUSSCGKSA-N 277.412 2.086 10 10 CECE COc1ccc([C@@H](C)NC[C@](C)(O)CSC)c(O)c1 230662850 CYWVOAYTVXUGIT-YGRLFVJLSA-N 285.409 2.165 10 10 CECE COC(=O)c1cc(N[C@@H](C)c2ccccc2O)ncn1 1655772787 HKDWEEIASQVIJK-VIFPVBQESA-N 273.292 2.142 10 10 CECE CCC[C@@H](O)CNCc1ccc2c(c1)CCCN2C 134361046 GUBYOHUWLKFJBW-OAHLLOKOSA-N 262.397 2.320 10 10 CECE Cc1cccc(CN[C@H]2CNC3(CCCC3)C2)c1O 2139751143 QGTCGEHZHRBETF-CQSZACIVSA-N 260.381 2.465 10 10 CECE N[C@@H]1CCN(Cc2ccc(F)cc2O)CCC1(F)F 2139769050 LOLQPSROIGDWTN-GFCCVEGCSA-N 274.286 2.090 10 10 CECE NC[C@H]1CN(Cc2ccc(F)cc2O)CC12CCC2 2139766172 RJTUBTUPEPVYOZ-LBPRGKRZSA-N 264.344 2.092 10 10 CECE Nc1ccc(CCCN2CCO[C@H]3CCC[C@@H]32)cc1 134706837 GACVHNCTSFQWMC-HOTGVXAUSA-N 260.381 2.455 10 10 CECE CC(C)NCc1ccc(N(C)CCO)c(Cl)c1 163980312 XZXBDPIKQHQEMR-UHFFFAOYSA-N 256.777 2.267 10 10 CECE C[C@H](C(=O)O)C1CN([C@@H](C)c2ccc(F)cc2O)C1 165981083 YKKRCAINPODYTI-IUCAKERBSA-N 267.300 2.245 10 10 CECE C[C@H](N[C@H]1CC2(CCC2)[C@@H]1O)c1cc(O)ccc1O 2140683851 OZWDAKGZAIUPBD-DUFXMDAXSA-N 263.337 2.052 10 10 CECE CC1(C)CCN(c2ccc3c(c2)OCO3)C[C@H]1CN 259223327 KNPRQBORDZPQNZ-LLVKDONJSA-N 262.353 2.227 10 10 CECE C[C@@H]1C[C@H](N)CN(Cc2ccc(Cl)cc2O)C1 1942496714 BFGJMNDZLVZEQH-SKDRFNHKSA-N 254.761 2.215 10 10 CECE Oc1cccc(-c2nc(Cc3cccnc3)no2)c1O 126857714 RLMVJSNIFIXWNU-UHFFFAOYSA-N 269.260 2.134 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H]2CO)cc1Br 1944103757 YQXVBIXVDMHMTC-ONGXEEELSA-N 299.212 2.301 10 10 CECE NC(=O)[C@@H]1CCCN1c1ccc(CNC2CC2)c(Cl)c1 236242738 UQYFAGDKZHAOLB-AWEZNQCLSA-N 293.798 2.046 10 10 CECE CNc1cc(N(C)[C@@H](C)c2ccccc2O)ncn1 1877517934 ONVBQVBBDONZAQ-JTQLQIEISA-N 258.325 2.421 10 10 CECE C[C@@H](N=c1ccc2nccn2[nH]1)c1ccccc1O 1877584554 GETUHUYPIGJXBW-SNVBAGLBSA-N 254.293 2.030 10 10 CECE C[C@@H](C(=O)O)N(Cc1ccc2c(c1)CCN2C)C1CC1 2143439798 KQNGRHBPPPLMCK-NSHDSACASA-N 274.364 2.116 10 10 CECE FC(F)COc1ccc(N2CC[C@@H]3CNC[C@H]32)cc1 1879908913 XPXDCMDICBPOSW-ZWNOBZJWSA-N 268.307 2.129 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@@H](O)CC2(C)C)c(F)c1 1880444981 SZNDZHQSDAJXLM-SCZZXKLOSA-N 271.307 2.368 10 10 CECE Cc1ccc(CN[C@H]2CCCC23OCCO3)c(O)c1 1308978081 JFUHJFPHOJFXIY-AWEZNQCLSA-N 263.337 2.086 10 10 CECE Cc1cnc(Cl)c(C(=O)N(C)CCN=[N+]=[N-])c1 1951109300 ZUKRMDRNTAGIQZ-UHFFFAOYSA-N 253.693 2.426 10 10 CECE O=C(O)[C@@H]1CCN(Cc2cc(F)ccc2O)CC1(F)F 1964732533 LCFWXBBAAOYOLD-JTQLQIEISA-N 289.253 2.073 10 10 CECE CC(C)(CNC(=O)c1cccc(O)c1O)[C@H]1CCCO1 1965333324 BVEACCUNPDBVRM-GFCCVEGCSA-N 279.336 2.033 10 10 CECE Cc1nc(CNC(=O)CCc2ccc(N)cc2)cs1 41010207 UWGRFBWOEZCLJD-UHFFFAOYSA-N 275.377 2.283 10 10 CECE COc1ccc([C@@H](C)NCCCc2ncc[nH]2)c(O)c1 139250043 TVGHALGFUDOBPV-LLVKDONJSA-N 275.352 2.407 10 10 CECE Nc1ccc(NC(=O)CN(CC(F)(F)F)C2CC2)cc1 42738482 UWYAVVKCHOTHSO-UHFFFAOYSA-N 287.285 2.234 10 10 CECE CN(CC[C@@H]1CC(C)(C)NC1=O)c1ccc(N)cc1 1967630503 UWJITDXQVMWTBY-LLVKDONJSA-N 261.369 2.010 10 10 CECE CN1CCCC[C@H](CNCc2ccc(F)cc2O)C1 1967748703 RDSLEQUZQHGCPG-GFCCVEGCSA-N 266.360 2.353 10 10 CECE CCN(CC(=O)NC(C)C)c1ccc2c(c1)CCCN2 168360118 MNZMMJIJOMTVHR-UHFFFAOYSA-N 275.396 2.396 10 10 CECE CCN(C)CCNCc1ccc(C(F)(F)F)cc1O 1969052607 YFEZZJQPWDMNCT-UHFFFAOYSA-N 276.302 2.452 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@H]2C[C@@H]2C2CCCC2)cc1 2145115853 YRPFDNATLNAVKX-CABCVRRESA-N 294.420 2.267 10 10 CECE CCn1nccc1CN1CCc2cc([C@H](C)N)ccc21 2150673680 LXHHJGJLWXNYAP-LBPRGKRZSA-N 270.380 2.485 10 10 CECE CCNCc1ccc(N2CC[C@](C)(N(C)C)C2)c(F)c1 2149957972 WKGMJLLLKQMJOS-INIZCTEOSA-N 279.403 2.466 10 10 CECE CCOc1cccc(CN[C@@H](COC)C(F)(F)F)c1O 1973151105 HJPYYNUXODJMLU-NSHDSACASA-N 293.285 2.458 10 10 CECE Nc1ccc(CC(=O)N[C@H]2C[C@H](C(F)(F)F)C2)cc1 1973848506 KJUZKDWPWLSFTE-HOMQSWHASA-N 272.270 2.268 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)C[C@H]1CCCOCC1 2145473732 UKARKNPUGLOLLO-ZDUSSCGKSA-N 276.380 2.434 10 10 CECE Cc1cccc(O)c1CN[C@H]1CCN(C)C2(CC2)C1 1974261835 IXJZWNHQCUMMMP-ZDUSSCGKSA-N 260.381 2.417 10 10 CECE CCCN(C[C@@H]1OC[C@@H]2CCO[C@@H]21)c1ccc(N)cc1 2145922266 FDMRNIGVPIMUMA-RCBQFDQVSA-N 276.380 2.289 10 10 CECE CC(C)(C)Cc1ccc(O)c([C@H](N)CC(=O)O)c1 258269862 BTECMYHOOBJUCO-LLVKDONJSA-N 251.326 2.455 10 10 CECE NN[C@@H](c1ccc(C(F)(F)F)nc1)c1ccccc1O 2146240415 KKEIXNJSIICUDL-LBPRGKRZSA-N 283.253 2.359 10 10 CECE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc([C@H](C)O)c(Cl)c1 2146463409 MJBUKSUNYRUGRI-BHDSKKPTSA-N 296.798 2.354 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2F)CCO1 34823426 TVLHXBCKXAVRRE-LLVKDONJSA-N 264.344 2.303 10 10 CECE COC(=O)[C@@H](N[C@@H](C)c1ccc(OC)cc1O)C(C)C 35346166 GQIWPRSACCTOOM-HZMBPMFUSA-N 281.352 2.249 10 10 CECE CCCN(CCC)C[C@@H](O)COc1ccc(N)cc1 36669944 QNSWHWYNYLIAPD-CQSZACIVSA-N 266.385 2.131 10 10 CECE CN(C)c1ccc(NCc2ccc(O)cc2O)cn1 36988920 UYFYIRWJXPVDGN-UHFFFAOYSA-N 259.309 2.171 10 10 CECE O=c1c2c(ccn1C[C@H]1CCCC(F)(F)C1)CCNC2 2150800850 QAPCUIXKKPNBAN-NSHDSACASA-N 282.334 2.320 10 10 CECE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@H]3C2)c(C(F)(F)F)c1 2151394250 VTQRKCSWCLNLHD-KWBADKCTSA-N 287.281 2.015 10 10 CECE CN(C(=O)CN1CCC[C@@](C)(F)C1)c1ccc(N)cc1 2152238428 ZCEDLHAKYAHWTO-OAHLLOKOSA-N 279.359 2.056 10 10 CECE CNCc1ccc(N(C)[C@H]2C[C@H](O)C2)cc1Cl 2009379869 UUKCJEMWFVRHHL-HAQNSBGRSA-N 254.761 2.019 10 10 CECE CN(C[C@H]1COCCCO1)c1ccc2c(c1)CCCN2 2154004413 VVAQGRWJIMZVGN-HNNXBMFYSA-N 276.380 2.286 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H](CO)C2)cc1Cl 2154456166 LVUFWUXKGYVTOF-VXGBXAGGSA-N 298.814 2.066 10 10 CECE CN1CCc2cc(CN3CC[C@H](N)CC34CC4)ccc21 2155061681 GGLYOAPHJOXMHZ-HNNXBMFYSA-N 271.408 2.135 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCn3ccnc32)cc1 294294591 ZJXGGXMINOVNBF-CQSZACIVSA-N 256.353 2.184 10 10 CECE CC(C)[C@@H]1CCN1c1ccc(CO)cc1[N+](=O)[O-] 2028284581 BWMNHJGQMRJQIE-NSHDSACASA-N 250.298 2.322 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)CC(F)(F)F 2031155929 ZTZVPGJAOPOIPK-WDEREUQCSA-N 263.259 2.356 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@H]1CCCOC1 62192715 DFKUTCJVZWGIPO-AWEZNQCLSA-N 276.380 2.434 10 10 CECE O=C1OC(c2ccccc2)=NC1=C1CCCCCN1 2041076107 PSSPIUBGKZPKGC-UHFFFAOYSA-N 256.305 2.365 10 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2.198 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CC=C[C@H](N)C3)ccc21 2106796342 PVOYGYMFSQUAOJ-IVMMDQJWSA-N 258.365 2.006 10 10 CECE CN1CCCc2cc(N3CCCC[C@H](N)C3)ccc21 2106822632 HLPWHXNQYVLEDJ-AWEZNQCLSA-N 259.397 2.387 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCCNCC1 2106831146 NQGHIKVRQHTMNV-MRXNPFEDSA-N 260.381 2.248 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@@H]3C(C(=O)O)[C@H]3C2)c1 2087317358 YVEYDFYHOCTBMI-DLOVCJGASA-N 261.321 2.024 10 10 CECE CCCN[C@H](C(=O)O)c1ccc2c(c1)CCCN2C 2107939966 MDIJBTBEEQTFJN-AWEZNQCLSA-N 262.353 2.194 10 10 CECE C[C@@]12CSC[C@H]1CN(CCOc1ccc(N)cc1)C2 2088478583 VMARNKNIPASWJY-IUODEOHRSA-N 278.421 2.333 10 10 CECE COc1ccc(O)c([C@@H](C)N2CC[C@@H]2CC(=O)O)c1 2109435309 UAGSNZBKRHAJSA-NXEZZACHSA-N 265.309 2.011 10 10 CECE OC[C@H]1C[C@H](NCc2c(O)ccc3ccccc23)C1 2090077188 IDQDWSXTTRJACC-AULYBMBSSA-N 257.333 2.406 10 10 CECE CCCN[C@H](c1ccccc1O)[C@](C)(O)[C@H](C)OC 2091863834 PSVYIDMNLGLWAA-NILFDRSVSA-N 267.369 2.219 10 10 CECE Nc1ccc(OCCC(=O)OC2CC(F)(F)C2)cc1 2092438011 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CC(C)(C)[C@@]1(O)CCN(c2ccc(CN)cc2F)C1 2121096377 DBPJJMXJKRITBY-OAHLLOKOSA-N 266.360 2.272 10 10 CECE COc1cc(N(C)[C@@H]2CC[C@@]23CCCO3)ccc1CO 2204553493 KUOFINLKMCMRIA-CVEARBPZSA-N 277.364 2.335 10 10 CECE CNCc1ccc(N2CCC[C@@H]2C(C)(C)O)cc1OC 2204544817 HJUZHTHDUBNPTF-OAHLLOKOSA-N 278.396 2.154 10 10 CECE CNCc1ccc(N2CC[C@H](O)CC2(C)C)cc1OC 2204554062 KYVMOHGPHOJJEJ-AWEZNQCLSA-N 278.396 2.154 10 10 CECE COc1cc(N2CCCC[C@@H]2CN(C)C)ccc1CN 2204558958 JKGXYRVYOPZJHO-OAHLLOKOSA-N 277.412 2.074 10 10 CECE COc1ccc(N2CCS[C@H](CO)C2)cc1Cl 2214343225 OUXWFWWJNCWAEO-JTQLQIEISA-N 273.785 2.263 10 10 CECE COC[C@]1(C)C[C@@H]1CN[C@H](C)c1ccc(O)cc1O 2269290602 RIQBDZOYNZKGAJ-HFAKWTLXSA-N 265.353 2.421 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](OCCCO)C2)c(Cl)c1 2207078277 BSBUATHFSPPLHK-DGCLKSJQSA-N 298.814 2.337 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@H](F)C2)c(Cl)c1 2219165602 JABPXVHYLNLYFN-MIMYLULJSA-N 273.735 2.302 10 10 CECE COCC(C)(C)N(C)c1ccc(OC)cc1CN 2220415271 QJBUTNQPDADDNG-UHFFFAOYSA-N 252.358 2.015 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CC(=O)NC(C)C 2232091645 JEHNIOPUYPBZCQ-GFCCVEGCSA-N 264.369 2.009 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCS[C@H](CCO)C1 2232104055 HBLZDIZAKIOGDP-GXTWGEPZSA-N 281.421 2.353 10 10 CECE CCOc1ncc(C(=O)c2cccc3c2NCC3)cn1 2234848906 QNVBGKKHEFKUNY-UHFFFAOYSA-N 269.304 2.074 10 10 CECE O[C@@H]1CCC[C@H]2CN(c3ccc4c(c3)OCCO4)C[C@@H]12 2235102328 XAHYDHGSFTVCKP-IACUBPJLSA-N 275.348 2.055 10 10 CECE CNCc1cc(OC)ccc1N(C)[C@@H]1CCOC[C@@H]1C 2235976204 CJNRVTGGQOCPOL-SWLSCSKDSA-N 278.396 2.276 10 10 CECE CNCc1cc(OC)ccc1N(CCOC)C1CCC1 2235954159 JWIVVKBKYWEJFM-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(N2CC[C@H](OC)[C@H]2C(C)C)c(CO)c1 2236000907 BWPUXOPYVYGRBK-JKSUJKDBSA-N 279.380 2.437 10 10 CECE CC(C)[C@@H]1[C@H](O)CCN1c1ccc2c(c1)OCCO2 2226770760 KXGNWHVJNHVDIZ-IUODEOHRSA-N 263.337 2.053 10 10 CECE COc1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)c(F)c1F 2226922430 NVIPFIQLRIWZKG-GUBZILKMSA-N 269.291 2.038 10 10 CECE CCN[C@@H]1CCc2cc(N3CC=C[C@]3(C)CO)ccc21 2237160281 QPJDUMFGTSIMMT-IAGOWNOFSA-N 272.392 2.411 10 10 CECE CN(C)c1ccc(OCC[C@@H]2CCC[C@@]2(N)CO)cc1 2237693130 DCPGFIUGZAVAMS-XJKSGUPXSA-N 278.396 2.011 10 10 CECE CNCc1cc(OC)ccc1N1CCCOC[C@H]1C 2227686359 RBXJIVOFKOEUJI-GFCCVEGCSA-N 264.369 2.030 10 10 CECE COc1ccc(N(C)CC2[C@H]3CC[C@H]23)c(CCN)c1 2227682002 FZEAHQGTLSMNRB-KBPBESRZSA-N 260.381 2.289 10 10 CECE C[C@H]1CN(C)[C@H](C)CN1c1ccc(CNC2CC2)cc1 2238057053 JRAIWZSXSMJVGA-KGLIPLIRSA-N 273.424 2.467 10 10 CECE CN(C)c1ccc(OCc2cc(NN)ccn2)cc1 2229379484 NWZAAHGQQTYBLZ-UHFFFAOYSA-N 258.325 2.012 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@]1(C)C=CCCN1 2239424157 TUPLQTBCUDMFRE-WBMJQRKESA-N 274.364 2.220 10 10 CECE CCOc1ncc([C@@H](NN)c2ccc(N(C)C)cc2)s1 2239812419 USMRYMHOCGHXQF-ZDUSSCGKSA-N 292.408 2.161 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C(N(C)C)[C@H]3C2)c(C)c1 2240755536 CHPMMRNASXSMSA-SNPRPXQTSA-N 273.424 2.272 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(C[S@](C)=O)C2)c(C)c1 2240743409 KOOCWIUNAIMKAC-RBZFPXEDSA-N 294.464 2.480 10 10 CECE 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CCCN(C[C@H](C)O)c1cc(OC)c(OC)c(OC)c1 2287944017 KSHUGWQTFXEMHY-NSHDSACASA-N 283.368 2.310 10 10 CECE OCc1ccc(N2CCC3(CC[C@@H](O)C3)CC2)c(F)c1 2288002010 BUSGWWXJDIIZHR-CYBMUJFWSA-N 279.355 2.449 10 10 CECE C[C@H](SC[C@@H]1NCC[C@@H]1C)C(=O)Nc1ccc(N)cc1 2288878415 ZOAPEMUFBCBYMC-MJVIPROJSA-N 293.436 2.327 10 10 CECE CCOc1ccc(C=C2C(=O)NC(C)=C2C(=O)OC)cc1 2297308035 HFKCPCLFRYYXRG-UHFFFAOYSA-N 287.315 2.046 10 10 CECE CCOC(=O)c1cnc(Sc2nccs2)nc1 2300354475 MEIAGFPGEMPGAS-UHFFFAOYSA-N 267.335 2.261 10 10 CECE Oc1c(Br)cccc1CNCCc1ncco1 2300961811 SBNAHVGJKFUZDZ-UHFFFAOYSA-N 297.152 2.475 10 10 CECE COCc1ccc(C(=O)NCCCN=[N+]=[N-])s1 2302952461 OVVKSHHLGSXQSB-UHFFFAOYSA-N 254.315 2.325 10 10 CECE N[C@@H]1CCCCC[C@]1(Sc1nccs1)C(=O)O 2307034293 KQSRLLVYLBMPND-LDYMZIIASA-N 272.395 2.350 10 10 CECE COc1cc(Cl)c(N2CC[C@@H](N)[C@H]2C)c(OC)c1 2319560735 QFWWDLUOPPPMSC-LDYMZIIASA-N 270.760 2.283 10 10 CECE Cc1ccc(CN(C)[C@@H]2CC[C@@H]2N)c(O)c1Br 2307565169 KALVPJBFNXPDRK-WDEREUQCSA-N 299.212 2.385 10 10 CECE 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CCN(c1ccc(CNC)cc1F)[C@H](C)CN(C)C 232258364 YLIUOVOGMXHGOQ-GFCCVEGCSA-N 267.392 2.322 10 10 CECE COc1cc(N2CC[C@]23C[C@@H](CF)C3)ccc1CN 2139686271 JAPLUMRBLGPPJI-FUKZOUPISA-N 264.344 2.482 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])C[C@@H]2CC[C@@H]1C2 158714789 MJQCQHAHXWFYHZ-FOGDFJRCSA-N 252.318 2.008 10 10 CECE C[C@@H](CC(=O)O)[C@@H]1CCCN(Cc2ccc(O)cc2O)C1 155910487 RFDVLRZYXOXDGJ-NWDGAFQWSA-N 293.363 2.421 10 10 CECE C[C@@H](N)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1865916037 HYRALQSETAAMIJ-LLVKDONJSA-N 269.348 2.145 10 10 CECE CCOC(=O)C(C)(C)N(C)c1ccc2c(c1)OCO2 258720043 GBYHKVMNHWIBAV-UHFFFAOYSA-N 265.309 2.193 10 10 CECE COCCNCc1ccc(N2CCO[C@@H](C)C2)cc1Cl 234686534 XBJXFLBFJJMHNJ-LBPRGKRZSA-N 298.814 2.301 10 10 CECE CN[C@@H](c1ccccc1O)c1ncncc1Br 1942399626 BJHNOVGQIZRBKD-NSHDSACASA-N 294.152 2.254 10 10 CECE OC[C@@H](CNCc1cc(Cl)ccc1O)C1CC1 1942316968 BBBYSNAZZGLEMO-LLVKDONJSA-N 255.745 2.154 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2OCCO[C@@H]2C)c(F)c1 2143681904 IGLXZKHUODEBSD-RWSFTLGLSA-N 283.343 2.119 10 10 CECE Oc1ccc(CNc2cccc3cn[nH]c23)c(O)c1O 236597405 MYYFPHZHWWOXIR-UHFFFAOYSA-N 271.276 2.292 10 10 CECE CC[C@@H]1C[C@@H]1CCNS(=O)(=O)Cc1ccc(N)cc1 1875941590 ODAMNXPVBJWINZ-OLZOCXBDSA-N 282.409 2.124 10 10 CECE CC(C)NCc1ccc(N2[C@@H]3COC[C@H]2C3)c(F)c1 1899653968 MTNFXCQBSFVWIM-BETUJISGSA-N 264.344 2.301 10 10 CECE CC(C)N(C)C(=O)CN(C)[C@@H](C)c1ccccc1O 1877539797 ZNOZLBGNDFBPER-LBPRGKRZSA-N 264.369 2.252 10 10 CECE COc1ccc(N(C)C[C@@H]2CC(F)(F)[C@H]2CO)cc1 2143155830 KNQVEUOYOQRSNI-GWCFXTLKSA-N 271.307 2.395 10 10 CECE Cc1ccnc(C)c1[C@@H](O)[C@H](N)c1ccccc1O 1878779632 VYYZOWABWMJXPY-HUUCEWRRSA-N 258.321 2.137 10 10 CECE COc1ccc(N(C)C[C@]23C[C@](C)(CO2)C3)c(N)c1 1879896906 XJQFVYQMAUOOQE-GASCZTMLSA-N 262.353 2.283 10 10 CECE C[C@H](O)[C@H]1CCN(c2c(F)cc([C@@H](C)N)cc2F)C1 1880963097 RLWICEROIGCEEC-UTLUCORTSA-N 270.323 2.192 10 10 CECE CCN[C@H](C)c1cc(F)c(N2CC[C@@H](O)C2)c(F)c1 1880962158 HDCVPMDWAZWQCK-MWLCHTKSSA-N 270.323 2.206 10 10 CECE 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261.365 2.481 10 10 CECE NCc1ccc(N2CCO[C@@H](C3CC3)CC2)cc1F 2088562145 LMHNKZQJSHKYCC-OAHLLOKOSA-N 264.344 2.290 10 10 CECE CCOC1(CNCc2ccc3c(c2)CCN3C)CC1 2110291997 MINKRJYFVAXZFB-UHFFFAOYSA-N 260.381 2.338 10 10 CECE OCc1ccc(N2C[C@]34CC[C@@]3(COC4)C2)cc1Cl 2090383642 APCBIAAGSYHCQR-GJZGRUSLSA-N 279.767 2.449 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC(C)(C)[C@H]1C(=O)O 2092535189 HZASGSBTOCFFIF-PRHODGIISA-N 267.300 2.387 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](COC)[C@H]3C2)cc1 2093140100 JYRMASFMXMQFBJ-JYJNAYRXSA-N 260.381 2.125 10 10 CECE CC[C@H](c1ccccc1O)N1CCNCC(F)(F)C1 2093145345 IZSRJOVEGCBPLT-GFCCVEGCSA-N 270.323 2.384 10 10 CECE CNCCCCN(C)[C@@H](C)c1cc(OC)ccc1O 2094158232 JOPVCDMYRWNIEC-LBPRGKRZSA-N 266.385 2.393 10 10 CECE CC[C@H]1CCCN(CCOc2ccc(N)cc2)C1=O 2094469928 IWRXPFDTKNGCMU-LBPRGKRZSA-N 262.353 2.296 10 10 CECE Oc1cccc(CNC[C@]23CCC[C@@H]2CCO3)c1O 2096718424 OVYUOAWAEVEHMH-IUODEOHRSA-N 263.337 2.147 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@H]2CC(F)(F)C(=O)O2)CC1 2099336404 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COc1ccc(N2CC[C@@H](CO)[C@H]2C)c(F)c1F 2219766235 GGHWOYAJNCLSQQ-BDAKNGLRSA-N 257.280 2.181 10 10 CECE Nc1ccc(CS(=O)(=O)NCCCCC(F)F)cc1 2230150136 BRQALVHFUBDVPZ-UHFFFAOYSA-N 292.351 2.124 10 10 CECE CCN(c1ccc(OC)cc1CN)[C@H](C)COC 2220415259 QECQEGKSAVMHTA-LLVKDONJSA-N 252.358 2.015 10 10 CECE Cc1cccc(O)c1CN[C@H](C(F)F)[C@H]1CCOC1 2231048874 OGFBUTMZIRNXJR-GWCFXTLKSA-N 271.307 2.460 10 10 CECE CC[C@H](C)NCc1ccc(N(C)CC(N)=O)cc1Cl 2231455078 RTHQXAQIGINLJX-JTQLQIEISA-N 283.803 2.150 10 10 CECE CCN(c1cc(OC)c(OC)cc1N)[C@@H]1CCC[C@H]1O 2232622225 SXXOPSLPKUEWHT-DGCLKSJQSA-N 280.368 2.026 10 10 CECE Oc1cccc(F)c1CN1CC[C@H](OC(F)F)C1 2222953358 CCAXAEDLGQAKCM-QMMMGPOBSA-N 261.243 2.345 10 10 CECE NCc1ccc(N2C[C@@H](F)C[C@@H](O)C2)c(C(F)(F)F)c1 2234683341 IWJPSPQDHCJZPC-VHSXEESVSA-N 292.276 2.073 10 10 CECE COC1(CO)CCN(c2ccc(OC3CC3)cc2)CC1 2235113852 VEMGTIXFWUPTST-UHFFFAOYSA-N 277.364 2.206 10 10 CECE COc1ccc(N2CC[C@@H]([C@H]3CCCO3)C2)c(CN)c1 2235965559 GANSWXCDXZMESM-MLGOLLRUSA-N 276.380 2.159 10 10 CECE CC[C@@H]1COCCN1c1ccc(OC)cc1C[C@@H](C)N 2235968761 VRINJGMCOBKDIY-TZMCWYRMSA-N 278.396 2.200 10 10 CECE COC[C@]1(C)CCN(c2ccc(OC)cc2CN)C1 2227679008 CVBJHFLXWWKBND-OAHLLOKOSA-N 264.369 2.017 10 10 CECE COc1ccc(N2C[C@@H]3[C@@H](C2)C3(C)C)c(CCN)c1 2227686723 VYHZVLWFVKASFY-ZIAGYGMSSA-N 260.381 2.289 10 10 CECE CC(C)CNCCOCCOc1ccc(N(C)C)cc1 2237700317 LOMKFUSSJVUDPU-UHFFFAOYSA-N 280.412 2.394 10 10 CECE CCCN(c1ccc([C@H](C)N)cc1C)[C@@H]1CCNC1=O 2240756596 FZBUIWGDZJQXCA-SWLSCSKDSA-N 275.396 2.120 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCS(=O)(=O)[C@@H](C)[C@H]1C 2240839744 JMTDMDGCBZBKQQ-UPJWGTAASA-N 297.420 2.060 10 10 CECE COC1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CC(C)C1 2255106028 XLRLEIPFWGYHAI-YZRBJQDESA-N 252.318 2.103 10 10 CECE Cc1cc(N(C)C[C@H]2CCCS2(=O)=O)ccc1[C@@H](C)N 2285142273 YIPQSQPSFKXORE-TZMCWYRMSA-N 296.436 2.028 10 10 CECE O[C@H](c1ccc(N2CCNCC2)cc1)c1ccsc1 2270556732 JTAFITYQIVUVMC-OAHLLOKOSA-N 274.389 2.239 10 10 CECE COc1ccc(N(C)[C@H]2COCC3(CCC3)[C@@H]2O)cc1 2279042166 BBXGEUWLTVEKKU-LSDHHAIUSA-N 277.364 2.061 10 10 CECE Cc1cc(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)ccc1[C@H](C)N 2269659575 WKNSUHNHEOTMIU-DANNLKNASA-N 260.381 2.486 10 10 CECE COc1ccc(N2C[C@@H]3[C@@H](CO)C[C@H]3C2)c(OC)c1C 2295375570 LNCAYKQCYWCLNV-XQQFMLRXSA-N 277.364 2.077 10 10 CECE COc1ccc(N(C)[C@](C)(CSC)C(=O)O)cc1 2323454170 NTUGZBFSNDYOPB-CYBMUJFWSA-N 269.366 2.338 10 10 CECE CC[C@@](C)(CN(C)Cc1ccc(N)cc1)C(=O)O 2320211427 NTSLAFWTVIWAMF-AWEZNQCLSA-N 250.342 2.202 10 10 CECE COc1ccc(CN[C@@H]2CC[C@@H]3C[C@H]2CO3)c(O)c1 2334120212 NIGCCHJBXYTLBO-IACUBPJLSA-N 263.337 2.058 10 10 CECE OCc1ccc(N2C[C@H]3CCO[C@H]3C2)cc1C1CC1 2339159986 JIPBLYDMUYDEJM-WBMJQRKESA-N 259.349 2.281 10 10 CECE CCNCc1cc(F)c(N(C)C[C@@H]2CCO2)c(F)c1 2341209592 XDCVZAWSFYJUHN-NSHDSACASA-N 270.323 2.299 10 10 CECE CN1C[C@@H]2[C@@H](CCC[C@@]2(Sc2nccs2)C(=O)O)C1 2351993085 WSIZSMHXXORTSD-CWSCBRNRSA-N 298.433 2.420 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2C[C@@H]3C[C@H]2C[C@H]3O)c1 2355723305 NSGYTYFLJWGPEG-DSJPLQJWSA-N 277.364 2.211 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2CC(=O)C3)c(OC)c1 107903121 GGARVGCBXSALSQ-QWRGUYRKSA-N 261.321 2.404 10 10 CECE COc1ccc(CNCC2C[C@H]3CC[C@H](C2)N3C)c(O)c1 104145308 MMLXANWAVRHUAV-HUUCEWRRSA-N 290.407 2.363 10 10 CECE CNCc1ccc(OC)c(CN2CCCCCC2=O)c1 50125521 OIFILOCDDOXYRR-UHFFFAOYSA-N 276.380 2.317 10 10 CECE OCC[C@H]1CCCCN1Cc1cc(F)ccc1O 179880365 ITOCGMHNXQQYHW-CYBMUJFWSA-N 253.317 2.268 10 10 CECE COc1ccc(N2CC[C@H](OC)C[C@H]2C)c(N)c1 305982434 SAGAXBKXQZZKBJ-PWSUYJOCSA-N 250.342 2.281 10 10 CECE CN(C(=O)[C@@H]1COc2ccccc2C1)c1ccc(N)cc1 110539745 HZPWGGIMAWUNMS-ZDUSSCGKSA-N 282.343 2.483 10 10 CECE CN(Cc1cscn1)Cc1cc([N+](=O)[O-])ccc1O 170914023 YAHZERGNCOJJFC-UHFFFAOYSA-N 279.321 2.389 10 10 CECE CCN(CC)[C@H]1CCN(CCCOc2ccc(N)cc2)C1 62977024 RJWGEYTYSBARBF-INIZCTEOSA-N 291.439 2.454 10 10 CECE CC(C)(C)OC(=O)C[C@](C)(N)c1c(O)cccc1O 1951861031 PKKSWEKYKYPXEV-AWEZNQCLSA-N 267.325 2.004 10 10 CECE O=C(NCc1cc(O)ccc1O)c1cccc(F)c1 212243052 RDXYYKMPQSPOJG-UHFFFAOYSA-N 261.252 2.167 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@@H]2CNC[C@H]2CC1 312634653 CIJXHCUJLOPXFW-JHJVBQTASA-N 276.380 2.090 10 10 CECE CC(C)[C@@H](C)OC[C@H](O)COc1ccc(N)cc1 123562526 HZECUBSSZNTPSD-YPMHNXCESA-N 253.342 2.070 10 10 CECE Nc1cc2c(cc1N(CC1CC1)CC1CC1)NC(=O)CO2 70504511 FJSXSFKYZWXENS-UHFFFAOYSA-N 287.363 2.226 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H](C)[C@@H]1CCCO1 130111868 VURWJSXHFAZFHC-CABZTGNLSA-N 264.325 2.035 10 10 CECE Cc1cc(N(C)C[C@H]2CCN2C)ccc1C[C@@H](C)N 2129906745 XCVTWUHVJVPVKK-CZUORRHYSA-N 261.413 2.025 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H](O)COC(C)(C)C)c1 182460123 XQSXAOJIKCNFCO-NWDGAFQWSA-N 297.395 2.227 10 10 CECE COc1ccc([C@@H](C)N[C@H](C)C(=O)N2CCCC2)c(O)c1 228089655 IVVLQIXFKDDFEL-VXGBXAGGSA-N 292.379 2.062 10 10 CECE NCc1ccc(N2CCC[C@H](CO)C2)cc1Br 228148572 RDJUNNRDIQUETC-JTQLQIEISA-N 299.212 2.117 10 10 CECE CCCNCc1ccc(N2CCC[C@@H]2C(=O)NC)c(F)c1 42395761 CVOOSVNVSFSBRO-OAHLLOKOSA-N 293.386 2.040 10 10 CECE CC(C)(C)OC(=O)Nc1ccc([C@H]2C[C@H](O)CN2)c(O)c1 1952564759 OGNHBTSNXXZJGU-CMPLNLGQSA-N 294.351 2.135 10 10 CECE CCNCc1cc(F)c(N2C[C@H]3[C@H](O)CC[C@H]3C2)c(F)c1 228062211 XKNDBZVCAMCOAP-YWPYICTPSA-N 296.361 2.281 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2CCCOC2)c1O 228673124 GKUQZKIPNDULRI-LLVKDONJSA-N 271.744 2.323 10 10 CECE CC(C)(C)c1ccc(O)c([C@@H]2N[C@H](C(=O)O)CS2)c1 83236616 OZPITQHVSNWKNG-CMPLNLGQSA-N 281.377 2.478 10 10 CECE CC[C@H]1OCC[C@@H]1CNC(=O)Nc1ccc(N)cc1 234136335 BCKNFDTUNCGAPH-ZWNOBZJWSA-N 263.341 2.205 10 10 CECE CCOC(=O)[C@H](CCCSC)NCCCN=[N+]=[N-] 231735762 PSOAWOSVJKOTSC-JTQLQIEISA-N 274.390 2.351 10 10 CECE CNCc1ccc(N2CCCC[C@@H]2CO)cc1Cl 234431698 RBCGJBVUZPCPQF-CYBMUJFWSA-N 268.788 2.411 10 10 CECE COC(=O)[C@@]1(N)CCC[C@H](Sc2nccs2)C1 93778701 UVLRWNIGRJFWMB-GZMMTYOYSA-N 272.395 2.048 10 10 CECE CN(C)c1ccc(/C=C2/N=C(c3ccncc3)NC2=O)cc1 243213736 KGXYFWZFAPXLQT-UHFFFAOYSA-N 292.342 2.065 10 10 CECE CN(CCN=[N+]=[N-])[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1F 1892494157 SJFDHZKGRSHJLX-ZJUUUORDSA-N 287.339 2.186 10 10 CECE NCC[C@H]1CCCN(c2ccc3c(c2)OCCCO3)C1 2162628720 BTVJOXLBOLTZQM-CYBMUJFWSA-N 276.380 2.413 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)c(Cl)c1 703487181 UBYPIHMGTUJGEZ-IEBDPFPHSA-N 282.771 2.093 10 10 CECE CN(C)c1ccc(CN2[C@H](CN)C[C@@H]3CCC[C@@H]32)cc1 2164801165 OKELXZPPFFGVIS-XIRDDKMYSA-N 273.424 2.454 10 10 CECE CCN1CCc2cc([C@@H](O)Cc3ccnn3C)ccc21 2163079338 NPZSSOUMJGYSBY-INIZCTEOSA-N 271.364 2.079 10 10 CECE COCCOCC[C@@H](N)c1ccc(N2CCCC2)cc1 2163112726 FAVJJPOVPFEKKK-MRXNPFEDSA-N 278.396 2.340 10 10 CECE CCN(C)c1ccc([C@@H](C)NCc2cnn(C)n2)cc1 806165210 DVHGVEURPFWWGD-GFCCVEGCSA-N 273.384 2.122 10 10 CECE COc1ccc(N(C)[C@H]2CNCC[C@@H]2C)c([N+](=O)[O-])c1 2163611252 BNVPPZFOQPWHNF-HZMBPMFUSA-N 279.340 2.038 10 10 CECE CC[C@H](N[C@@H](C)c1ccccc1O)[C@@H](O)C(F)F 296551400 RNSDKRSQFNXRKB-PTOFAABTSA-N 259.296 2.447 10 10 CECE Cc1cc(N2CC[C@@H]3OCC[C@H]3C2)ccc1C[C@H](C)N 724844033 CQVVKCGXKMSQCO-QRTARXTBSA-N 274.408 2.500 10 10 CECE C[C@@H]1CN(C)C[C@H]1Nc1c(N)cccc1Br 722290704 UKIYGUIAUWRMFK-LDYMZIIASA-N 284.201 2.393 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CC[C@@]2(O)C[C@H]2C1 827293411 YSYJYAGPVPLTFG-TVQRCGJNSA-N 271.719 2.141 10 10 CECE COc1ccc(O)c(CNC(=O)C[C@H](C)[C@H]2CCCO2)c1 830543631 AMOLGTGCOGRLOY-XHDPSFHLSA-N 293.363 2.222 10 10 CECE CCn1ncnc1CNC/C=C\c1ccc(N(C)C)cc1 835051822 KCXKXYHUTHNSBH-WAYWQWQTSA-N 285.395 2.167 10 10 CECE CCOC(=O)CC(C)(C)CNCc1cccc(OC)c1O 839095319 CMZKKUBUCVBDMC-UHFFFAOYSA-N 295.379 2.470 10 10 CECE COC(=O)[C@@H](NC/C=C\c1ccc(N(C)C)cc1)C1CC1 835050306 OMAUKGCBDXPUEE-AWFCHZOYSA-N 288.391 2.307 10 10 CECE Nc1ccc(CCNC(=O)N[C@H]2CC23CCCC3)cc1 841959715 PKJRXMVNASQSGV-AWEZNQCLSA-N 273.380 2.443 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](C)[C@](C)(CN)C2)c1 841087948 UFTHMWKESUZEJA-MLGOLLRUSA-N 278.396 2.208 10 10 CECE CN(C)c1ccc(/C=C\CN[C@@H]2CNCCC2(F)F)cc1 841079605 MHGOOXPNEHYWKK-ABCZVMIZSA-N 295.377 2.353 10 10 CECE CC(=O)C(=O)COC(=O)c1cc(C2CC2)oc1C1CC1 923897653 LCPXKLMDZAWTOW-UHFFFAOYSA-N 276.288 2.349 10 10 CECE Cc1cc(Cl)cc([C@@H](C)N[C@H]2C[C@@H](C(N)=O)C2)c1O 846195042 WVKJTSCSYNDFCO-KKZNHRDASA-N 282.771 2.269 10 10 CECE C[C@@H]1CN(C)c2ccccc2N(C(=O)C=C2CCNCC2)C1 852817660 GTLIAJLZQWMUTN-CQSZACIVSA-N 299.418 2.415 10 10 CECE CN(C)c1ccc(CNC(=O)C(C)(C)n2cccn2)cc1 854272071 XNQVAIPTERQPKI-UHFFFAOYSA-N 286.379 2.001 10 10 CECE COc1ccc(N2CCCNC[C@@H](C)C2)c(OC)c1 49664012 CPFQTDAJHWIFQV-GFCCVEGCSA-N 264.369 2.140 10 10 CECE C[C@H](NC(=O)c1cccnn1)c1ccc(N(C)C)cc1 860950062 HFXFWRWQVNKJHB-NSHDSACASA-N 270.336 2.034 10 10 CECE CSc1ncc(CN[C@@H]2CCC[C@H]2CN)s1 2243832127 HXFWEANANNGOIB-WCBMZHEXSA-N 257.428 2.082 10 10 CECE CC[C@@H]1CN(CCC(C)=O)c2cc3c(cc2N1)OCO3 76928991 XKDWRBMPCPDTLH-LLVKDONJSA-N 276.336 2.405 10 10 CECE CN(C)c1ccc2c(c1)[C@H](CN)N(c1cccc(O)c1)C2 82701823 BSSRSCOKCSQBSC-KRWDZBQOSA-N 283.375 2.478 10 10 CECE Oc1ccc([C@@H]2NCCc3cccc(F)c32)cc1O 83621866 YPAGKZZYVHMAKK-HNNXBMFYSA-N 259.280 2.472 10 10 CECE CC(C)(O)[C@@H]1CCCN1c1c(F)cc(CN)cc1F 707109800 VBVGVXZXEXETRS-LBPRGKRZSA-N 270.323 2.163 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@H]1CCC[C@@H]1O 689666713 PRVDCGSDASFNKJ-CJNGLKHVSA-N 278.396 2.131 10 10 CECE CC(C)(C)N(CCO)c1ccc(CN)cc1Cl 708508101 XHZKAYOBPZZFSJ-UHFFFAOYSA-N 256.777 2.396 10 10 CECE CSC(C)(C)CN(C)c1ccc2c(c1)NC(=O)[C@@H]2N 713986850 VDQNLBWPIUCNLJ-GFCCVEGCSA-N 279.409 2.216 10 10 CECE C[C@H](NCC[C@H](O)C(F)F)c1ccc(F)cc1O 716662813 ROOKOUDWUJGRDA-XVKPBYJWSA-N 263.259 2.198 10 10 CECE CNCc1ccc(N(C)CCN(C)C(=O)OC)cc1Cl 690712189 IWKVYLQDYPHVKR-UHFFFAOYSA-N 299.802 2.194 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CCN1 86123703 WZOYDHPRIALOPN-VIFPVBQESA-N 270.279 2.196 10 10 CECE CCc1nn(C)cc1CNCc1ccc2c(c1)CCO2 92386028 CMRBIJIZWCCBMA-UHFFFAOYSA-N 271.364 2.207 10 10 CECE CNCc1ccc(N2C[C@@H]3CCCN3C[C@@H]2C)c(C)c1 94462706 AAQVSOQOCPTOFM-HOCLYGCPSA-N 273.424 2.387 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]2C(F)F)c([N+](=O)[O-])c1 2115272020 RVNGYSRSMBOIPG-GMSGAONNSA-N 272.251 2.492 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCO[C@@H]2C[C@H]21 2115228872 JTEIPYKMEUAXMS-ZIAGYGMSSA-N 259.305 2.070 10 10 CECE O=C(N[C@@H]1CCC[C@@H]2CC[C@H]21)c1ccc(O)c(O)c1 2115776654 CZNFWFNLGVONOA-YUSALJHKSA-N 261.321 2.406 10 10 CECE CO[C@]1(C(F)(F)F)C[C@H](C(=O)N(C)CCN=[N+]=[N-])C1 2125548608 AGINBCCXPBUJGM-OTSSQURYSA-N 280.250 2.113 10 10 CECE O=C(NCc1cc(O)ccc1O)C1Cc2ccccc2C1 1176754797 HIOGTVDRQKVBOR-UHFFFAOYSA-N 283.327 2.129 10 10 CECE CCCOc1cc(N2CC3(CC[C@H]3O)C2)ccc1N 2123109868 UWYXSHBYRQQNQM-CQSZACIVSA-N 262.353 2.019 10 10 CECE Nc1ccc(CNCc2cnn(C(F)(F)F)c2)cc1 2118513278 DTOQSVCHAPPUAK-UHFFFAOYSA-N 270.258 2.231 10 10 CECE COC1(C(=O)NCc2c(O)cccc2O)CCCCCC1 1645366688 YOTGWPXOASVMBM-UHFFFAOYSA-N 293.363 2.453 10 10 CECE C[C@@H](NC[C@H](O)CC(F)(F)F)c1c(O)cccc1O 2119070101 CMQUBSJGCOKNQM-HTQZYQBOSA-N 279.258 2.062 10 10 CECE CC[C@]1(C)CCN1c1cc2c(cc1F)[C@H](O)C(=O)N2 2119485575 XMRIFEVMMZOGEK-GXTWGEPZSA-N 264.300 2.190 10 10 CECE CCCN(C(=O)[C@H]1[C@H]2OCC[C@@H]21)c1ccc(N)cc1 2119958879 OISJVRJIHQYYPF-MCIONIFRSA-N 260.337 2.047 10 10 CECE Cc1cc([C@@H](N)c2ccc(N(C)C)cc2)nc(C)n1 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CC[C@@H]1CN(C(=O)CCc2ccc(N)cc2)C[C@H](C)O1 689161824 UCOGRDDFHBRKSL-SWLSCSKDSA-N 276.380 2.227 10 10 CECE Cc1nnc(Sc2ncc([C@H](C)N)s2)s1 1958551697 MKWFWISVBOOQFO-BYPYZUCNSA-N 258.397 2.474 10 10 CECE COc1ccc([C@H](C)N[C@H](C)[C@@H](C)CO)c(O)c1 168791023 YBPVMZYLSFTEEC-AXFHLTTASA-N 253.342 2.068 10 10 CECE C[C@H]1CC(=O)CC[C@@H]1C(=O)NCc1ccccc1O 1137471636 UPHGVHARGGQFSR-GWCFXTLKSA-N 261.321 2.014 10 10 CECE CC(C)CN1CCN(Cc2ccc(F)c(F)c2O)CC1 703500566 FARFHJTXHBMIDM-UHFFFAOYSA-N 284.350 2.444 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCC(F)F 793799688 LXPRBVYDWDQILM-QMMMGPOBSA-N 273.279 2.190 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](O)C2)cc1C(F)(F)F 705570118 BZCDQQZRILOYRL-PSASIEDQSA-N 275.270 2.330 10 10 CECE CN1C[C@H]2CN(c3ccc4c(c3)CCCN4)C[C@H]2C1 707077350 YGVJZMXXNZWOJA-OKILXGFUSA-N 257.381 2.043 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H](C)[C@@H](C)OC)c1 191655644 DEIUVXCYWVSRCT-HBNTYKKESA-N 253.342 2.475 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2nccn2C)c(F)c1 62253001 YACRGDRHFJXCMC-LLVKDONJSA-N 276.359 2.476 10 10 CECE CC(C)N1CC[C@H](N)[C@]1(C)c1ccc(N(C)C)cc1 712058511 GJONLLDQDCMRKQ-HOTGVXAUSA-N 261.413 2.409 10 10 CECE COc1ccc(CNC[C@H]2CCN2C2CC2)cc1C 691834297 MULNQFGSZHZRLI-OAHLLOKOSA-N 260.381 2.330 10 10 CECE C[C@H]1CN(c2ccc([N+](=O)[O-])c(CO)c2)CC[C@@H](C)O1 694914659 QDYQSDLSFYHOQC-MNOVXSKESA-N 280.324 2.091 10 10 CECE CC[C@@]1(C)CN(c2ccc3c(c2)OCCO3)CCCN1 86285789 HLQNZCBMXQFPLJ-INIZCTEOSA-N 276.380 2.426 10 10 CECE COc1cccc(CN(CCCC(=O)O)C(C)C)c1O 86748640 YKXQRQMVDQIZLH-UHFFFAOYSA-N 281.352 2.476 10 10 CECE CN(CCF)c1ccc(CN)c(Br)c1 1917016882 CBLHOSWRNQWQPE-UHFFFAOYSA-N 261.138 2.314 10 10 CECE CC(C)(C)OC(=O)N1CC(C2CN(CCN=[N+]=[N-])C2)C1 1883485249 JEHNQWNCCLTAOP-UHFFFAOYSA-N 281.360 2.095 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1OCCc2ccccc21 1303225696 NMOYBFDTJPPSEC-MRXNPFEDSA-N 299.326 2.028 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC([S@](C)=O)C2)cc1 2115314013 MVJZCIRPIQGJQX-BUXKBTBVSA-N 280.437 2.314 10 10 CECE CN(c1ccc(CN)c2ccccc12)[C@H]1C[C@H](O)C1 2122885679 BDCADLFJYZYEDR-JOCQHMNTSA-N 256.349 2.258 10 10 CECE C[C@H](C(=O)NC1CCCC1)N1CCC[C@H]1CN=[N+]=[N-] 2123021736 XDGUYVFUCIWTHQ-PWSUYJOCSA-N 265.361 2.208 10 10 CECE Nc1ccc(OCCC(=O)O[C@H]2CCC[C@H]2F)cc1 2118911402 NTPXMUWMJJNEMM-OLZOCXBDSA-N 267.300 2.472 10 10 CECE C[C@@H]1[C@H](CO)CCN1c1ccc2c(c1)CCC[C@H]2N 2128275343 TVXAHFJVHJFAPJ-PVXIVEMSSA-N 260.381 2.230 10 10 CECE N[C@@H]1CCc2cc(N3CCC(CCO)CC3)ccc21 2128309030 MZQTZVYDOIAHQQ-MRXNPFEDSA-N 260.381 2.231 10 10 CECE N[C@H]1CCCN(c2ccc(OC(CF)CF)cc2)C1 2129972574 OSRYTTQTCQYKPV-NSHDSACASA-N 270.323 2.301 10 10 CECE CC[C@@](C)(CN)C(=O)N(C)[C@H](C)c1ccccc1O 211276171 FNSCHFIKOIVELS-ABAIWWIYSA-N 264.369 2.287 10 10 CECE CCN(Cc1ccc(N)cc1)[C@H]1CC(F)(F)C[C@@H]1O 2133286554 VHVXILWBPARCLX-STQMWFEESA-N 270.323 2.249 10 10 CECE C[C@H](NC(=O)c1cccs1)C(=O)N(C)CCCN=[N+]=[N-] 1912147963 NGLAITJIIXDZTD-VIFPVBQESA-N 295.368 2.025 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCCO[C@H]2CCOC2)C1 1912167474 LCOZTYLRVVBUPW-OLZOCXBDSA-N 268.361 2.204 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(S(=O)(=O)C2CC3(CCC3)C2)C1 1912151925 NCFOEYHISYXZQJ-JTQLQIEISA-N 284.385 2.281 10 10 CECE COc1cc(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)sn1 1912192331 DPKHOUKIFJWQEY-QMMMGPOBSA-N 281.341 2.314 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])C1(OC(C)C)CC1 1912206348 JHJUHAMSTZEUSJ-NSHDSACASA-N 284.360 2.166 10 10 CECE CCn1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)c(C)n1 1912204972 ZQKDDUSKXRIFJD-JTQLQIEISA-N 262.317 2.126 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3cccc(F)c3O)C[C@@H]21 2133893938 TZHMLWGORKCSCJ-KZVDOYCCSA-N 265.328 2.434 10 10 CECE COc1ccc(CN[C@H]2CCN3CCC[C@@H]23)cc1C 218336276 HDPBKHZTGVQKQT-GJZGRUSLSA-N 260.381 2.330 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 2134370246 QAIGVPZXGOPAHT-NDAKKZQWSA-N 257.381 2.159 10 10 CECE CC[C@H]1CCOCCN1c1ccc(CN)cc1F 1913611873 ALUWUWFPVWOVOG-LBPRGKRZSA-N 252.333 2.290 10 10 CECE CCc1cccc(CNCC(C)(C)[C@@H](C)O)c1O 1913825683 LKPHTSYJKXJXDI-LLVKDONJSA-N 251.370 2.451 10 10 CECE CN(CC1CC2(CC2)C1)C(=O)c1ccc(O)c(O)c1 1913803813 ZTNYIUCDIIWHEO-UHFFFAOYSA-N 261.321 2.360 10 10 CECE CO[C@@H]1CCN(c2ccc([C@H](C)O)cc2F)[C@H]1C 1914235789 HDWRLRCDYSNFNN-PKFCDNJMSA-N 253.317 2.493 10 10 CECE CNCc1ccc(N2CC[C@@H](O)[C@H]2C)c(C(F)(F)F)c1 1914244888 VUCMSCAWGQTQOI-NOZJJQNGSA-N 288.313 2.384 10 10 CECE Nc1ccc(COc2cc(Br)ncn2)cc1 1986582207 BUWKVQUDABABOQ-UHFFFAOYSA-N 280.125 2.400 10 10 CECE Clc1cccc(NN=NCCN2CCOCC2)c1 1860495332 VOLQPJPPFNHFMQ-UHFFFAOYSA-N 268.748 2.451 10 10 CECE O=C(O)[C@@]12CC[C@H]1CCN2Cc1cc(Cl)ccc1O 2136403793 BSPKTBRPSVPEAO-IINYFYTJSA-N 281.739 2.485 10 10 CECE Cc1cnc(C(=O)N[C@@H](C)c2ccccc2O)c(O)c1 1471194881 QFMVSOXHMMGBHW-JTQLQIEISA-N 272.304 2.292 10 10 CECE COC[C@H](CN[C@@H](C)c1ccc(N(C)C)cc1)OC 227712553 DHZMEYPZPCAQKT-WFASDCNBSA-N 266.385 2.065 10 10 CECE COc1ccc(N2CCC(C)(C)[C@H](O)C2)cc1OC 259180672 HLAHXPKFLDTSEA-CQSZACIVSA-N 265.353 2.301 10 10 CECE COc1ccnc(OC)c1NC(=O)c1cc(O)cs1 1637853538 GOWKWTVNGBXIRS-UHFFFAOYSA-N 280.305 2.118 10 10 CECE CCOC(=O)C(F)(F)[C@@](C)(N)c1ccc(N(C)C)cc1 1927396326 JIYFYLWXTOXUMK-ZDUSSCGKSA-N 286.322 2.125 10 10 CECE COC(=O)[C@@H](C(C)C)[C@@H](N)c1ccc2c(c1)CCN2C 1927407728 KPPGXPRZKHUVRD-GJZGRUSLSA-N 276.380 2.124 10 10 CECE C[C@@H](NC(=O)c1ccc(CO)cc1)c1ccccc1O 1642824424 ULZKQKKDDVRFNT-LLVKDONJSA-N 271.316 2.376 10 10 CECE CC[C@@H](C)CCNC(=O)Cc1ccc(O)c(O)c1 1641042799 VDNWXWFYWWRRHE-SNVBAGLBSA-N 251.326 2.193 10 10 CECE O=C(Cc1cccs1)NCc1cc(O)ccc1O 1651222458 GMZVIYIGXGDLEB-UHFFFAOYSA-N 263.318 2.018 10 10 CECE NCc1ccc(N(CCO)CC(F)(F)F)cc1Cl 231310297 XZJRWLBMSOSHNR-UHFFFAOYSA-N 282.693 2.160 10 10 CECE C[C@H]1[C@H](C)[C@@H](NCc2ccc(F)cc2O)CCN1C 2139879194 GJRYUVBSWONMOL-MJVIPROJSA-N 266.360 2.350 10 10 CECE CC[C@H]1CN(c2cc(Cl)c(CN)cc2F)C[C@@H]1CO 2140883486 NRZGHHHIAUQMQE-GXSJLCMTSA-N 286.778 2.393 10 10 CECE CN(C)c1ccc(CN2CC[C@H](N)C(C)(C)C2)cc1 258633761 CJOAHDQELXHXMC-HNNXBMFYSA-N 261.413 2.312 10 10 CECE COC(=O)N1CCC(NCc2ccc(Cl)cc2O)CC1 1205535744 RTYACOCCOSPBKQ-UHFFFAOYSA-N 298.770 2.366 10 10 CECE O=C(NCc1ccccc1O)c1cccc2c1OCC2 1149181363 MMOQCSXSAOBUMM-UHFFFAOYSA-N 269.300 2.257 10 10 CECE COc1ccc(O)c(CNC[C@@H](F)C(F)(F)F)c1 1876099080 DGOLFEOXKUSXMU-SNVBAGLBSA-N 267.222 2.391 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3O)C[C@@]1(C)O 1876937075 QSIKESWEEKTQSB-KNXALSJPSA-N 261.365 2.263 10 10 CECE Cc1cc(N(C)CC23CC(C2)[C@H](C)O3)ccc1CN 1878423525 ISRDNRWWRVIJAV-YGONEPDPSA-N 260.381 2.457 10 10 CECE Oc1cccc(Br)c1CN1CCCC12CNC2 1946766274 DVGTZZPUZOEDNX-UHFFFAOYSA-N 297.196 2.093 10 10 CECE C[C@@H]1CC[C@@H](CN(C)c2ccc([C@@H](C)N)c(O)c2)O1 1885266320 YHCSQVLZSJMPTI-WZRBSPASSA-N 264.369 2.416 10 10 CECE C[C@@H](N)c1ccc(N2CC(CCO)C2)c(Br)c1 1946924912 IYVMJHKMSKOTOZ-SECBINFHSA-N 299.212 2.287 10 10 CECE CN1CCc2cc([C@H](O)[C@]34C[C@H](CCO3)C4)ccc21 1887024289 KWNXWZKKIRJUCG-KNXALSJPSA-N 259.349 2.281 10 10 CECE C[C@@H]1C[C@H](CNCc2c(O)cccc2F)CCO1 1964078174 VBYYDNBQIWCPFH-GHMZBOCLSA-N 253.317 2.436 10 10 CECE CC(C)CO[C@H](C)C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2218745764 SHXXLLUVVGWPSZ-GMTAPVOTSA-N 254.334 2.395 10 10 CECE COCC(C)(COC)NCc1ccc(OC)c(C)c1 1965908252 MFEBOMPJCUEOFA-UHFFFAOYSA-N 267.369 2.145 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2CC[C@H]3O)c(F)c1 2144890078 VVAIEXGTKZTNLF-MZXFEWSRSA-N 278.371 2.456 10 10 CECE CN[C@@H](C)c1ccc(N2CCN(C)[C@H](C)C2)c(F)c1 251690774 IHPHVPVDAVZCLN-NEPJUHHUSA-N 265.376 2.246 10 10 CECE Cn1nc(CNCc2ccc(F)cc2O)cc1Cl 1967894851 HSSUVHHPLONFLW-UHFFFAOYSA-N 269.707 2.208 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3COCC[C@H]32)cc1O 2145021248 RUALCUPMNVBPSR-TYNCELHUSA-N 276.380 2.288 10 10 CECE CC[C@H](N[C@@H](C)[C@@H]1CCS(=O)(=O)C1)c1ccccc1O 1969540053 UPFMWTZTNVFOTC-SCRDCRAPSA-N 297.420 2.256 10 10 CECE C[C@]1(C(=O)O)C[C@H](NCc2ccc(Cl)cc2O)CCO1 1973210452 UFZINAKXKLJSSS-BXUZGUMPSA-N 299.754 2.158 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1C[C@H]1NCc1ccccc1O 1973223621 YPEZTGIGCGAXFD-CHWSQXEVSA-N 292.379 2.395 10 10 CECE Nc1ccc(OCC(=O)NC[C@@H]2C[C@H]3CCC[C@H]32)cc1 2145441187 YHMLKCVUPPJWBD-TYNCELHUSA-N 274.364 2.200 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)CC1[C@H]2CCC[C@H]12 2150199466 TXTRNILVJRXBEI-KBPBESRZSA-N 273.380 2.185 10 10 CECE C[C@H]([C@H]1CCCO1)[S@](=O)CCCOc1ccc(N)cc1 2145515359 QGCXVQVHNGJAHB-ASNKJTAVSA-N 297.420 2.354 10 10 CECE Oc1cc2c(cc1CNC[C@@H]1[C@H]3CCC[C@H]31)OCO2 1974359065 MCWWKGWEWANUQE-GDNZZTSVSA-N 261.321 2.257 10 10 CECE CC1(C)CCN(Cc2ccc(O)cc2O)C[C@H]1C(=O)O 2148672733 INWKDFFUZYASIT-LBPRGKRZSA-N 279.336 2.031 10 10 CECE CN(c1cc2c(cc1F)[C@H](O)C(=O)N2)C1CC(F)(F)C1 2145869409 ZJUWZCWBIJNOTK-NSHDSACASA-N 286.253 2.045 10 10 CECE COc1ccc(N(C)C)c(CC(C)(C)C(=O)O)c1 258742038 UUXLEXXBOOQMFP-UHFFFAOYSA-N 251.326 2.415 10 10 CECE C[C@@H](N)c1ccc(N2CCC3(CC2)C[C@H]3CO)cc1O 2148905455 GKLVIVKVQUVFBP-NEPJUHHUSA-N 276.380 2.011 10 10 CECE CCCN[C@H](c1ccccc1O)C1CCS(=O)(=O)CC1 2146242559 VCFZNSSJXWDAGT-HNNXBMFYSA-N 297.420 2.258 10 10 CECE COCCNCc1ccc(N2CC3(CSC3)C2)c(C)c1 2146387223 NXNBIHSIJBATRX-UHFFFAOYSA-N 292.448 2.284 10 10 CECE CCOC(=O)CCC[C@@H]1NCCc2cccc(O)c21 259778746 MHSLIGCZGQSHKZ-LBPRGKRZSA-N 263.337 2.312 10 10 CECE CCOC(=O)c1cc(-c2cc(C)c(O)c(O)c2)no1 260057656 GKVYPHDBDHBMKO-UHFFFAOYSA-N 263.249 2.238 10 10 CECE COC(=O)c1c(C)nn(Cc2ccccc2O)c1C 260800683 CKCKBBFCEHPPSS-UHFFFAOYSA-N 260.293 2.040 10 10 CECE COC(=O)CC[C@@H](N)c1ccc2c(c1)CCCN2C 260857761 IUNHCFGLQSDNDU-CYBMUJFWSA-N 262.353 2.022 10 10 CECE COC(=O)c1cnc(Sc2nnc(C)s2)s1 1985813344 BCCSLXUJNMPWBH-UHFFFAOYSA-N 273.364 2.241 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)CCc1ccco1 35360076 ZSPLAOQAECAGDM-UHFFFAOYSA-N 258.321 2.453 10 10 CECE CN[C@H]([C@H](O)c1ccc2c(c1)CCN2C)[C@@H]1CC1(C)C 2151072285 FESNMFYLFZDOGZ-CWRNSKLLSA-N 274.408 2.346 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CCn1ccnc1 38089619 WXKSDMZFQKTPQE-GFCCVEGCSA-N 273.336 2.198 10 10 CECE CN(C)[C@@H]1CC[C@H]1NCc1cccc(Cl)c1O 1996065384 NSCDMIREVAYXOD-VXGBXAGGSA-N 254.761 2.228 10 10 CECE C[C@H](CCS(C)(=O)=O)Nc1c(N)cccc1Cl 1997983361 PELSVBBZEBHXEL-MRVPVSSYSA-N 276.789 2.157 10 10 CECE OCc1cc(F)c(N2CCC[C@H]3OCC[C@H]3C2)c(F)c1 2151891146 XWJHYOGAFRVDPH-SMDDNHRTSA-N 283.318 2.462 10 10 CECE Nc1ccc(NC(=O)C[S@](=O)c2ccccc2)cc1 40960997 CQIWGISHUCDLSI-LJQANCHMSA-N 274.345 2.015 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CC4(C)CC3C4)ccc21 2153467934 PIFLUGCEDFHJJT-WMEQCIOUSA-N 271.364 2.278 10 10 CECE CCN(C)[C@@H]1CCN(c2c(F)cc(CNC)cc2F)C1 2154002103 ARDRJRGKGAHGGT-GFCCVEGCSA-N 283.366 2.215 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@@]3(C)CCO[C@H]23)c1O 2154146715 SKNJBENAHRLDSJ-DAXOMENPSA-N 277.364 2.448 10 10 CECE Cn1cc(Br)c(CN2CCC[C@H]2CN=[N+]=[N-])n1 2009447020 RDRPBDIDSYTVFL-QMMMGPOBSA-N 299.176 2.457 10 10 CECE CN(C(=O)[C@H](F)C(F)(F)F)c1ccc(N)cc1 2009565583 WSVJUEWVTPZSQD-QMMMGPOBSA-N 250.195 2.132 10 10 CECE COCCN1CCN(c2ccc([C@@H](C)O)cc2Cl)CC1 2154750602 OYHRIJZCWUDEJJ-GFCCVEGCSA-N 298.814 2.162 10 10 CECE CNCc1ccc(OC)c(COC2CCOCC2)c1 50126128 XMOSIIDVBXRPPO-UHFFFAOYSA-N 265.353 2.110 10 10 CECE CC[C@@H](c1ccccc1O)N(CCN)CC(F)F 2028623359 YPKXQHKUMCPPBL-NSHDSACASA-N 258.312 2.369 10 10 CECE C[C@H]1C[C@@H]([C@H](NN)c2ccccc2O)C[C@@H](C)O1 2029550046 PEZGTOCFMHSQCA-OXIWPEFWSA-N 250.342 2.100 10 10 CECE CCCNCc1cc(F)c(N(C)C[C@H](C)O)c(F)c1 62719056 MBEOQDBXRHDJNK-JTQLQIEISA-N 272.339 2.281 10 10 CECE CCCNC(=O)[C@H](C)N[C@H](C)c1ccc(F)cc1O 62746521 PGAUYQIAYKYCTL-ZJUUUORDSA-N 268.332 2.097 10 10 CECE C[C@@H]1C[C@H](CN(C)c2ccc(CN)cc2F)CO1 2040291864 CTFBCIHJMNJDCB-ZYHUDNBSSA-N 252.333 2.146 10 10 CECE CC1(C)CCCN(C[C@@H](O)COc2ccc(N)cc2)C1 70257896 VBPKQSMPFMYNRM-CQSZACIVSA-N 278.396 2.131 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)[C@@H]1CO[C@H](C)C1 401362754 CXECTMHLQAMTAY-VWYCJHECSA-N 251.326 2.268 10 10 CECE CCNCc1ccc(N2C[C@@H](C)C[C@@H](O)C2)c(F)c1 401516721 ZKIBYJATZZYQAI-WCQYABFASA-N 266.360 2.142 10 10 CECE COc1ccc(N(C)[C@]2(CN)CC[C@H]3CC[C@H]2O3)cc1 401656459 NMEBKZJVXWTBNV-OAGGEKHMSA-N 276.380 2.170 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C(C)(C)CCN 311495532 XDVUJQOWNZXNMS-NSHDSACASA-N 264.369 2.287 10 10 CECE Cc1ccc(CNCc2cccc(O)c2O)nc1C 314197955 QSKMSXDUFSNCQW-UHFFFAOYSA-N 258.321 2.399 10 10 CECE COc1cccc(O)c1CN1CC[C@@H](N(C)C)[C@@H](C)C1 2160729007 QRXQKGSYERZKME-GXTWGEPZSA-N 278.396 2.173 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@H]1COC(C)(C)CO1 2176667241 HLUXATFLGWTYNI-HNNXBMFYSA-N 278.396 2.285 10 10 CECE CCNCc1ccc(N(C[C@@H](C)O)C2CC2)c(F)c1 709501260 JQPDVIXVFDHKOG-LLVKDONJSA-N 266.360 2.285 10 10 CECE Oc1cccc(Br)c1CNC[C@]12COC[C@@H]1C2 706845265 ZPDNIJRUIOVTKE-TVQRCGJNSA-N 298.180 2.281 10 10 CECE C[C@@H]1CN([C@H](C)c2ccccc2O)C[C@@H](CC(=O)O)O1 2179282921 OGCMSHQAPIADQU-IJLUTSLNSA-N 279.336 2.017 10 10 CECE CCCNC[C@@H]1CCN1c1ccc(OC)c(OC)c1 710233858 VGLMBKFYQBQFFO-ZDUSSCGKSA-N 264.369 2.282 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)C[C@H]2CCCS2(=O)=O)c1 710646707 TZRXDZIPMWUPEJ-CHWSQXEVSA-N 297.420 2.271 10 10 CECE CN1CCCc2cc([C@@H](O)CC3CC(CN)C3)ccc21 2163104255 CNTUVIYBVVLDIF-FVKWTLKZSA-N 274.408 2.477 10 10 CECE COC[C@](C)(CO)N(C)c1ccc([C@H](C)N)cc1Cl 689793869 TWBQUYAXBBKZHR-HZMBPMFUSA-N 286.803 2.193 10 10 CECE CC[C@@H](CNCc1c(O)cccc1Cl)N(C)C 388899164 NCOMSGRUKPUCDZ-JTQLQIEISA-N 256.777 2.475 10 10 CECE Cc1nc[nH]c1CNCc1ccc2c(c1)CCN2C 380196633 AVDPNWIOOIYTCM-UHFFFAOYSA-N 256.353 2.000 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CCCC[C@@H]32)cc1 712382496 CXAKFMPBBDASCK-TUKIKUTGSA-N 274.364 2.343 10 10 CECE CC(C)[C@@](C)(O)CNCc1ccc2c(c1)CCN2C 389129048 SQKKNRNESMXSBL-INIZCTEOSA-N 262.397 2.176 10 10 CECE CO[C@H](CN1CCN(c2ccc(N)cc2)C1=O)C(C)C 384039477 UJUCDEOIUYCYEA-CQSZACIVSA-N 277.368 2.182 10 10 CECE COc1cccc(CN2CC(C)(C)[C@H]3COC[C@H]32)c1O 384825271 QVHSCJYYCSAWKF-QWHCGFSZSA-N 277.364 2.258 10 10 CECE Oc1c(CN2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3O2)ccc(F)c1F 718167718 SNZJISIQAMEDMV-FPQZTECRSA-N 281.302 2.280 10 10 CECE Cc1cnccc1C(=O)N(C)Cc1ccc(N)cc1 388367822 JYTXLDDEYPYWFW-UHFFFAOYSA-N 255.321 2.244 10 10 CECE Nc1ccc(OCc2cn([C@@H]3C[C@@H]4C[C@@H]4C3)nn2)cc1 2179334957 WPWDWCOPJVVHLW-YABSGUDNSA-N 270.336 2.410 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)c1ccc([C@@H](C)O)cc1F 724148517 URZJERDXEWRQSR-BIGNPOOSSA-N 253.317 2.493 10 10 CECE CC(C)[C@H](CO)CN[C@H](C)c1c(O)cccc1O 394069574 JCCNJELQSDQSCC-MNOVXSKESA-N 253.342 2.013 10 10 CECE CC[C@@H](CN(CCCN)c1ccc(OC)cc1)OC 396997671 YDFDQMJEKOGGNW-AWEZNQCLSA-N 266.385 2.275 10 10 CECE COc1cc(Cl)cc(CN[C@@H](C)c2ncon2)c1O 398003168 WOGGGZXABZDBHD-ZETCQYMHSA-N 283.715 2.288 10 10 CECE CC(C)(C)[C@]1(O)CCN(c2ccc(CN)c(F)c2F)C1 2177588732 SINOGULOHDAJRP-HNNXBMFYSA-N 284.350 2.411 10 10 CECE C[C@@H](CCCCO)N[C@@H](C)c1c(O)cccc1O 398788845 OXVMQKLUTQABJZ-QWRGUYRKSA-N 253.342 2.300 10 10 CECE C[C@@H](N)c1ccc(N2CCCOC[C@H]2C)cc1O 398987236 DVIJFUUUQCCZJX-GHMZBOCLSA-N 250.342 2.027 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC(C)(C(=O)O)C1 399298135 ODLVKXFACNBVGP-NSHDSACASA-N 262.353 2.220 10 10 CECE OC[C@@H]1C[C@H](NCc2ccc3c(c2)CCCO3)[C@H]2C[C@H]21 2166866661 RJVXVSLGJCJGSX-VGWMRTNUSA-N 273.376 2.118 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC[C@H]3[C@@H]2C[C@H]3O)c1O 2178167548 FHYALTBTZQDXNX-FPMFFAJLSA-N 295.766 2.203 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CC=CCC34CCC4)ccc21 2169177844 AFKQKYKXAKIIOM-CQSZACIVSA-N 269.348 2.328 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CC[C@H](c2ccco2)C1 2170667248 KCFWEJNMTYZQBR-NSHDSACASA-N 273.288 2.321 10 10 CECE Cc1cc(O)n2nc(C3CCCCC3)c(C(=O)O)c2n1 2080882225 JUHSBYLRQQQOGY-UHFFFAOYSA-N 275.308 2.489 10 10 CECE Cc1cc(CN)ccc1N(C)Cc1c(C)nn(C)c1C 2187824219 SQVJUUKZNRFVEG-UHFFFAOYSA-N 272.396 2.440 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ncccc1C(=N)N 2192590048 QTALMNYUKUHAFW-JTQLQIEISA-N 270.336 2.269 10 10 CECE COc1ccc(CN(C)[C@@H](C)c2ccccc2O)nn1 2192599967 HECQGHMAXUKUKP-NSHDSACASA-N 273.336 2.384 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H]3CC[C@@]3(CO)C2)c(F)c1 2198882315 SCMGCFYNVLAQNK-OSQNNJELSA-N 283.318 2.227 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2ccn3cnnc3c2)CC1 2188209773 KHTMPLDLEZFFQA-LBPRGKRZSA-N 271.328 2.394 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CCCN(C)CC2)cc1O 2192804416 ICTPEDYNSLNYDL-QWHCGFSZSA-N 278.396 2.366 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2CCC(=O)N(C)C2)cc1 2188486306 POUICWYVFLYNMY-IUODEOHRSA-N 275.396 2.024 10 10 CECE CN[C@@H](C1[C@@H](C)[C@@H]1C)[C@H](O)c1ccc(N(C)C)cc1 2094524652 WVQWBLQFTWSUFA-KUDNYVPYSA-N 262.397 2.276 10 10 CECE C[C@H]1SCCC[C@H]1NC(=O)CCOc1ccc(N)cc1 2197310042 UOCWIEOKDBYNLJ-BXUZGUMPSA-N 294.420 2.438 10 10 CECE CN[C@@H]1CCc2cc(N3CCCC[C@H](CO)C3)ccc21 2184729516 KEFIBOKDCIUUOR-SUMWQHHRSA-N 274.408 2.492 10 10 CECE CN(CC12CCN(CC1)C2)c1ccc2c(c1)CC[C@H]2N 2184710709 IPRFVVPDXDUKAK-MRXNPFEDSA-N 271.408 2.165 10 10 CECE OC[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)CC12CCC2 2184735144 CDEDBHWNUNRYKJ-XJKSGUPXSA-N 273.376 2.265 10 10 CECE Cc1c(CN(C)c2ccc3c(c2)CC[C@@H]3N)cnn1C 2184735883 LZOXUVPMNOYNSJ-INIZCTEOSA-N 270.380 2.311 10 10 CECE Nc1ccc(CS(=O)(=O)CCCOCC2CCC2)cc1 2184713936 FREOELYNAZCZQA-UHFFFAOYSA-N 297.420 2.390 10 10 CECE CCN1CC(CN(C)c2ccc3c(c2)CC[C@@H]3NC)C1 2184730139 RKGSPTFFGKGEKZ-KRWDZBQOSA-N 273.424 2.281 10 10 CECE CNCc1ccc(N(C2CC2)C2COC2)cc1Cl 2043126045 VFBIJPCDYWAIIQ-UHFFFAOYSA-N 266.772 2.427 10 10 CECE COc1ccc(N2CCNCCC2(C)C)cc1F 2044510868 ZLZZFGZINJVMTF-UHFFFAOYSA-N 252.333 2.413 10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2CCCSC2)cc1 2044733819 PIVMUTPMEYXTEA-JSGCOSHPSA-N 265.426 2.400 10 10 CECE CN1CCc2cc(C3(N)CCC4(CC3)OCCO4)ccc21 2044752319 LAUVGSLBSPXVKU-UHFFFAOYSA-N 288.391 2.150 10 10 CECE CC(C)C(F)(F)CN(C)c1ccc2c(c1)NC(=O)[C@@H]2O 2185376789 NUYBGFJVUJBCBY-GFCCVEGCSA-N 284.306 2.400 10 10 CECE CN(CC(F)(F)[C@@H]1CCOC1)c1ccc(CO)cc1F 2185373943 AAUMHCLVJRLQKN-LLVKDONJSA-N 289.297 2.426 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@H]1C[C@@]12CC2(F)F 2051975474 HCYJGHBJZGJBKS-QXFUBDJGSA-N 256.256 2.333 10 10 CECE CCCNC(=O)CCN1CCC[C@H](N=[N+]=[N-])CC1 2053255357 OWJJGVIZAJVPJF-NSHDSACASA-N 253.350 2.068 10 10 CECE Nc1ccc(CC(=O)Nc2ccc3c(c2)CNC3)cc1 2191745190 GBSNPZIBCNJHEK-UHFFFAOYSA-N 267.332 2.053 10 10 CECE NN[C@H](C[C@@H]1C[C@H]1C(F)(F)F)c1ccccc1O 2065545267 NEFZMECNVMCNJI-FXBDTBDDSA-N 260.259 2.485 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2CCOC[C@H]2F)cc1 2066653701 UGUYZQDSYGUJCL-HONMWMINSA-N 253.317 2.303 10 10 CECE CO[C@H]1CC[C@@H]1CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2066826799 LPUQVIQPIVTKPB-MXWKQRLJSA-N 252.318 2.103 10 10 CECE CCO[C@@H](CNCc1ccc(O)cc1O)C(C)C 2068093707 LTZUZVBUMSFETB-AWEZNQCLSA-N 253.342 2.249 10 10 CECE CNCc1ccc(N2CCC3(CC[C@@H]3O)CC2)cc1C 2187440596 GIMHGXWFUNPFAQ-INIZCTEOSA-N 274.408 2.456 10 10 CECE COC(=O)CCCN(C)[C@@H](C)c1ccccc1O 2072460382 KCNULEPMQWEVGH-NSHDSACASA-N 251.326 2.338 10 10 CECE C[C@H](NCC1CC2(CC[C@@H]2O)C1)c1c(O)cccc1O 2195362686 KBDXUMRSXCGUAF-SQKQQLTESA-N 277.364 2.300 10 10 CECE C[C@H]1SCCC[C@@H]1NC(=O)c1cccc(O)c1O 2076685967 MQXAOGBXCSVTRL-SCZZXKLOSA-N 267.350 2.112 10 10 CECE O=C(c1cccc(O)c1O)N1CCC[C@]12CCSC2 2102290661 FGPSGZDWVNUGKK-CQSZACIVSA-N 279.361 2.210 10 10 CECE C[C@H](N)c1ccc(N2CC(F)(F)C[C@]2(C)CO)cc1 2102791248 OKMQOOGYFVWDJC-GXFFZTMASA-N 270.323 2.303 10 10 CECE COc1ccc(CNC[C@H]2COC(C)(C)C2)c(O)c1 2103164121 HBEQIBFTSSDQRM-NSHDSACASA-N 265.353 2.306 10 10 CECE Cc1cccc(O)c1CN[C@H]1CCC[C@H](C(=O)O)C1 2104483704 JBCOZRNDQJAKDX-RYUDHWBXSA-N 263.337 2.434 10 10 CECE CN(C)[C@H]1CCCC[C@@H]1NCc1c(O)cccc1F 2104477325 KSPJSTYOLDXGSE-KBPBESRZSA-N 266.360 2.494 10 10 CECE CCN(Cc1c(O)cccc1F)C[C@H]1CCCCN1 2104510520 IUZZTZGKEAOSFB-GFCCVEGCSA-N 266.360 2.495 10 10 CECE c1cc2c(cc1N1CCC[C@@]13CCNC3)CCCO2 2106390362 XTJNMYBTLURPRR-INIZCTEOSA-N 258.365 2.344 10 10 CECE CCN(c1ccc2c(c1)OCCO2)[C@H]1CCCNC1 2106326020 NBGKNJMCJUZOQS-ZDUSSCGKSA-N 262.353 2.036 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]23CCC[C@H]2NCC3)cc1 2106795236 FNCIPYGZTCDTHU-OWCLPIDISA-N 260.381 2.318 10 10 CECE CC[C@]1([C@H](O)c2ccc3c(c2)CCN3C)CCCN1 2106790516 IZFOXQXEFHDXOO-HZPDHXFCSA-N 260.381 2.245 10 10 CECE CN(C)c1ccc([C@@]2(O)CCN(C(C)(C)C)C2)cc1 2106805842 QWOSXJQSBWTQHP-MRXNPFEDSA-N 262.397 2.444 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@](C)(O)C1CC1 2106849356 UXMVBNNNHALYDE-JKSUJKDBSA-N 260.381 2.100 10 10 CECE CC[C@@](O)(c1ccc2c(c1)CCN2C)[C@H]1CCOC1 2106801394 NWNAMFNQLCXDQN-GOEBONIOSA-N 261.365 2.313 10 10 CECE CCN(CC)c1ccc([C@@]2(O)CN3CC[C@H]2C3)cc1 2106821271 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278.396 2.420 10 10 CECE COc1ccc(N2C[C@H](OC)CC(F)(F)C2)c(C=O)c1 2235992042 JMNAQXWXCPMZAA-GFCCVEGCSA-N 285.290 2.368 10 10 CECE CCN1CCc2cc(N3CC(O)(C4CC4)C3)ccc21 2226659056 TVHBKBLRAHEKLX-UHFFFAOYSA-N 258.365 2.030 10 10 CECE CCN(CC1(O)CCC1)c1ccc2c(c1)OCCO2 2226772449 VHXIPVPYOVLNCF-UHFFFAOYSA-N 263.337 2.199 10 10 CECE COC(C)(C)[C@](C)(Oc1ccc(N(C)C)cc1)C(=O)O 2237684642 LNGUHSJLCKJKQL-OAHLLOKOSA-N 281.352 2.400 10 10 CECE CNCc1cc(OC)ccc1N1CCCOC[C@@H]1C 2227686360 RBXJIVOFKOEUJI-LBPRGKRZSA-N 264.369 2.030 10 10 CECE COc1ccc(N2C[C@H]3CSC[C@]3(C)C2)c(CN)c1 2227681307 HXIHOTYKBJEGCA-WFASDCNBSA-N 278.421 2.343 10 10 CECE CC[C@H](C)NCc1ccc(N2CCOCC2)cc1OC 2240052708 IYDQTAOLXAHPLL-ZDUSSCGKSA-N 278.396 2.420 10 10 CECE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@H](F)C2)cc1C 2240040362 PMPZYIZTOXNTGD-MAZHCROVSA-N 280.387 2.402 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC(F)(F)C[C@@H]1CN 2278907287 OAYPFDHKAULSEG-WCBMZHEXSA-N 274.286 2.261 10 10 CECE CCC[C@@H]1CNCCN1c1ccc(OC)cc1[N+](=O)[O-] 2240632858 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CN(c1ccc2c(c1)COCC2)[C@@H]1CNCC1(C)C 2274176836 MZXWKVUMMQZBNR-OAHLLOKOSA-N 260.381 2.194 10 10 CECE COC[C@]1(C)C[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2269187075 CDQFHBUETUDKBL-LOWVWBTDSA-N 266.345 2.208 10 10 CECE CSc1ncc(CNC(=O)[C@@H]2CCC[C@@H](N)CC2)s1 2269194356 AUYXCXNRSUPGJO-NXEZZACHSA-N 299.465 2.389 10 10 CECE CCS(=O)(=O)[C@H]1CCN(c2ccc([C@@H](C)O)c(C)c2)C1 2285159504 FHZKSEVCMPKUPA-OCCSQVGLSA-N 297.420 2.062 10 10 CECE C[C@@H](NCCCc1cnn(C)c1)c1cc(O)ccc1O 2295517984 RUDRIGPMNCIXTB-LLVKDONJSA-N 275.352 2.115 10 10 CECE CNCc1ccc(OC)c(C[S@@](=O)[C@H]2C[C@@H]3C[C@@H]3C2)c1 2285664670 UZJJXLLGDZPSHT-UHTBIJDUSA-N 293.432 2.462 10 10 CECE CC(C)Oc1ccc(N2C[C@@H]3OCC[C@@]3(CO)C2)cc1 2296359467 FVLNYKUEONQCHF-HOTGVXAUSA-N 277.364 2.061 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@@H]3C[C@H](C2)[C@H]3O)cc1 2286218817 BXMWWBRAGDQROR-JJAZEVLHSA-N 274.408 2.392 10 10 CECE NC[C@]12C[C@H]1CN(Cc1c(O)ccc3ccccc13)C2 2288261338 RDHHWUUZRCGGOD-GUYCJALGSA-N 268.360 2.326 10 10 CECE O=C1NN(c2ccccc2)C(=O)C1=Cc1ccccc1F 2297578147 KDRWAXJNYPTMKM-UHFFFAOYSA-N 282.274 2.287 10 10 CECE C[C@@H]1CSCCN1C(=O)C=Cc1ccc(O)c(O)c1 2308001443 JSJZBWNYUXHHJC-SNVBAGLBSA-N 279.361 2.075 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C=Cc1cccnc1 2308464810 VNFFLQLFPIEYIZ-LBPRGKRZSA-N 298.342 2.253 10 10 CECE N[C@@H]1C[C@@H]2C[C@H]1CN(c1ccc(OCF)cc1)C2 2313509616 HBWLOIJGRISWQW-COPLHBTASA-N 250.317 2.166 10 10 CECE CCO[C@H]1CC[C@H](C(=O)N(CC)CCN=[N+]=[N-])C1 2315992743 QTLGVAXNGFDZDR-QWRGUYRKSA-N 254.334 2.350 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)c(Cl)c1 2333103937 PNNNBMPDGSDGIJ-HUBLWGQQSA-N 280.799 2.267 10 10 CECE Nc1ccc(CC(=O)NCC[C@H]2CCC2(F)F)cc1 2335262240 FHSRZATUCUITOP-LLVKDONJSA-N 268.307 2.363 10 10 CECE CC12CC(C1)[C@H](C(=O)N1CCC[C@H](N=[N+]=[N-])C1)CO2 2337659069 FTPKYDSNRPCNQH-PCQVFGIUSA-N 264.329 2.103 10 10 CECE Oc1cc2c(cc1CN[C@H]1C[C@@H]3C[C@H]1C[C@H]3F)OCO2 2354321273 WLTMDGAIKJLUTK-XPXLGCRWSA-N 279.311 2.347 10 10 CECE CCN(CC)c1ccc([C@@H](NN)[C@@H]2CCO[C@@H]2C)cc1 2354609963 TUPJNRXZAZMVNB-DAXOMENPSA-N 277.412 2.462 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@]1(O)CC[C@@H]2C[C@@H]21 2354609980 UFPOYTYCUVJFPV-RNCIANSQSA-N 272.392 2.100 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@@H]2C[C@H](C(=O)O)[C@@H]2C1 2355437487 METDABUWNPFSSV-WTTBSCSTSA-N 279.311 2.245 10 10 CECE COc1ccc2c(c1)CCN2Cc1cccc(C(N)=O)c1 58944884 HYRNSTWXVPXCCO-UHFFFAOYSA-N 282.343 2.357 10 10 CECE CC[C@](C)(CN)CN1CCN(c2ccc(OC)cc2)CC1 51212309 MVJGIJRYBHDZLZ-QGZVFWFLSA-N 291.439 2.192 10 10 CECE CN1CCCc2cc([C@@H](NC3CCCC3)C(N)=O)ccc21 50287653 JNEDAOFLWKNCHS-MRXNPFEDSA-N 287.407 2.128 10 10 CECE Cc1cc(CN(C)Cc2cc([N+](=O)[O-])ccc2O)no1 172621127 FKSYSZKDHHREKA-UHFFFAOYSA-N 277.280 2.229 10 10 CECE CCCNC(=O)CN(C)c1ccc(CNCC(C)C)cc1 62737364 FTBOBMQUSIOEIJ-UHFFFAOYSA-N 291.439 2.395 10 10 CECE CNc1ncnc(Sc2nccs2)c1OC 134963651 CXCFWVMLZHIVAU-UHFFFAOYSA-N 254.340 2.135 10 10 CECE CN1CCCc2cc([C@@H]3[C@H](N)CCCN3C)ccc21 70296869 WSANKZVGRNAWTG-GDBMZVCRSA-N 259.397 2.163 10 10 CECE COc1c(F)cc(CN(C)O)c(O)c1Br 218799354 CXFGQQOKWOCHOR-UHFFFAOYSA-N 280.093 2.123 10 10 CECE CCN(CC)[C@@](C)(C(=O)O)c1ccc(N(C)C)cc1 37902615 HNRPURFVWQCDSV-OAHLLOKOSA-N 264.369 2.394 10 10 CECE CC(=O)c1cccc(NC(=O)COc2ccc(N)cc2)c1 38055707 KTUYDAIILLZQCW-UHFFFAOYSA-N 284.315 2.489 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(N)=O)c1ccc(F)cc1Cl 236167271 IWXGMTKPFROJQI-JTQLQIEISA-N 285.710 2.296 10 10 CECE CC[C@]1(C)C[C@@H]1C(=O)NCc1cccc(OC)c1O 136615770 DTBOUYYRXQGVRK-IAQYHMDHSA-N 263.337 2.453 10 10 CECE CC(C)[C@H](N)CC(=O)N(C)[C@@H](C)c1ccccc1O 136408578 LWWZPMWYGYFNPJ-WCQYABFASA-N 264.369 2.285 10 10 CECE CN1CCc2ccc(NC(=O)c3cccc(O)c3O)cc21 193153182 MFIAIKBKEDZPFU-UHFFFAOYSA-N 284.315 2.342 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC[C@@H](C(F)(F)F)C3)ccc21 227819903 ANQGGSMUXXYNTO-PELKAZGASA-N 299.296 2.417 10 10 CECE CN(C[C@H]1CCCOC1)c1ccc(CN)c(F)c1 135228231 XYBJFPNBHIWOME-LLVKDONJSA-N 252.333 2.147 10 10 CECE CCOc1cccc(CN[C@H]2CCC[C@H]2CO)c1O 230681231 BWDYENNFFBYPDN-STQMWFEESA-N 265.353 2.042 10 10 CECE CCNCc1ccc(N2CC[C@@H](CO)C2)cc1Cl 233537744 FOLBJYMYMHCUJT-LLVKDONJSA-N 268.788 2.268 10 10 CECE CC[C@@H](C)N(C)[C@@H](CN)c1ccc2c(c1)CCN2C 50287100 LSNWGHRXRSTBMO-WBMJQRKESA-N 261.413 2.409 10 10 CECE CN1CCCc2cc([C@]3(C)CC[C@@H](C(=O)O)N3)ccc21 606607453 LAYMINBDUUKSIM-BBRMVZONSA-N 274.364 2.121 10 10 CECE CN(C[C@H]1CCCO1)c1ccc(/C=C\C(=O)O)cc1 250494606 YYMUKVQBTSLFJY-DEBLGDTFSA-N 261.321 2.400 10 10 CECE CCNCc1ccc(OC)c(CN(C)[C@H]2CCO[C@H]2C)c1 250219909 YIFKMDSWVCFGSQ-BBRMVZONSA-N 292.423 2.414 10 10 CECE CN(Cc1ccc(N(C)C)c(F)c1)CC1(CO)CC1 275838346 GPWCJGHIFCGTJV-UHFFFAOYSA-N 266.360 2.096 10 10 CECE C[C@H](c1cc(O)ccc1O)N1[C@H](CN)C[C@H]2CCC[C@H]21 2164807090 PAHIHJMZIJYHRU-MCYUEQNJSA-N 276.380 2.361 10 10 CECE COc1cc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)ccn1 2166951383 XBEBDSQSPRJSCQ-LLVKDONJSA-N 275.312 2.395 10 10 CECE COc1cc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])cc(C)n1 2166949447 NUDSYIBEKHXHNS-LLVKDONJSA-N 275.312 2.314 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@]3(CCOC3)C2)c(Cl)c1 2168210282 GTCCUTMWWXFQSX-XHDPSFHLSA-N 296.798 2.355 10 10 CECE CCN[C@H](CC)c1ccc(N(C)CCC(N)=O)cc1 723151012 PWISZTRQEWZSIK-CQSZACIVSA-N 263.385 2.059 10 10 CECE O=C(NCc1cc(Br)ccc1O)C(F)F 804739137 RYSRFAQOFDYEFU-UHFFFAOYSA-N 280.068 2.036 10 10 CECE NN[C@H](COCC1CC1)c1ccc(N2CCCC2)cc1 2163090827 AFYYIIXPDQLHGF-MRXNPFEDSA-N 275.396 2.218 10 10 CECE CN[C@H](c1ccc(N2CCCCC2)cc1)c1nc[nH]n1 2163096250 HLHRUQDXFAEXOY-CQSZACIVSA-N 271.368 2.104 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2[C@H]3CNCC[C@H]32)cc1 2163106010 LQMPDTGLMMLFTC-TWMKSMIVSA-N 274.408 2.422 10 10 CECE CN1CCC(C[C@H](N)c2ccc3c(c2)CCN3C)CC1 2163138153 KNAHGTGFYAREHE-INIZCTEOSA-N 273.424 2.411 10 10 CECE CN1CCc2cc([C@H](NN)c3cncc(Cl)c3)ccc21 2163155571 HDUUHKFVNSICGV-HNNXBMFYSA-N 288.782 2.280 10 10 CECE Cc1cc(O)nc(CCNCc2cccc(Cl)c2O)n1 2163208887 MXOBMHHXUTUFJA-UHFFFAOYSA-N 293.754 2.182 10 10 CECE C[C@@]12CCN(C(=O)c3cccc(O)c3O)C[C@H]1C2(F)F 294517076 BWPNAKZPMZQSHS-ZWNOBZJWSA-N 283.274 2.215 10 10 CECE CC(=O)c1cc(F)cc(CN2CCC3(CCN3)CC2)c1O 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Cc1cc(O)c(CNCC2(N)CCC2)c(Cl)c1 841050133 YHBVWRNDMKUMOB-UHFFFAOYSA-N 254.761 2.325 10 10 CECE COc1ncncc1CNCc1ccc(N(C)C)cc1C 842680854 CBPCGIUSECICOQ-UHFFFAOYSA-N 286.379 2.149 10 10 CECE COC[C@H]1CN(Cc2c(O)cc(C)cc2Cl)CCO1 840917420 KBJUHCWAFMRMBX-LLVKDONJSA-N 285.771 2.201 10 10 CECE CN(C)c1ccc(/C=C\CNCCc2cncn2C)cc1 857783083 SGOREZVYOKJJJQ-PLNGDYQASA-N 284.407 2.332 10 10 CECE CC(C)(C)OC(=O)[C@H]1CCN[C@@H]1c1c(O)cccc1O 1952824286 ANEQVQXVOYOUFD-ZANVPECISA-N 279.336 2.090 10 10 CECE O=C(N[C@H](c1ncccn1)C1CC1)c1cc(O)cs1 928576656 YVTQTSFCAWAVCI-NSHDSACASA-N 275.333 2.125 10 10 CECE Nc1ccc(OCCC(=O)N2C[C@H]3CCC[C@H]3C2)cc1 157920004 RUUFCLWXBSQOGB-BETUJISGSA-N 274.364 2.296 10 10 CECE CCOc1cccc(CN2CC[C@H]3COC[C@@H]32)c1O 1899148042 KMRBIOMRMZUOLO-STQMWFEESA-N 263.337 2.012 10 10 CECE O=C(O)/C=C/c1ccc(N2CC[C@@H]3COC[C@@H]3C2)cc1 690384215 LETRIYAJEXVJSC-IVDJAJHCSA-N 273.332 2.257 10 10 CECE Cc1ccc(C(=O)N2CC[C@@H]2C(F)(F)F)c(O)c1O 854521425 VLIXWLYRWLRLPN-MRVPVSSYSA-N 275.226 2.183 10 10 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C[C@H](CNC(=O)c1cccc(O)c1O)c1ccncc1 790863475 BCAUGOUQAURNOI-SNVBAGLBSA-N 272.304 2.026 10 10 CECE CSC[C@H]1CCN(c2cc3c(cc2N)NC(=O)CC3)C1 706681976 BDACEXVIQCJYLO-JTQLQIEISA-N 291.420 2.343 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2CCC[C@@H]2O)c(F)c1 708591434 UPSHLNUJUNWBMP-HERUPUMHSA-N 253.317 2.229 10 10 CECE Nc1ccc(CN(C(=O)C2CCOCC2)C2CC2)cc1 61670992 GZRPBTUJTZPXLZ-UHFFFAOYSA-N 274.364 2.186 10 10 CECE CN(C)c1ccc([C@H](N)c2cnn3c2CCCC3)cc1 686888602 YLNVNPHHZUIWPE-INIZCTEOSA-N 270.380 2.334 10 10 CECE C[C@H](NCc1cccnc1O)c1cc(F)ccc1O 714963386 GVQMAECZGNITQR-VIFPVBQESA-N 262.284 2.483 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CN(C)C(C)(C)C2)cc1O 694151465 YDMMUXUAQOJMAX-AAEUAGOBSA-N 278.396 2.364 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2)C[C@]1(C)CO 694707343 JRGFJUONFOGWEH-CXAGYDPISA-N 274.408 2.393 10 10 CECE CN(C)c1ccc(CN(C)[C@H](CN)C(F)(F)F)cc1 698784255 BPJMANSBVZVNDN-GFCCVEGCSA-N 275.318 2.074 10 10 CECE O=C(C[C@@H]1Cc2ccccc2O1)NCc1ccccc1O 1150536643 PZKYTOICKIWUIF-AWEZNQCLSA-N 283.327 2.402 10 10 CECE CC1(C)C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C(C)(C)O1 1152611765 CVMXSBZTSCWYCK-CYBMUJFWSA-N 293.363 2.103 10 10 CECE CC(C)CCNC(=O)[C@H](C)N(C)CCCN=[N+]=[N-] 1912167753 ORPUEBCLLVCLOB-NSHDSACASA-N 255.366 2.169 10 10 CECE C[C@@H]1CN(CCc2ccc(N)cc2)CC[C@H]1CCO 2115816968 DXPXIJKWZYPHMV-HIFRSBDPSA-N 262.397 2.152 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2ccnc(F)c2F)CC1 2117729518 WYGTYQUCHUGLIA-UHFFFAOYSA-N 267.239 2.180 10 10 CECE C[C@@H]1C[C@H](O)CN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128270231 CANNJFVFBYBTTL-WPGHFRTFSA-N 261.365 2.263 10 10 CECE CN(C)c1ccc(CNC[C@H]2[C@H]3OCCC[C@H]23)cc1 2119935241 ULBCVUCGWGPGGB-OAGGEKHMSA-N 260.381 2.267 10 10 CECE C[C@@H]1[C@H](N(C)C)CCN1c1ccc2c(c1)CC[C@@H]2O 2128318876 XVKFXCGJNQYJJP-LYRGGWFBSA-N 260.381 2.195 10 10 CECE O[C@H]1CCc2cc(N3CCO[C@H](C4CC4)C3)ccc21 2128321796 KLHNDHFNLUTVFE-HOTGVXAUSA-N 259.349 2.281 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1C[C@@H](n2cncn2)C1 2127676531 TWYWOXWGJKEXOW-PHIMTYICSA-N 278.743 2.130 10 10 CECE CNCc1ccc(N(C)[C@@H](CCO)C(F)(F)F)cc1 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[N-]=[N+]=NC[C@H]1CCN(C(=O)c2cnn3ccccc23)C1 1912194432 KYUMEZVFWWUZFF-SNVBAGLBSA-N 270.296 2.107 10 10 CECE [N-]=[N+]=NCCN[C@@]1(C(=O)O)CCCCC12CCC2 1912153230 FMRPXVOXTQBTBM-GFCCVEGCSA-N 252.318 2.454 10 10 CECE CCOC1CC(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 1912145462 HMHPEICQKCYJNR-HSOILSAZSA-N 252.318 2.103 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cc(Cl)nnc2Cl)C1 1912191376 QYNFTVDZVOBBTR-YFKPBYRVSA-N 287.110 2.308 10 10 CECE [N-]=[N+]=NCC1CCN(CCOC[C@H]2CCCO2)CC1 1912201374 TVTCYXSWPIVUIH-CYBMUJFWSA-N 268.361 2.204 10 10 CECE CC[C@@H]1CCCN(C[C@@H](O)COc2ccc(N)cc2)C1 218388631 GGZYIVOEEGXKJE-UKRRQHHQSA-N 278.396 2.131 10 10 CECE COC[C@@H]1C[C@@H]1CN(C)c1c(F)cc(CO)cc1F 2133437219 JLGUZHRHFFPKPF-MNOVXSKESA-N 271.307 2.176 10 10 CECE CCc1nc([C@@H](NC)c2ccc(N(C)C)cc2)cn1C 1913459291 LDMKRXREDNLLTK-INIZCTEOSA-N 272.396 2.357 10 10 CECE CS[C@H]1C[C@@H](CNC(=O)CCc2ccc(N)cc2)C1 2134051886 HFEKTTPGOIRFLF-XBXGTLAGSA-N 278.421 2.459 10 10 CECE CCN1CCc2cc([C@@H](O)c3n[nH]cc3C)ccc21 2134192733 FHONICXPBHSLFY-OAHLLOKOSA-N 257.337 2.182 10 10 CECE CN(CC1(C)COC1)c1ccc(C=CC(=O)O)cc1 1912014694 VCIMPTQWUMDADH-UHFFFAOYSA-N 261.321 2.257 10 10 CECE CO[C@@H]1CCN(c2ccc([C@H](C)N)c(O)c2)[C@H]1C 1914270179 YMXKYTUUJNKOCQ-PKFCDNJMSA-N 250.342 2.026 10 10 CECE CN(CC1=CCSC1)c1cc2c(cc1N)OCCO2 1916813609 MHNDAHKPZQAFGV-UHFFFAOYSA-N 278.377 2.149 10 10 CECE CN(CCF)c1c(F)cc(C=CC(=O)O)cc1F 1917026002 GTEKNFLJLIANTJ-UHFFFAOYSA-N 259.227 2.468 10 10 CECE CCCCN(C)c1ccc(CNCC(=O)O)cc1OCC 212002455 HVPMWKMBWOJRLA-UHFFFAOYSA-N 294.395 2.496 10 10 CECE Nc1ccc(-n2nc(C(F)(F)F)cc2C(=O)O)cc1 107265152 KVYKESWVOQXMOI-UHFFFAOYSA-N 271.198 2.172 10 10 CECE CC(=O)c1ccc(N(C)C(=O)/C=C\c2cn(C)cn2)cc1 1536392966 DYFWDROWJNJGSG-TWGQIWQCSA-N 283.331 2.299 10 10 CECE C[C@H]1CCCC[C@@]1(O)CNCc1cccc(O)c1O 2136796217 LBBJHBCTVFQHAJ-XHDPSFHLSA-N 265.353 2.129 10 10 CECE O=C(NCc1cccc(Br)c1O)C(F)(F)F 1923188274 AGXDGKMUVHPSQY-UHFFFAOYSA-N 298.058 2.333 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCc2c(O)cccc21 1629189137 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2.434 10 10 CECE Cc1cc(C(N)=O)ccc1CN(C)Cc1ccc(N)cc1 166032514 IDRJHQKNNNJXCY-UHFFFAOYSA-N 283.375 2.308 10 10 CECE CCc1cc(CNCC(C)(C)CN)ccc1OC 258671869 CWJJKWDIHYDIOG-UHFFFAOYSA-N 250.386 2.332 10 10 CECE Cc1cc2c(cc1N(C)C(C)(C)CCN)OCCO2 258680728 AVOBYVPLRNLPEU-UHFFFAOYSA-N 264.369 2.330 10 10 CECE C[C@H](N)c1cccc(NC(=O)c2cccc(O)c2O)c1 126089975 DLOVEJVKPSWPEB-VIFPVBQESA-N 272.304 2.370 10 10 CECE CC[C@H]1OCC[C@H]1C(=O)N(C)Cc1ccc(N)cc1 234118289 OXAWGJPGUSIEEI-ZIAGYGMSSA-N 262.353 2.042 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)CCSC 1943690058 JHRZZQZNARFZOQ-QWHCGFSZSA-N 255.383 2.157 10 10 CECE COc1ncc(CN(C)Cc2ccccc2O)s1 876615562 HYJTVKUPORRCSO-UHFFFAOYSA-N 264.350 2.489 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](C)[C@](C)(O)C2)cc1O 1876950854 XNDHYUKOWVZFRX-JRPNMDOOSA-N 264.369 2.009 10 10 CECE C[C@@H]1[C@@H](N(C)Cc2ccc(N)cc2)C2CCN1CC2 1877896788 NCSWOOKSEZIOJO-MLGOLLRUSA-N 259.397 2.183 10 10 CECE CCNCc1ccc(OCCO[C@@H]2CCOC2)c(C)c1 2143661073 RECCYYWEAZVJLO-OAHLLOKOSA-N 279.380 2.289 10 10 CECE C[C@H]1C[C@H](NCc2c(O)cccc2F)CCN1C 896637393 JPWRPQLMFIETTO-WDEREUQCSA-N 252.333 2.104 10 10 CECE CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1885562258 CWPFMPMECPHRTB-JTQLQIEISA-N 299.375 2.304 10 10 CECE CC(C)(/C=C/C(=O)NCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1885563269 RUKVEURCXANRJR-VOTSOKGWSA-N 297.359 2.272 10 10 CECE Nc1ccc(CC(=O)N2CCC[C@H](C(F)F)C2)cc1 1964396547 LCAPZYKNOGXXQE-NSHDSACASA-N 268.307 2.315 10 10 CECE O=C(O)[C@H]1CCN(Cc2c(O)cccc2F)CC1(F)F 1964732103 GUSRMLRFCNMGFA-SECBINFHSA-N 289.253 2.073 10 10 CECE O=C(N[C@H]1C[C@H]2C[C@H]1CC2(F)F)c1cccc(O)c1O 1965444944 MTZSEOJHVRGCJM-XKSSXDPKSA-N 283.274 2.261 10 10 CECE C[C@]12CSC[C@@H]1CN(c1ccc([N+](=O)[O-])c(CO)c1)C2 2144753244 RSPQLARSZCCZPW-FZMZJTMJSA-N 294.376 2.276 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1[C@H]2COCC[C@H]21 1968788523 FIJGPDBOCXJZHC-IKVITTDRSA-N 275.348 2.194 10 10 CECE CN(Cc1ccccc1O)C(=O)C(C)(C)[C@@H](N)C1CC1 1968866410 WXUQGZBIYYXUAG-AWEZNQCLSA-N 276.380 2.114 10 10 CECE CCN(Cc1ccn2ncnc2c1)c1ccc(N)cc1 2148724049 IBNRDUMVBAOIKV-UHFFFAOYSA-N 267.336 2.338 10 10 CECE C[C@@]1(C(=O)O)C[C@@H](NCc2c(O)cccc2Cl)CCO1 2148830967 BWAHWSLWJLITMW-XPTSAGLGSA-N 299.754 2.158 10 10 CECE O=C1Nc2cc(N3CC[C@H]3C3CCCC3)ccc2[C@@H]1O 2145710907 WQJQSIXSRUMXAD-GJZGRUSLSA-N 272.348 2.441 10 10 CECE CC1(C)CCN(c2ccc([N+](=O)[O-])c(CO)c2)CCO1 2148829364 JEJSELFUDFBJML-UHFFFAOYSA-N 280.324 2.092 10 10 CECE CN1C[C@@H](CN)C[C@@H]1c1ccc(C(F)F)cc1O 258509950 YGIDWFCQTBOVLC-LDYMZIIASA-N 256.296 2.281 10 10 CECE CCNCc1ccc(N2CCN(C)CC2(C)C)c(F)c1 2150436208 DOHONCUAEANTTH-UHFFFAOYSA-N 279.403 2.466 10 10 CECE Cc1n[nH]c(SCCCC(=O)Nc2ccc(N)cc2)n1 41632564 HOUOYLPKXRAQSR-UHFFFAOYSA-N 291.380 2.206 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@@H](OC(=O)N(C)C)C1 2146479767 BVDASQQEPNLOGX-NWDGAFQWSA-N 278.352 2.226 10 10 CECE Nc1ccc(CCCN2CC[C@@H](N3CCCC3)C2)cc1 158222339 QPDZACPVRBLEQW-QGZVFWFLSA-N 273.424 2.372 10 10 CECE CCOC(=O)C1=C[C@@H](c2ccccc2O)N(C)CC1 260609071 QVDSMUNBXUUEBY-ZDUSSCGKSA-N 261.321 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10 10 CECE C[C@@H](N)c1ccc(N2CC3(CC[C@H]2CO)CC3)cc1O 2154155930 JGGQUYLWZPSZHQ-YPMHNXCESA-N 276.380 2.153 10 10 CECE CC(C)n1ncnc1[C@@](C)(N)c1ccc(N(C)C)cc1 2154615084 XBSOVVVTPFDRNE-HNNXBMFYSA-N 273.384 2.147 10 10 CECE CCc1cnn(C)c1[C@](C)(N)c1ccc(N(C)C)cc1 2154704110 UAEDITLPYHOVDD-MRXNPFEDSA-N 272.396 2.271 10 10 CECE N[C@H](c1ccccc1O)[C@H](O)c1ccn(C2CCC2)n1 2155187946 CNNJCMRPLCFZJR-HUUCEWRRSA-N 273.336 2.047 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CCN[C@H]2CC[C@@H]21 2016999919 OUKRUEINVWKLKK-KPXOXKRLSA-N 251.761 2.475 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1[C@H]2CCCCN[C@H]21 2016902355 JOXOADWZSSOCEV-XXILOJSOSA-N 251.761 2.475 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CC[C@@H]2CNC[C@@H]21 2016950517 ALYIPFPYFXFHBV-VDDIYKPWSA-N 251.761 2.332 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CO)c(Cl)c1 2018112552 ODPUPVVOKPGTNT-RNCFNFMXSA-N 255.745 2.182 10 10 CECE C[C@H]1SCCC[C@@H]1NCc1ccc(O)cc1O 2020609307 VFBSLPJLBUNAKM-SKDRFNHKSA-N 253.367 2.472 10 10 CECE NCc1ccc(N2CC[C@]3(CCCO3)C2)cc1F 2028414862 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C[C@H](N[C@@H]1CCN2CCCC[C@H]12)c1c(O)cccc1O 300436125 FFFVUDAJRFDXJT-YNEHKIRRSA-N 276.380 2.375 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@H]2CN1[C@@H](C)c1c(O)cccc1O 300443587 XRRDLVCHHMXCSW-WUHRBBMRSA-N 276.380 2.089 10 10 CECE COc1cccc(CNCC(C)(C)C[C@@H](C)O)c1O 304274374 FUBOZVMTVWPKAV-LLVKDONJSA-N 267.369 2.288 10 10 CECE CC(=O)c1ccc(O)c(CN(C)[C@H]2CO[C@@H](C)C2)c1 401472219 PPHKLEYSIIQQMS-IINYFYTJSA-N 263.337 2.204 10 10 CECE CCN1CCCN(c2ccc([C@@H](C)NC)cc2)CC1 307786407 HMKMTBKOJGIZFB-CQSZACIVSA-N 261.413 2.499 10 10 CECE C[C@H]1CN(C2CC2)CCN1c1c(F)cc(CN)cc1F 402663804 RKNIVSHVCPBEIB-JTQLQIEISA-N 281.350 2.096 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H]2CNC[C@H]2C1 312064003 JWDXMDHSJJGDMT-WOPDTQHZSA-N 264.344 2.134 10 10 CECE COc1ccc(N(C)CC[C@@H](O)CNCC(C)C)cc1 312420427 RGKNRNMPQCSTSH-OAHLLOKOSA-N 280.412 2.128 10 10 CECE Oc1ccc(CNCCOCC2CCCC2)c(O)c1O 313255792 SEXOURGFHAMIMH-UHFFFAOYSA-N 281.352 2.100 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CN3CC[C@H]2C3)c(F)c1 2158737727 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10 CECE CCCC1(O)CN(c2ccc(CNCC)cc2F)C1 384134943 LYWZDCGCVKLJEC-UHFFFAOYSA-N 266.360 2.286 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)cc1 384681513 DTAPXIXKVDIIGN-QXSJWSMHSA-N 259.397 2.093 10 10 CECE NC[C@@H]1C[C@@H]2CCC[C@@H]2N1Cc1cc(F)cc(F)c1O 2164797743 APNLBJWKCIECAY-WFBYXXMGSA-N 282.334 2.372 10 10 CECE CCOc1ccc(N2CC[C@@H]2CNC)cc1OCC 696363898 HWTVTHVLURCQPI-CYBMUJFWSA-N 264.369 2.282 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc([C@H](C)N)cc1F 385783178 MEKJMWIMNCQOOC-VHRBIJSZSA-N 266.360 2.443 10 10 CECE Cc1csc(CN(C)c2ccc(CN)cc2C#N)n1 387533755 QKEGESCTELOACW-UHFFFAOYSA-N 272.377 2.418 10 10 CECE COc1ncccc1[C@H](N)c1ccc(N(C)C)cc1 388052476 CNSXEHZVYHFMRT-CQSZACIVSA-N 257.337 2.204 10 10 CECE COc1cc(N[C@@H](C)c2ccc(F)cc2O)nn1C 388257075 JYBWQNMWQWBTMM-QMMMGPOBSA-N 265.288 2.447 10 10 CECE CSc1ccccc1C(=O)N1CCS[C@H](C(=O)O)C1 699318043 MUMRLHBUAMPAES-NSHDSACASA-N 297.401 2.051 10 10 CECE Nc1ccc(CCNCCCc2nccs2)cc1 391381959 XBIWVZJFZMDBSE-UHFFFAOYSA-N 261.394 2.490 10 10 CECE CN([C@H]1CCc2cccc(O)c21)[C@H]1CN2CCC1CC2 394264689 OSCKQQGMKKHNFW-GJZGRUSLSA-N 272.392 2.406 10 10 CECE CCCN(CC[C@@H]1CCNC1=O)c1ccc(N)cc1 395878906 GNISQTUPVWJEAK-LBPRGKRZSA-N 261.369 2.011 10 10 CECE C[C@H](N[C@@H]1COC(C)(C)C1)c1cc(O)ccc1O 396532264 LBIJLVZITAWRTL-UWVGGRQHSA-N 251.326 2.316 10 10 CECE C[C@H](CCC1CC1)NC(=O)COc1ccc(N)cc1 398152289 DZCOJPOGCHNHCZ-LLVKDONJSA-N 262.353 2.343 10 10 CECE Nc1ccc(CCNCCCOC(F)(F)F)cc1 398152924 UWHHUQWRNBBMNO-UHFFFAOYSA-N 262.275 2.327 10 10 CECE CCN=c1cc(C(=O)C(=O)c2ccc(F)cc2)cc[nH]1 2059918649 OUUKJTMQGFYJTP-UHFFFAOYSA-N 272.279 2.140 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCCC[C@H]1C 821941245 FOUUVKFWUZLWSQ-ZYHUDNBSSA-N 254.334 2.398 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1N[C@@H]2CC[C@H]1C2 2175325591 UTWJHUSWTVHXEN-OHTBPHCPSA-N 274.364 2.052 10 10 CECE C[C@H](c1ccc(F)cc1O)n1ncc(CN)c1Cl 2070419723 FYKMOYQQUTWWRG-SSDOTTSWSA-N 269.707 2.449 10 10 CECE CCCNC(=O)[C@H]1CCCN1c1ccc([C@@H](C)N)cc1 2169598135 RTFBNFPQJIZFHD-IUODEOHRSA-N 275.396 2.201 10 10 CECE CC(C)C[C@H]1COCCN1CCOc1ccc(N)cc1 2170234227 MVIBBERMUMPSPU-HNNXBMFYSA-N 278.396 2.395 10 10 CECE NCc1ccc(N2CC[C@H]3C[C@]3(O)C2)c2ccccc12 2171004393 IQFYRWSUPKUTAO-GUYCJALGSA-N 268.360 2.260 10 10 CECE Cn1nccc1[C@H]1CCCN1c1ccc(CO)cc1F 2171793558 ZDQCWDUZLZDGGX-OAHLLOKOSA-N 275.327 2.393 10 10 CECE CNCc1ccc(N2[C@@H]3COC[C@H]2C3)c(C(F)(F)F)c1 2198574172 FKMFVVBHFQKTCW-PHIMTYICSA-N 286.297 2.402 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]3[C@@H]2CCN3C)cc1O 2183797960 USPMXSFVYBIYPT-GLQYFDAESA-N 276.380 2.118 10 10 CECE CNCc1ccc(N2CCO[C@@H]3C[C@@H]32)c(Br)c1 1907000677 APERKBSIRHYILF-QWHCGFSZSA-N 297.196 2.146 10 10 CECE C[C@H](O)c1cc(F)c(N2CC3(CC3)C[C@@H]2CO)c(F)c1 2194515628 GTNYKPRTSJITDR-GXSJLCMTSA-N 283.318 2.369 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@H]3C[C@H]2CN3C)c(F)c1 2194696976 JGXQGSZWPVESKL-JLLWLGSASA-N 281.350 2.138 10 10 CECE CCN(c1c(F)cc([C@H](C)NC)cc1F)C1CN(C)C1 2194698739 AATPWGSNKKDMER-JTQLQIEISA-N 283.366 2.386 10 10 CECE C[C@H](N)c1cc(F)c(N(C)C[C@H]2CCN(C)C2)c(F)c1 2194709832 PSRHSMVREONJSG-QWRGUYRKSA-N 283.366 2.372 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@H]2C[C@H]2C(F)F)CC1 2041769280 BVHXIPNWIUEYGI-BDAKNGLRSA-N 258.272 2.437 10 10 CECE CN(C)c1ccc([C@@H](N)CCOCC(F)F)cc1 2044707542 DVXBDEBEMLQMLY-LBPRGKRZSA-N 258.312 2.424 10 10 CECE CCCOCC[C@H](NN)c1ccc(N(C)C)cc1 2044752597 OUXRLSKQIDVNBB-AWEZNQCLSA-N 251.374 2.074 10 10 CECE CC[C@@]1(CNC(=O)Nc2ccc(N)cc2)CCCNC1 2191537953 AWEOPOKDKJMEQG-OAHLLOKOSA-N 276.384 2.170 10 10 CECE CCCN(Cc1ccccc1O)[C@H]1CCCNC(=O)C1 2195486236 HJRTZCALJKHOLO-AWEZNQCLSA-N 276.380 2.273 10 10 CECE Nc1ccc(CCNC(=O)c2ccc(Cl)c(N)c2)cc1 2191748944 BLSRXXFWHYYVSC-UHFFFAOYSA-N 289.766 2.477 10 10 CECE NCc1ccc(N2CC[C@H](O)CC23CC3)c(Cl)c1 2050622301 VZCBMJVOWYHBGD-NSHDSACASA-N 266.772 2.292 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2CC[C@H]2C2CCC2)cc1 2191873141 BWCIFSKZAJMTDK-LSDHHAIUSA-N 294.420 2.267 10 10 CECE CN1C[C@H]2CC[C@H]1CN2c1ccc2c(c1)CCC[C@H]2O 2186700159 RAILRUHMZZQDOT-ZMSDIMECSA-N 272.392 2.339 10 10 CECE CCO[C@@H]1CC[C@@H](C(=O)N(C)CCCN=[N+]=[N-])C1 2054441782 WQEHZLKQOBDVPP-GHMZBOCLSA-N 254.334 2.350 10 10 CECE CCN[C@@H](c1ccccc1O)C1(O)CC(CF)C1 2054571193 QSZSPQJQNUHSQO-AWAWDMARSA-N 253.317 2.153 10 10 CECE C[C@H]1OCC[C@H]1CCNCc1cccc(O)c1O 2057455727 UCZRGJUOQBCAKK-GHMZBOCLSA-N 251.326 2.003 10 10 CECE CCOC(=O)[C@@](C)(CCC(F)F)NCCN=[N+]=[N-] 2057731883 UXKRQCKOBIOOMF-SNVBAGLBSA-N 264.276 2.253 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@H]2C2CC2)cc1O 2187172809 OMONSRIQBBWRGM-QSGSBWRWSA-N 276.380 2.022 10 10 CECE CN(Cc1cccc(F)c1O)C[C@@H]1OCC[C@@H]1F 2058672897 PITBPBXKLGNRSH-JQWIXIFHSA-N 257.280 2.090 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H]2CN3CC)cc1C 2187586613 XWGPAUUQCXZESC-SJORKVTESA-N 273.424 2.387 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2C[C@@]23CCCNC3)cc1 2106788423 PLAQFIUGRSRRQS-OWCLPIDISA-N 260.381 2.176 10 10 CECE CCCc1c(N)ncnc1N(C)Cc1ccccc1O 2192600725 PVEIRTISCNDYQU-UHFFFAOYSA-N 272.352 2.353 10 10 CECE Cc1nnc2cc(COCc3ccc(N)cc3)ccn12 2188156895 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[N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1OCC[C@H]1C(F)(F)F 2240498766 NNRARSNQWGPGHV-BZNPZCIMSA-N 292.261 2.301 10 10 CECE COc1ccc(N2C[C@H](F)C[C@@H]2CN)c(C)c1C 2256998501 BSBVNHFPXHMCNH-VXGBXAGGSA-N 252.333 2.188 10 10 CECE CP(C)(=O)C1CN(c2ccc3c(c2)CC[C@H]3N)C1 2258287955 LTNSLYIXTYYCEG-CQSZACIVSA-N 264.309 2.444 10 10 CECE CC[C@@H]1CNCC[C@@H]1NCc1cnc(SC)s1 2248710034 DRCUTTSYTYERBD-KOLCDFICSA-N 271.455 2.343 10 10 CECE CSc1ncc(CNC2CCC(CN)CC2)s1 2248708102 NMYJRCWWQJBTAG-UHFFFAOYSA-N 271.455 2.472 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H]2COC[C@H]1C2 2258770456 DJEYHGRMXBZHJO-JBLDHEPKSA-N 251.301 2.313 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1c(N)cccc1Cl 2249925230 URVSBJJIZRUMEB-UHFFFAOYSA-N 253.693 2.305 10 10 CECE Oc1ccc(CN[C@H]2CCC[C@@H]2CF)c(O)c1O 2260443563 LLBQSZMZVVDVOE-SCZZXKLOSA-N 255.289 2.031 10 10 CECE CCC[C@@]1(NCc2cccc(Cl)c2O)CCNC1=O 2274176723 MTYWGDURJHMSNM-CQSZACIVSA-N 282.771 2.194 10 10 CECE CCN(CCN1CCCC1)c1ccc(CO)cc1F 2265248429 DGKCRJNEGOLELH-UHFFFAOYSA-N 266.360 2.240 10 10 CECE COc1ccc(N2CC=CC[C@@H]2CO)c(OC)c1C 2277991874 GQWVWAOUVRQZRR-GFCCVEGCSA-N 263.337 2.139 10 10 CECE N[C@H]1CN(c2ccc(OCF)cc2)C[C@H]1C(F)(F)F 2278501491 DHAVXCWNPSXMAS-MNOVXSKESA-N 278.249 2.318 10 10 CECE Oc1ccc(CN[C@@H]2CCC[C@H]3CC[C@H]2O3)cc1O 2268530377 ADJAQPCEORSTGI-YWPYICTPSA-N 263.337 2.288 10 10 CECE CCN[C@@H](C)c1ccc(N2CC([S@@](C)=O)C2)cc1C 2269663852 YWYWGNKZKRFISK-HXPMCKFVSA-N 280.437 2.233 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)cc1C 2285131306 NAFYIDGLLLKYRY-VWPFQQQWSA-N 274.408 2.483 10 10 CECE Cc1cc(N2CC[C@@H](N3CC=CC3)C2)ccc1[C@@H](C)O 2285148842 MLUIJRJZEXLSFA-GDBMZVCRSA-N 272.392 2.499 10 10 CECE COc1ccc(N2C[C@H](CO)C3(CC3)C2)c(OC)c1C 2295462395 CNZSRHZZOQZCES-GFCCVEGCSA-N 277.364 2.221 10 10 CECE CC[C@@]1(C)C[C@H]1NCc1ccc(N2CCNCC2)cc1 2286069021 WNGYZOLDPLJMNS-SJORKVTESA-N 273.424 2.374 10 10 CECE CCO[C@@]1(COc2ccc(CNC)cc2C)CCOC1 2287074253 CRHSLDQDTKKAPG-INIZCTEOSA-N 279.380 2.289 10 10 CECE CC[C@@H](C)[C@@H](NC(=O)COc1ccc(N)cc1)C(F)F 2287272426 QIUHWBYYJWRVJU-NOZJJQNGSA-N 286.322 2.444 10 10 CECE CCN(CC)c1ccc(CN[C@H]2COC[C@H]2OC)cc1 1202739523 SBPGNTXZLMMKTN-JKSUJKDBSA-N 278.396 2.036 10 10 CECE C[C@H]1CNCCC[C@]1(Sc1nccs1)C(=O)O 2307041216 IQDXWBUIVNOHTR-GZMMTYOYSA-N 272.395 2.078 10 10 CECE CN(C(=O)C=Cc1ccc(O)c(O)c1)c1cccnc1 2308001297 UMPVLXQCWHBIQU-UHFFFAOYSA-N 270.288 2.169 10 10 CECE COc1cccc(N(C)C(=O)C=Cc2cnc(OC)nc2)c1 2324666155 GRHKFIYAOKIGJN-UHFFFAOYSA-N 299.330 2.170 10 10 CECE Cc1ccc(CN[C@@H]2CNC[C@H]2C)c(O)c1Br 2307568208 BZRIMTLEQLADPI-MWLCHTKSSA-N 299.212 2.161 10 10 CECE CSc1ncc(CN[C@@](C)(C(=O)O)C2(F)CC2)s1 2324964360 JRAQTTDYYSTRET-JTQLQIEISA-N 290.385 2.300 10 10 CECE CSc1cc(N2CCC[C@H](CO)C2)ccc1CN 2328545133 VDUJZHZKIZWXSJ-NSHDSACASA-N 266.410 2.076 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N1C[C@@H]2C[C@H]1[C@@H]2N 2328843688 XMZYQOMWMOGOPV-OYFAQSGBSA-N 258.365 2.280 10 10 CECE COc1ccc(N2C[C@H](OC)CC23CCC3)c(N)c1 2337899436 VECNIXQPZCJPDI-GFCCVEGCSA-N 262.353 2.425 10 10 CECE CC1(C)CN(c2ccc(CO)c(C3CC3)c2)[C@H]1CO 2339146860 JDDDHIQWSNNQDL-HNNXBMFYSA-N 261.365 2.263 10 10 CECE C[C@@H](C(=O)N1CCc2cc(O)c(O)cc2C1)C1CC1 2341194546 VCPUKJRTGVMAPM-SECBINFHSA-N 261.321 2.029 10 10 CECE CC(C)[C@@H]1C[C@@H](O)CN1c1ccc([C@H](C)O)cc1F 2344595982 SEOJWCQPFXVUCJ-NVBFEUDRSA-N 267.344 2.475 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CC[C@@H]4CC[C@H]3C4)cc21 2355101503 AQDYSFZBHWIUPW-ZIBATOQPSA-N 272.348 2.075 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H]1C[C@@H]2C[C@@H]2CO1 2355831172 WORQXXLASPEUOZ-XOSAIJSUSA-N 272.392 2.364 10 10 CECE CCOc1ccc(N2C[C@@H]3CC[C@H]2[C@H]3N)cc1OCC 2356121168 DIXIKQTYVFMSAP-RBOXIYTFSA-N 276.380 2.410 10 10 CECE Nc1ccc(C(=O)C2C(=O)c3ccccc3C2=O)cc1 105628515 ZWLFHBDHXZMFAH-UHFFFAOYSA-N 265.268 2.147 10 10 CECE COc1cccc(O)c1CN[C@H]1C[C@H]2C[C@@H](OC)C[C@H]21 2357080065 WGUZDAIJJZBMSF-BYNQJWBRSA-N 277.364 2.304 10 10 CECE COCC[C@H](C)Oc1ccc(N2CCNCC2)c(C)c1 130942510 HYBIYRKGJCLNON-AWEZNQCLSA-N 278.396 2.208 10 10 CECE CN(C)c1ccc(CNC(=O)/C=C/C2CC2)cc1F 79811132 OYJNMCZEEFYSGF-SOFGYWHQSA-N 262.328 2.474 10 10 CECE COC(=O)[C@H](CC1CCCCC1)NCCN=[N+]=[N-] 125269781 XGCFPRYLOJYZSB-NSHDSACASA-N 254.334 2.398 10 10 CECE CO[C@H]1CCC[C@@H](OCC(=O)N(C)c2ccc(N)cc2)C1 70322583 FNOORVFAUVRYFV-LSDHHAIUSA-N 292.379 2.206 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])CCC(C)(C)C1 129731337 JZNHUAWLCWDCEW-GFCCVEGCSA-N 254.334 2.398 10 10 CECE COCC[C@@H](N)c1cc(Br)cc(OC)c1O 1952141290 RYMYSSGAYISCOR-SECBINFHSA-N 290.157 2.200 10 10 CECE CCOC[C@@H](C)NCc1cccc(OCC)c1O 44688762 ANJFLYCRPJCEQJ-LLVKDONJSA-N 253.342 2.306 10 10 CECE CCNCc1ccc(N2CCN(C3CC3)CC2)c(F)c1 48995460 DAUGHYQHCXRLAH-UHFFFAOYSA-N 277.387 2.220 10 10 CECE C[C@H](c1cc(Br)ccc1O)N1CCN(C)CC1 131884809 OWBCNLRKLYTJHD-SNVBAGLBSA-N 299.212 2.463 10 10 CECE C[C@H]1CN(Cc2cc(F)ccc2O)C[C@H](C)N1C 221292595 SVQHQSFDVMEZND-QWRGUYRKSA-N 252.333 2.056 10 10 CECE COCCN(C)c1ccc(/C=C/C(=O)O)cc1F 42459970 SECNNFKDERFCPJ-GQCTYLIASA-N 253.273 2.006 10 10 CECE COc1ccc(N2CC[C@H](CO)C2)cc1Br 83869842 BUGAQYLJDPUZTM-VIFPVBQESA-N 286.169 2.276 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1O 145426701 XOCCDWVWMPSHJU-RYUDHWBXSA-N 276.296 2.069 10 10 CECE CNCc1ccc(N(CCO)C2CCCC2)cc1C 50584372 AZSCCGIGMJCJGC-UHFFFAOYSA-N 262.397 2.456 10 10 CECE Oc1cc(I)ccc1[C@@H]1CCCN1 238702458 YNRJXGOEMNCIKO-VIFPVBQESA-N 289.116 2.421 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(N)=O)c1cccc(Cl)c1 90260367 BZVGNMXJSPBVKR-SNVBAGLBSA-N 267.720 2.156 10 10 CECE C[C@H](NCC[C@H]1CCOC1)c1ccc(O)cc1O 235505568 GBFMAWUWZMUVLG-QWRGUYRKSA-N 251.326 2.175 10 10 CECE Nc1ccc(CN(C(=O)N2CCCC2)C2CC2)cc1 91962772 MFANVLVEOKXXGF-UHFFFAOYSA-N 259.353 2.449 10 10 CECE Nc1ccc(OC[C@H](O)CN2CC[C@H]3CCCC[C@H]32)cc1 250011904 WHPBSWGJZGSVCS-FRFSOERESA-N 290.407 2.273 10 10 CECE CC1(C)NC(=O)CC[C@H]1NCc1cccc(Cl)c1O 802659136 GMDIMANMQBTQCD-LLVKDONJSA-N 282.771 2.192 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCCC[C@H]1O 2165042352 ZJPWVPYYBMNWIE-QWHCGFSZSA-N 278.352 2.161 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CCNC34CC4)ccc21 2163067178 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COc1cccc(CNC(=O)[C@@H]2CCC[C@H]3C[C@H]32)c1O 830541192 UUTGZDJILQJCNW-CYZMBNFOSA-N 275.348 2.453 10 10 CECE C[C@H]1CCCCN1CCNC(=O)Nc1ccc(N)cc1 841301681 DBZUWFDAJYWSCQ-LBPRGKRZSA-N 276.384 2.265 10 10 CECE COC(=O)/C(C)=C/CN(C)c1ccc(OC)c(OC)c1 748813315 MCYRWWOWYATHGZ-DHZHZOJOSA-N 279.336 2.259 10 10 CECE Cc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[C@H]3C2)c(O)c1O 844110219 ZQHGKNQFHGYEJA-OUAUKWLOSA-N 261.321 2.325 10 10 CECE O=C(O)[C@@H]1CCN[C@@H]1c1cc(Cl)cc(Cl)c1O 1952818852 MZPYJPMLOKCRSV-MUWHJKNJSA-N 276.119 2.434 10 10 CECE Cc1ccc(C(=O)NC[C@H](C)c2ccccn2)c(O)c1O 855176941 DONHKSJYDAETSA-NSHDSACASA-N 286.331 2.335 10 10 CECE CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2cc(C)ccc2O)C1 850353488 DQGLJYIZKYTUQB-BMFZPTHFSA-N 293.407 2.356 10 10 CECE COC(=O)[C@@H]1C[C@H]1[C@H](C)NCc1ccc(N(C)C)cc1 850011365 OTQPPVSSTAAKBZ-TUKIKUTGSA-N 276.380 2.040 10 10 CECE CO[C@@H]1CCCC[C@H]1NC(=O)NCc1c(O)cccc1F 923073020 MFFNRVSROLBZIN-TZMCWYRMSA-N 296.342 2.288 10 10 CECE CN(C)c1ccc([C@@H](N)CNC(=O)[C@H]2CCC2(C)C)cc1 852790900 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CNCc1nc2cc(F)ccc2n1-c1ccc(N)cc1 76044703 VKKGEPXXCOSHDC-UHFFFAOYSA-N 270.311 2.466 10 10 CECE Cc1cc(C)c([C@@H](C)NC[C@]2(CCO)CCOC2)c(O)c1 788633824 VADPXSDPMQFCLG-PBHICJAKSA-N 293.407 2.449 10 10 CECE C[C@H]1CC(C)(C)C[C@](NCCCN=[N+]=[N-])(C(N)=O)C1 90260448 YCVGNJPHQWHDPJ-GWCFXTLKSA-N 267.377 2.347 10 10 CECE CCN(c1ccc(CN)c(F)c1F)[C@H]1CCOC1 386325008 JAJRFIMKLPRKCX-JTQLQIEISA-N 256.296 2.039 10 10 CECE NCc1ccc(N2CC(OCC(F)(F)F)C2)cc1F 687900752 WJBHQUISJAVPAQ-UHFFFAOYSA-N 278.249 2.052 10 10 CECE CCNCc1cc(F)c(N(CCO)CC2CC2)c(F)c1 688445055 PTKBNQXKJDPDIZ-UHFFFAOYSA-N 284.350 2.283 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2CC[C@@H]3CCC[C@@H]32)cc1 707722695 WLCVDXZQZFABIB-AEGPPILISA-N 294.420 2.267 10 10 CECE C[C@H](O)[C@H]1CCCCN1C(=O)Nc1ccc(N)cc1 688668464 PMCUCHZLXINJOJ-GXFFZTMASA-N 263.341 2.036 10 10 CECE CC(C)NCc1ccc(N2CCSC[C@@H]2CCO)cc1 708398975 MEIUBBPQEVPPOO-INIZCTEOSA-N 294.464 2.489 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H]([C@H](C)O)C2)cc1O 688889274 GMIKCQPXKFSDJK-SDDRHHMPSA-N 264.369 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Cc1cc(N2C[C@H](O)[C@H](C3CC3)C2)ccc1[C@@H](C)O 2269673681 MQBCODWQTQWLTN-RLCCDNCMSA-N 261.365 2.255 10 10 CECE CCO[C@@]1(CNCc2cnc(SC)s2)CCOC1 2208657193 PFJXUDDGIHTRIF-GFCCVEGCSA-N 288.438 2.150 10 10 CECE CO[C@@H](CN[C@@H](C)c1cc(O)ccc1O)CSC 2218738562 PTTJSUGGCSCXCO-ONGXEEELSA-N 271.382 2.126 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@H](CO)C2)c(F)c1 2219611137 XVZPLKBFJXQTEP-MNOVXSKESA-N 253.317 2.289 10 10 CECE COc1ccc(N2C[C@H]3CSC[C@H]3C2)c(C=O)c1 2220426116 KCJDEUVHIVWEBG-TXEJJXNPSA-N 263.362 2.307 10 10 CECE C[C@@H](NCc1ncccc1O)c1ccc(F)cc1O 2230926271 SPCCMGDEBXXZES-SECBINFHSA-N 262.284 2.483 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC[C@@H]2COC[C@H]2C1 2232102554 MVXAOMQVAWNZLZ-BPLDGKMQSA-N 260.381 2.487 10 10 CECE Cc1ccc(O)c(CNC[C@@H](F)[C@H]2CCOC2)c1 2222389681 KRHOPIJTKQDJJZ-WCQYABFASA-N 253.317 2.165 10 10 CECE COc1ccc([C@H](C)Nc2cccn(C)c2=O)c(O)c1 2233030760 GYCWZUDEVGJBDM-JTQLQIEISA-N 274.320 2.273 10 10 CECE CCN(c1ccc([C@H](C)O)c(O)c1)[C@H]1CCC[C@H]1O 2224422301 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CCC1(O)CCN(c2ccc(OC)cc2C=O)CC1 2227697151 RJJGLCMRRHFHCI-UHFFFAOYSA-N 263.337 2.249 10 10 CECE CCCN(c1ccc(OC)cc1C(=O)O)C1COC1 2227670278 NULGRBMRMFJUPP-UHFFFAOYSA-N 265.309 2.009 10 10 CECE C[C@@H]1CC[C@@H]1CNC(=O)CCOc1ccc(N)cc1 2227908937 YWZNLTWETRMGJP-VXGBXAGGSA-N 262.353 2.200 10 10 CECE Nc1ccc(OC[C@@H](O)CO[C@H]2CCC(F)(F)C2)cc1 2238389958 OETPIIKPJWEOJX-YPMHNXCESA-N 287.306 2.213 10 10 CECE Nc1ccc(OC[C@@H](O)CO[C@@H]2CCC(F)(F)C2)cc1 2238389956 OETPIIKPJWEOJX-DGCLKSJQSA-N 287.306 2.213 10 10 CECE CCCOCC[S@@](=O)CCCOc1ccc(N)cc1 2229795793 MADACTRKUDCPKU-IBGZPJMESA-N 285.409 2.213 10 10 CECE CO[C@@H]1CCN(c2ccc([C@H](C)O)cc2C)C[C@H]1OC 2240829536 MNIMYYRYLQWSGG-APHBMKBZSA-N 279.380 2.288 10 10 CECE COC[C@@]1(OC)CCN(c2ccc([C@H](C)O)c(C)c2)C1 2285177452 SBFLAFHTWNAEHV-XJKSGUPXSA-N 279.380 2.290 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1C[C@@H]2NCC[C@H]21 2286379209 VTZWPJZNFQYVQT-VVLHAWIVSA-N 272.392 2.318 10 10 CECE COc1cc(Cl)cc(CNCCCC2(O)CC2)c1O 2270202754 KPJNXHNRJVFXON-UHFFFAOYSA-N 285.771 2.449 10 10 CECE CCN[C@@H](c1ccccc1O)c1nnn2c1CCCC2 2289272066 OJOUETDMADSFPL-AWEZNQCLSA-N 272.352 2.019 10 10 CECE CN(c1ccc(OC(F)F)cc1)[C@H]1CCCNC1 2263934095 WORIRWYLKNVAMA-NSHDSACASA-N 256.296 2.476 10 10 CECE CC[C@H](NC[C@@H](C)NC(=O)OC)c1ccccc1O 2274583247 SBKYCMMAIGOLMD-PWSUYJOCSA-N 266.341 2.177 10 10 CECE FCOc1ccc(N2CCN[C@H](C(F)(F)F)C2)cc1 2278502878 CQTDALWDUWAUDP-NSHDSACASA-N 278.249 2.333 10 10 CECE CCOC(=O)CC(=O)[C@H](C)N(C)c1ccc(OC)cc1 2279038010 UHYKEHKCSBCUPJ-NSHDSACASA-N 279.336 2.042 10 10 CECE COC[C@@H]1CC[C@H](O)[C@@H](N(C)c2ccc(OC)cc2)C1 2279043259 GUIXCQJCDOGHDY-KCXAZCMYSA-N 279.380 2.307 10 10 CECE CCN1C(=O)C(=CNCc2ccccc2)SC1=S 2293880471 DNRPHJDKIDMJQP-UHFFFAOYSA-N 278.402 2.498 10 10 CECE C[C@@H](CNCc1ccc2c(c1)CCO2)Cc1cn[nH]c1 2290440616 SMOAHZVGNBQECS-GFCCVEGCSA-N 271.364 2.313 10 10 CECE C[C@H]1COC(C)(C)CN1c1cc2c(cc1N)OCCO2 2284149710 CSQXGWMWNPPDAJ-JTQLQIEISA-N 278.352 2.044 10 10 CECE Cc1cc(N2CCO[C@@]3(CCOC3)C2)ccc1[C@@H](C)N 2285126276 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CECE Nc1ccc(NC(=O)N[C@H]2C[C@@H]3C[C@H]2[C@H]2C[C@@H]32)cc1 2330305419 PMGLDPVQQRYUNJ-KDPWEKEESA-N 257.337 2.435 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)c1cc(N)c(C)s1 2337807461 QVSXTESRZODBTO-UHFFFAOYSA-N 298.389 2.454 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[S@@](=O)C[C@@H]2C)c1C 2340852708 ZPRRFTVQXPLFRF-WSHAHDTKSA-N 280.437 2.280 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@]1(O)C[C@H]1C(F)(F)F 2344254145 XSVYGBYPYNNLCL-MNOVXSKESA-N 295.688 2.449 10 10 CECE Nc1ccc(N2CCN(C[C@H]3C[C@@H](F)C3)C2=O)cc1 2352356553 AKLMWTPWAAXDOC-PHIMTYICSA-N 263.316 2.259 10 10 CECE CCCOc1ccc(N2C[C@@H](OCC)[C@H](CN)C2)cc1 2354603603 QJIAKTNASINUNR-CZUORRHYSA-N 278.396 2.275 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]23C[C@@H]2[C@@H]2CC[C@H](C3)N2)cc1 2354609073 UAQXDCFKBZLMPK-ZUOZUFPHSA-N 272.392 2.317 10 10 CECE COCCN(C)Cc1cc(CNC(C)C)ccc1OC 50125114 CNZJRNRZLSDQSE-UHFFFAOYSA-N 280.412 2.271 10 10 CECE CCC[C@@](NCCCN=[N+]=[N-])(C(=O)OC)C1CC1 302537221 SISURPAVXUTOJM-LBPRGKRZSA-N 254.334 2.398 10 10 CECE COCCNCc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1C 62734285 CHLBRIILBAGKBI-HUUCEWRRSA-N 292.423 2.345 10 10 CECE C[C@@H](NC(=O)[C@@H]1CCC[C@@H]1C(=O)O)c1ccccc1O 2357204423 LSYIRXZNWZLQLN-JLLWLGSASA-N 277.320 2.070 10 10 CECE C[C@@H]1C[C@@H](C)CN(C(=O)Nc2cc(O)c(O)c(O)c2)C1 217278771 CPDAZGHAZSWZCX-RKDXNWHRSA-N 280.324 2.313 10 10 CECE CC(=O)C[C@@H]1CCCCCN1C(=O)c1cccc(O)c1O 126168299 GORBXJOSHVGWAL-LBPRGKRZSA-N 291.347 2.462 10 10 CECE Oc1ccc(CNc2cnn(C[C@@H]3CCCO3)c2)cc1O 37137600 DDADHMAUGBBWNZ-ZDUSSCGKSA-N 289.335 2.085 10 10 CECE CCOc1ccc(O)c(CN2CCC[C@](C)(O)C2)c1 129557376 FZGNYTLQFAMUQK-HNNXBMFYSA-N 265.353 2.138 10 10 CECE COc1ccc(O)c(CN[C@H](C[S@@](C)=O)C(C)(C)C)c1 1964618962 PRKDVCJKPSTMRQ-JLTOFOAXSA-N 299.436 2.284 10 10 CECE CCN1C(=O)CCC[C@@H](N)[C@H]1c1ccc(N(C)C)cc1 70295013 NMCQWUKIKDAIKO-GDBMZVCRSA-N 275.396 2.153 10 10 CECE C[C@@H]1SCCN(CCOc2ccc(N)cc2)[C@H]1C 132268963 QRAHUEZOHYTHLO-RYUDHWBXSA-N 266.410 2.473 10 10 CECE Cc1cc(C)c(C(N)=O)c(NCCc2ccc(N)cc2)n1 44365055 VCVOFRFMOXGZCA-UHFFFAOYSA-N 284.363 2.034 10 10 CECE C[C@@H](N)[C@@H](Sc1nccs1)c1cnn(C)c1 43238484 KIYOWEVGBZOUOS-VXNVDRBHSA-N 254.384 2.057 10 10 CECE CCC[C@](CN)(Cc1ccc(N)cc1)C(=O)OCC 233414026 ZEQYDHWDAHYTNK-OAHLLOKOSA-N 264.369 2.120 10 10 CECE COc1ccc(N2CCNC[C@@H]2C(F)(F)F)c(F)c1 2130133088 PLQKDFPCIMSZFF-LLVKDONJSA-N 278.249 2.175 10 10 CECE CN[C@H]1CCCN([C@H](C)c2cc(F)ccc2O)C1 94621894 YEMNTDSKYSIISF-PWSUYJOCSA-N 252.333 2.276 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1nccnc1OC 97388477 CBWMBWJXGQQLLQ-AWEZNQCLSA-N 286.379 2.250 10 10 CECE CN(C)Cc1cc([C@@H](CN)C(F)(F)F)ccc1O 1952487780 BXABAPKRHNXGJJ-SNVBAGLBSA-N 262.275 2.058 10 10 CECE COc1ccc([C@@H](NCCN=[N+]=[N-])C(=O)O)cc1Cl 90256624 RWCRZTJXBKJSTH-SNVBAGLBSA-N 284.703 2.374 10 10 CECE CN1CCc2cc(CN3C[C@@H]4CCC[C@@H](N)[C@H]4C3)ccc21 252865887 PZFVKURLYXDBEJ-YESZJQIVSA-N 285.435 2.238 10 10 CECE CCNCc1cc(CN(C)c2ccc(OC)cc2)on1 52541816 YPGMCLJWFWOUEM-UHFFFAOYSA-N 275.352 2.429 10 10 CECE CNC[C@](C)(F)c1cc(O)c(O)cc1Br 257823580 FOPYIASBEWMRGF-JTQLQIEISA-N 278.121 2.264 10 10 CECE C[C@H]1CCN(c2ccc(CNC3CC3)cc2)C[C@H]1CO 700394545 NGNWRBNLGSAJDI-ZFWWWQNUSA-N 274.408 2.393 10 10 CECE N[C@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)CC1(F)F 2162659584 MSFLKVSKNBHKFV-JTQLQIEISA-N 292.232 2.181 10 10 CECE c1cc2c(cc1N1CC[C@@]3(CCCNC3)C1)COCC2 2162666504 DPUCOGPKSSYFTN-QGZVFWFLSA-N 272.392 2.339 10 10 CECE C[C@@]12CNC[C@@H]1CN(c1ccc3c(c1)OC(F)(F)O3)C2 2162673771 VNJOVOXPVYCZDT-RNCFNFMXSA-N 282.290 2.054 10 10 CECE CC(C)(C)[C@H]1CN(Cc2cc(N)ccc2O)CCO1 709054286 KRQDEJQCWVTSKY-CQSZACIVSA-N 264.369 2.221 10 10 CECE COc1ccc(CNC(=O)N[C@@H]2CSC2(C)C)c(O)c1 801799105 RPVXEEHLLYKKTD-GFCCVEGCSA-N 296.392 2.094 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2[C@@H](CN)C2(F)F)cc1 2163107052 QKCGUPPSEJCXCH-MCIONIFRSA-N 284.350 2.406 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@]1(O)CC[C@@H]1C 2163242033 DWNLSCWUIDWIGG-VUCTXSBTSA-N 274.408 2.491 10 10 CECE CO[C@H](C)CCOc1ccc(N2CCCNCC2)cc1 2165540785 VTPYAGINVODYRP-CQSZACIVSA-N 278.396 2.290 10 10 CECE CCN(CC)c1ccc([C@@](O)(CCOC)COC)cc1 2165963504 SASRFCJGODWKTC-MRXNPFEDSA-N 281.396 2.403 10 10 CECE CS(=O)(=O)c1cccc(NCCc2ccc(N)cc2)c1 2162480493 ADMKTJRMBXLMHX-UHFFFAOYSA-N 290.388 2.327 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@H](C(=O)O)[C@H](F)C1 2164555835 NDMFBUCHCXBWQJ-HLUHBDAQSA-N 285.290 2.337 10 10 CECE NC[C@@H]1CCCCN(c2ccc3c(c2)OCCCO3)C1 2162623288 NVFSUCXJFLRAEA-ZDUSSCGKSA-N 276.380 2.413 10 10 CECE CCN(CCN1CCCCC1)c1ccc(CN)cc1 723465756 AVKGTARTODTHAJ-UHFFFAOYSA-N 261.413 2.458 10 10 CECE COc1ccc([C@@H](C)N(C)CCN2CCCC2)c(O)c1 133905543 YCLWJRWEWFSSPC-CYBMUJFWSA-N 278.396 2.489 10 10 CECE CC[C@H]1[C@H](CO)CCN1Cc1cc(F)ccc1O 824636261 NNMIDFDFTSCGLF-GWCFXTLKSA-N 253.317 2.124 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(Cl)ccc1O 42013090 DRFAXPACJXMOBR-UHFFFAOYSA-N 254.677 2.476 10 10 CECE CC[C@H](N)[C@@H](N(C)Cc1ccccc1O)C(F)(F)F 1877517936 OPQPIRCOAOGCDA-CMPLNLGQSA-N 276.302 2.492 10 10 CECE C[C@]1(O)C[C@@H](NCc2cc(Cl)c(F)cc2O)C1 841890516 BZMPRVQNCPYAEO-LYWQIFSTSA-N 259.708 2.188 10 10 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2.158 10 10 CECE COCCOCCCN(C)c1ccc(CO)c(Cl)c1 2129760164 MAXPAFMVMUVRLH-UHFFFAOYSA-N 287.787 2.322 10 10 CECE NCc1ccc(N(CC2[C@H]3COC[C@H]23)C2CC2)cc1 2132397437 OAQVDNCWZAMVAS-HZPDHXFCSA-N 258.365 2.007 10 10 CECE CN(C(=O)CN=[S@@](C)(=O)C(C)(C)C)c1ccc(N)cc1 1913862921 PNLCLQSRHHQHGO-FQEVSTJZSA-N 297.424 2.128 10 10 CECE CCNCc1ccc(N(C)C2(CCO)CC2)c(F)c1 2133545778 JRDUGZLENLYQDA-UHFFFAOYSA-N 266.360 2.286 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H](O)CC(F)(F)F)C1 1912169143 ZEYJMCFRWDACGZ-SFYZADRCSA-N 252.240 2.074 10 10 CECE CCC[C@@H](C)NC(=O)[C@@H](C)N1CCC(N=[N+]=[N-])CC1 1912162246 UDBFJRXDZQGARJ-GHMZBOCLSA-N 267.377 2.454 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCOC[C@@H]2CCCO2)C1 1912176405 YUICVYFQAJCMOR-OLZOCXBDSA-N 268.361 2.204 10 10 CECE COc1ccc(CN2CCC[C@@H](CN=[N+]=[N-])C2)nn1 1912167938 QUBYSOFRPPABFS-JTQLQIEISA-N 262.317 2.008 10 10 CECE CC[C@@H](C)S(=O)(=O)N1CCC(CN=[N+]=[N-])CC1 1912145177 DBOZCADJUMKPRL-SECBINFHSA-N 260.363 2.137 10 10 CECE NCc1ccc(N2C[C@H](CO)C3(CCC3)C2)c(F)c1F 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CCOc1ccccc1C(=O)NCc1cc(O)ccc1O 1633595130 JFKPUZFHIMBWAF-UHFFFAOYSA-N 287.315 2.427 10 10 CECE CC(C)[C@H](C(=O)O)[C@H](N)c1ccc(N(C)C)cc1 1927706939 SZGSQBWJXLGVMJ-QWHCGFSZSA-N 250.342 2.109 10 10 CECE COCC1(NC(=O)c2ccc(N=NC(N)=O)cc2)CCC1 1640418242 UILMJLKTXDXRGR-UHFFFAOYSA-N 290.323 2.148 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)Nc1cc(Cl)nnc1O 1650959956 GTFMHKNEDDLENB-ZETCQYMHSA-N 295.726 2.290 10 10 CECE Cc1ccc(O)c(CNc2nccn(C(F)F)c2=O)c1 1651258888 QHDSSCHWPYMZPX-UHFFFAOYSA-N 281.262 2.265 10 10 CECE CNCc1ccc(N(C)CC[C@@H](C)OC)cc1OC 2139687667 ZXISVOVRYYRMRR-GFCCVEGCSA-N 266.385 2.276 10 10 CECE Cc1ccc(CNc2cnc3nccn3c2)c(O)c1 2139764835 FFALBQMSIJOKAA-UHFFFAOYSA-N 254.293 2.355 10 10 CECE CC(C)N(Cc1ccc(F)cc1O)C[C@H]1CCCN1 2139756702 YCGVFQBTNYJICG-CQSZACIVSA-N 266.360 2.494 10 10 CECE Nc1c(F)cccc1C(=O)Nc1ccc(O)cc1C(=O)O 156226614 NCTNUYUJFGJGDW-UHFFFAOYSA-N 290.250 2.064 10 10 CECE CCc1cc(CNCCNC(C)C)ccc1OC 258889608 LDUYSHFZAZDVSF-UHFFFAOYSA-N 250.386 2.345 10 10 CECE 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253.323 2.077 10 10 CECE CN[C@@H](c1ccccc1O)C1(O)CCP(C)(=O)CC1 1879130279 SNMXAWBAZVCAPI-CDJWAVJASA-N 283.308 2.171 10 10 CECE C[C@H](NCc1ccc(F)cc1O)C(=O)OC(C)(C)C 1964539855 VGLWNTHKVLBEIX-VIFPVBQESA-N 269.316 2.351 10 10 CECE NCc1ccc(N2C[C@H]3CO[C@@H](C3)C2)c(Cl)c1 1946939206 WGBJUUKFCZBKDW-QWRGUYRKSA-N 252.745 2.024 10 10 CECE C[C@H](O)c1cc(F)c(N2CCC[C@H](O)[C@H]2C)c(F)c1 1880484808 HVCZVMYJPVJUQP-ZDMBXUJBSA-N 271.307 2.368 10 10 CECE COc1ccc(CN[C@@]2(CO)CC[C@H](C)C2)c(O)c1 1880888983 HLJAXDPMUQZGAU-NHYWBVRUSA-N 265.353 2.042 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@@]23CCOC3)c(F)c1 1880929875 YXWXDCTZWWBVLO-OTYXRUKQSA-N 268.307 2.354 10 10 CECE N[C@H]1CCC[C@@H](c2nc(-c3ccc(O)c(O)c3)no2)C1 236328454 QXWGFEZELCFXMA-ZJUUUORDSA-N 275.308 2.133 10 10 CECE CC[C@H](C(=O)N(C)CCN=[N+]=[N-])N(C)C(=O)OC(C)(C)C 1885558110 ZHMRYRQOYJRKGB-SNVBAGLBSA-N 299.375 2.401 10 10 CECE CCCCOC(=O)c1ccn(-c2ccc(N)cc2)n1 41086420 STQPUSQETOWJTI-UHFFFAOYSA-N 259.309 2.411 10 10 CECE 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CCn1ncnc1CN(C)c1ccc([C@@H](C)NC)cc1 2168065086 GONPAFHRFKDVTR-GFCCVEGCSA-N 273.384 2.215 10 10 CECE Oc1ccc(F)cc1CNC[C@@H]1CC12CCOCC2 780027047 KWRNYFCJPUMSHU-LBPRGKRZSA-N 265.328 2.438 10 10 CECE CC[C@@H](C(F)F)N(C)c1cc2c(cc1N)OCC(=O)N2 2178792144 VOBDBJXKFHBISG-VIFPVBQESA-N 285.294 2.080 10 10 CECE CN(CCOc1ccc(N)cc1)[C@H]1COCCC1(F)F 2168216814 BFMWAYQWTDNYGF-ZDUSSCGKSA-N 286.322 2.004 10 10 CECE CCc1cc(CN)n(Cc2cc(Cl)ccc2O)n1 2070047310 PNPBXOMWRGSLIN-UHFFFAOYSA-N 265.744 2.312 10 10 CECE CN1CCCc2cc([C@H](O)[C@H]3CCCCNC3)ccc21 2179067650 RPUIALODGYZXBU-RDJZCZTQSA-N 274.408 2.492 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@H](CO)CC(C)(F)F)c1 2169534911 DHGPSXFCRLRTLG-ZJUUUORDSA-N 289.322 2.458 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCCn2cncn2)cc1 2170124604 ZWYOIEBTCUDZSU-ZDUSSCGKSA-N 273.384 2.085 10 10 CECE CCC[C@H]1COCCN1c1ccc(CO)cc1[N+](=O)[O-] 2170249047 SXYDKFHKDXIAFU-LBPRGKRZSA-N 280.324 2.092 10 10 CECE CC[C@H]1CN(c2ccc(CNC)cc2C)C[C@@H]1N(C)C 2170472098 NLKLUMBGBKIIMG-RDJZCZTQSA-N 275.440 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CCOC(=O)CCC[C@H](N)c1cccc(F)c1O 1951604654 YQYCZAJOJVJDLQ-NSHDSACASA-N 255.289 2.265 10 10 CECE O=C1c2cscc2C(=O)N1Cc1ccccc1O 311074041 VKOKTLKIXVTQRS-UHFFFAOYSA-N 259.286 2.250 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCCC[C@@H]1[C@@H](C)N 63191296 TUABCKSLILWYKW-UHIISALHSA-N 264.369 2.361 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)[C@@H]1C[C@H]1C 2357641307 DEGRKSJDVTVHMO-PREXVCJDSA-N 274.408 2.346 10 10 CECE Cc1c(O)cccc1C(=O)Nc1ccc(O)cc1C(=O)O 125381532 OTKLAFPLDQXQPF-UHFFFAOYSA-N 287.271 2.357 10 10 CECE CC[C@H]1CN(c2ccc([C@@H](C)N)cc2F)CCO1 36770093 AGBWGLMOAHZQCR-PWSUYJOCSA-N 252.333 2.461 10 10 CECE Nc1ccc(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])cc1 37017956 YXBQRQNGPXTEGF-UHFFFAOYSA-N 289.266 2.497 10 10 CECE Cc1cc(OCCCN(C)C)ccc1N1CCCNCC1 122403526 RHVKIOYXJSUGOL-UHFFFAOYSA-N 291.439 2.125 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1 2358070661 GBJIRTUUWAEOKK-IMJJTQAJSA-N 274.408 2.392 10 10 CECE CN1CC[C@H](N(C)c2ccc(/C=C\C(=O)O)cc2F)C1 312684618 LQXWEUSXKOBIFH-RNZFLTOJSA-N 278.327 2.064 10 10 CECE Cc1ccnc(CN[C@@H](C)c2ccc(F)cc2O)n1 2130073057 PRNOKCTWERCXTQ-JTQLQIEISA-N 261.300 2.481 10 10 CECE Cc1ccnc(CN[C@H](C)c2ccc(O)cc2O)n1 2130073819 UYAMYBFKALCDCT-SNVBAGLBSA-N 259.309 2.047 10 10 CECE CN(Cc1ccc(O)cc1)C(=O)COc1ccc(N)cc1 40331525 WKDNEALAHGTBJT-UHFFFAOYSA-N 286.331 2.012 10 10 CECE C[C@H](NCC[S@@](C)=O)c1cc(Cl)ccc1O 134921795 IBSKEBDAGNUFCB-PWJLMRLQSA-N 261.774 2.075 10 10 CECE CN1CCc2nc(Cc3ccc(N)cc3)sc2C1 88870836 QGIVIAOALCLTFQ-UHFFFAOYSA-N 259.378 2.304 10 10 CECE CCCOc1ccc(CN(C)[C@H](C)C[S@](C)=O)c(O)c1 131156859 COXIHBMUHBOUMV-MPBGBICISA-N 299.436 2.380 10 10 CECE C[C@@H](c1ccccc1O)N1CCNC[C@H]1C(F)(F)F 2130120165 AANJFVQLMZSTNT-CABZTGNLSA-N 274.286 2.289 10 10 CECE O=C(O)C[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 89716459 WNGVMXUFDQEATP-VIFPVBQESA-N 269.728 2.342 10 10 CECE CC[C@H](c1ccccc1O)N1CCC(OCC(=O)O)CC1 86773473 OJKZTCFCRSKKNU-CQSZACIVSA-N 293.363 2.409 10 10 CECE [N-]=[N+]=NCCCS(=O)(=O)c1ccc2c(c1)OCCCO2 48804734 IPOPCGCKLNNMHD-UHFFFAOYSA-N 297.336 2.322 10 10 CECE CCOC(=O)CN(Cc1ccc(OC)cc1O)CC(C)C 91789995 HHSFIDYYNRUBRX-UHFFFAOYSA-N 295.379 2.422 10 10 CECE C[C@H](O)C1CCN(Cc2ccc(N(C)C)cc2)CC1 92969093 DBVHFUDQDRCOKG-ZDUSSCGKSA-N 262.397 2.345 10 10 CECE O=c1c(O)c(-c2ccc(O)c(O)c2O)oc2ccccc12 90712766 DTOSMSVKBWNCSO-UHFFFAOYSA-N 286.239 2.282 10 10 CECE CCN(c1ccc([C@H](C)N)c(O)c1)[C@H](C)COC 249700791 BPXQMJMTUBSVJN-MNOVXSKESA-N 252.358 2.273 10 10 CECE Nc1ccc(NC(=S)N2CCCC[C@H]2CCO)cc1 243311316 LHVWKXYZEZKASD-ZDUSSCGKSA-N 279.409 2.203 10 10 CECE COC(=O)[C@H](C)c1cc(O)c(O)cc1Br 258412346 FTTZENCPUCKBRZ-RXMQYKEDSA-N 275.098 2.137 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCCC[C@H]1C(=O)O 251578545 VSNYZVRCRNMBMQ-SKDRFNHKSA-N 265.309 2.098 10 10 CECE C[C@H]1CC[C@H](NS(=O)(=O)Cc2ccc(N)cc2)CC1 253116479 GCDLPJVDXBZYDI-YEORSEQZSA-N 282.409 2.267 10 10 CECE O=C(NC[C@@H]1CC[C@H]2C[C@H]2C1)c1c(F)ccc(O)c1O 530267042 VOKUUJBTFOWCOW-KXUCPTDWSA-N 279.311 2.403 10 10 CECE CNC1C[C@@H]2CC[C@H](C1)N2Cc1cccc(OC)c1O 1275273678 WDHDGTJZXUUXLV-AGUYFDCRSA-N 276.380 2.116 10 10 CECE CCCN1CC[C@](N)(c2ccc3c(c2)CCN3CC)C1 2163062444 MBDYSCWNISMUQG-QGZVFWFLSA-N 273.424 2.339 10 10 CECE CN1CCCc2cc([C@@](C)(O)c3cnn(C)c3)ccc21 2163101884 FTSFWSAMHQULLG-MRXNPFEDSA-N 271.364 2.058 10 10 CECE CN1CCCc2cc([C@H](O)[C@H](CN)C(F)(F)F)ccc21 2163105813 KWVMCFQECXAOQO-AAEUAGOBSA-N 288.313 2.240 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3CSCCN3C)ccc21 2163106782 LKSBRZGWDRAPQO-JKSUJKDBSA-N 292.448 2.150 10 10 CECE Cc1ccncc1[C@H](O)[C@@H](N)c1ccc(N(C)C)cc1 2163135720 MPNUKTWYUPBSPO-HOTGVXAUSA-N 271.364 2.189 10 10 CECE CCCCOCC[C@H](NN)c1ccc2c(c1)CCN2C 2163140867 OFLFKXDTWLYKJD-HNNXBMFYSA-N 277.412 2.390 10 10 CECE Oc1c(Br)cccc1CNCCOC1CC1 715020779 YDIAIBKSMFHLRW-UHFFFAOYSA-N 286.169 2.423 10 10 CECE CN(Cc1ccccc1O)C(=O)/C=C/[C@@H]1CCCO1 819382886 RUSJIWWLPODJDA-XEHSLEBBSA-N 261.321 2.086 10 10 CECE CN1CCN(c2ccc(CN3CC(C4CC4)C3)cc2)CC1 812775236 JVTBBRIGTXYGQL-UHFFFAOYSA-N 285.435 2.280 10 10 CECE CCOC(=O)C(F)(F)[C@H](N)c1c(F)ccc(C)c1O 725274808 HLLWEOPQRYMKBS-SNVBAGLBSA-N 277.242 2.038 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3OCC[C@H]3C2)cc1O 724801830 RPOCXPVXTSPEMD-BFQNTYOBSA-N 276.380 2.288 10 10 CECE CC(=O)C(=O)COC(=O)c1ccccc1C1(C)CC1 909732037 AMXLAPZNISWEFN-UHFFFAOYSA-N 260.289 2.053 10 10 CECE C[C@@H](NC1CC(CC(N)=O)C1)c1cc(Cl)ccc1O 903261637 ZOODGXMJLRRNSB-FKTRJACZSA-N 282.771 2.350 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@@H]1CCn2ccnc21 834590565 XBMMQENNGVQTAP-OAHLLOKOSA-N 270.380 2.492 10 10 CECE CC(=O)[C@H](N)c1cccc(NC(=O)OC(C)(C)C)c1O 1952648092 UPEDOGMSDXKTHB-NSHDSACASA-N 280.324 2.328 10 10 CECE CCc1cccc(CN[C@@H](CO)C[C@@H](O)C(C)(C)C)c1O 848909478 UZLJRFJHOPTGOQ-HUUCEWRRSA-N 295.423 2.202 10 10 CECE CC(C)(C)OC(=O)[C@H]1CCN[C@@H]1c1cccc(O)c1O 1952824586 VMPKLBKOGIXWCN-CMPLNLGQSA-N 279.336 2.090 10 10 CECE CCN(CC)c1ccc(CN2C[C@@H]3C[C@H]2C[S@]3=O)cc1 846101093 ZOOUDGAUSYGUFY-TWOQFEAHSA-N 292.448 2.238 10 10 CECE CC[C@H](NC(=O)NCCc1ccc(N)cc1)C(F)(F)F 841208957 NGFIDAVRMZRUPP-NSHDSACASA-N 289.301 2.451 10 10 CECE O=C(NCc1cc(Cl)ccc1O)NCC1CSC1 923834151 UOCHWQKPFLGGNX-UHFFFAOYSA-N 286.784 2.208 10 10 CECE C[C@H](O)[C@@H](C)Nc1c(N)cccc1Br 697482088 XKUZJKBNKJDPLD-RQJHMYQMSA-N 259.147 2.213 10 10 CECE C[C@@H](NC[C@H](O)CC1(O)CCC1)c1ccc(N(C)C)cc1 859258669 RQQDEWCUATYQEY-CZUORRHYSA-N 292.423 2.069 10 10 CECE CCOCCCCCC(=O)NCc1ccc(N)cc1 868060740 CJRULIXKSSUVCF-UHFFFAOYSA-N 264.369 2.482 10 10 CECE CC(=O)NCC1CCC(NCc2ccccc2O)CC1 865442586 OUPZQRGFGPSLSP-UHFFFAOYSA-N 276.380 2.177 10 10 CECE O=C(COC(=O)[C@@H]1CCCC12CC2)c1ccc(O)c(O)c1 860176480 DVSDZUXCTSRJRF-NSHDSACASA-N 290.315 2.404 10 10 CECE CN(C)c1cc(F)c(CN2C[C@H]3COC[C@]3(C)C2)cc1F 862416058 LOSMWPMYIGVAOA-LRDDRELGSA-N 296.361 2.499 10 10 CECE CCOc1ccc(CN2[C@H]3CC[C@H]2CC(O)C3)c(O)c1 768240856 IHIZUBAJUXNSNF-STQMWFEESA-N 277.364 2.279 10 10 CECE Cc1ccn(C[C@H](C)C(=O)N2Cc3cccc(O)c3C2)n1 871197831 DYKGGAIYFNFFSV-NSHDSACASA-N 285.347 2.076 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NC1CC2(CSC2)C1 871507495 JWHQOMZVCJVSJJ-RQOWECAXSA-N 291.372 2.123 10 10 CECE C[C@H](Cc1ccc(N)cc1)N(C)C1CCN(C)CC1 71426041 VFBRFEMTWFDNSG-CYBMUJFWSA-N 261.413 2.226 10 10 CECE CN1CC[C@@H]2CN(Cc3cc(F)cc(F)c3O)CC[C@@H]21 895459945 CJIRFZQWCJGXKR-YGRLFVJLSA-N 282.334 2.196 10 10 CECE CN1CCC([C@H](N)c2cc(F)c(N(C)C)cc2F)CC1 75903881 LTTPJQJMBZIXBV-HNNXBMFYSA-N 283.366 2.372 10 10 CECE NC(=O)c1ccc(NCc2cccc(F)c2O)cc1 83439274 HYZCTPVXBHQCRB-UHFFFAOYSA-N 260.268 2.242 10 10 CECE Oc1cccc2c1CCN[C@H]2c1c(O)cccc1F 83703247 DFQVGBJWOIVHJU-OAHLLOKOSA-N 259.280 2.472 10 10 CECE COc1cc2c(cc1OC)N(CC(=O)O)CC[C@@H]2C 84802054 JAYRZXZSJUHPLA-VIFPVBQESA-N 265.309 2.102 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3[C@H]2CCCN3C)c1 720451820 RZJVDLOWHIGASO-LSDHHAIUSA-N 260.381 2.369 10 10 CECE C[C@@H]1CCCCN(CC(=O)N(C)c2ccc(N)cc2)C1 703240507 JWWBHNCHOVNSTE-CYBMUJFWSA-N 275.396 2.354 10 10 CECE C[C@H](O)c1ccc(N2CCNC(=O)C[C@@H]2C)cc1Cl 687976572 FBTSLDRPTUWWTR-UWVGGRQHSA-N 282.771 2.108 10 10 CECE Nc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1 705415325 ZCRGMWJGKMVTJY-GOSISDBHSA-N 297.402 2.318 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccc(-c2nnco2)cc1 706393505 STKNSJIUWDULCT-UHFFFAOYSA-N 272.268 2.167 10 10 CECE CSC[C@@H]1CCN(CCc2ccc(N)cc2)C1 706668325 YCPDUUBSBCIQEA-CYBMUJFWSA-N 250.411 2.496 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CCC[C@@H]43)c(Cl)cc2[C@H]1O 706728618 RHCAWYAGFCBFJO-LCHGKGQCSA-N 278.739 2.314 10 10 CECE C[C@H](CO)CN(C)c1ccc([C@@H](C)O)cc1Cl 688681638 ALPGMHGJCSLLMT-VHSXEESVSA-N 257.761 2.458 10 10 CECE COCCNCc1ccc(N2CCC(F)CC2)cc1 689394116 ITZAJGNRBFRVNA-UHFFFAOYSA-N 266.360 2.361 10 10 CECE CC[C@@H](NCC[C@H](O)C(F)F)c1ccccc1O 716775030 PSNRITTVXIRHTF-PWSUYJOCSA-N 259.296 2.449 10 10 CECE COc1cc(N)c(N(C)C[C@@]2(C)CCOC2)cc1OC 687495065 QZPVWHVXZCVPAE-OAHLLOKOSA-N 280.368 2.149 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@]12CCC[C@H]1OCC2 687417835 HEAXSBJQHJVRIS-GDBMZVCRSA-N 275.348 2.310 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@]1(C)CCCN1 79518435 LPASRIWZIRBTPE-NHYWBVRUSA-N 262.353 2.054 10 10 CECE C[C@@H](CNC(=O)c1cccc(O)c1O)C(F)(F)F 697706972 ONBZOWADLVNGKH-LURJTMIESA-N 263.215 2.026 10 10 CECE CCn1cncc1[C@H](CN)N(C)c1ccc(OC)cc1 90174814 BMHHJQKTGDEIMR-AWEZNQCLSA-N 274.368 2.048 10 10 CECE CCC[C@@H]1C[C@@](NCCCN=[N+]=[N-])(C(=O)OC)CCO1 90259240 WVBUZMYHKSYOMI-DGCLKSJQSA-N 284.360 2.167 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](N(C)C)C2)c(F)c1 97013016 YWRMFPLXIUSTPH-WCQYABFASA-N 265.376 2.376 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC([C@H]2CCNC2)C1 1886866963 UYUSFVAOGRYNMS-MNOVXSKESA-N 264.344 2.134 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@@H]1C[C@H]2C[C@H]2CO1 2122825683 DQDHWHPCYYQXBJ-ILXRZTDVSA-N 261.365 2.349 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1[C@H]1CCO[C@@]2(CCOC2)C1 2123015786 PSUMPFVDBDSWDF-XQQFMLRXSA-N 266.345 2.099 10 10 CECE NC(=O)[C@@H]1CCCC[C@H]1NCc1cccc(Cl)c1O 2117472666 AYVLEOYTFODVII-ZYHUDNBSSA-N 282.771 2.179 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1[C@H]2COC[C@H]21 2117957394 XTEQQWWAADYSCK-FZKCQIBNSA-N 259.349 2.213 10 10 CECE CC(C)[C@@H](C(=O)O)N(C)[C@@H](C)c1ccc(O)cc1O 2118365906 ATAKTUFAADNOPS-ZANVPECISA-N 267.325 2.200 10 10 CECE F[C@@H]1CCC[C@H]1Oc1ccc(N2CCNCC2)cc1 2118871006 RQULBWBCLLZCSK-HUUCEWRRSA-N 264.344 2.366 10 10 CECE N[C@@H](c1ccccc1O)[C@@H](O)C1CC2(C1)CC2(F)F 2130895023 FZONCAGFHJOCGL-CQXWZGLCSA-N 269.291 2.188 10 10 CECE c1cc2c(cc1CNC[C@@H]1[C@@H]3CCCO[C@@H]31)CCO2 2119934544 PSUQMDNWAOSAIO-LZWOXQAQSA-N 259.349 2.136 10 10 CECE CN(C[C@H]1[C@H]2OCCC[C@H]12)c1ccc(CN)c(F)c1 2119940969 JYKVPLULELJOAY-NFAWXSAZSA-N 264.344 2.146 10 10 CECE CCOC(=O)[C@](C)(C[C@@H](C)C(F)F)NCCN=[N+]=[N-] 2121394325 WSTONOUUUQMMLD-KCJUWKMLSA-N 278.303 2.499 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3[C@H](CO)[C@@H]3C2)c(Cl)c1 2125606179 PJEKNAGNJXNZAT-FOUMNBMASA-N 280.799 2.295 10 10 CECE O=C(NC1CC2(C1)CC21CC1)c1cccc(O)c1O 2127614255 VVXFUXVMCGBQPP-UHFFFAOYSA-N 259.305 2.160 10 10 CECE CN1CCCN(c2ccc3c(c2)CCC[C@@H]3N)CC1 2128268195 CRVGCCLZMCHUHE-INIZCTEOSA-N 259.397 2.165 10 10 CECE CN[C@@H]1CCCc2cc(N3CC4(COC4)C3)ccc21 2128269653 UWKYFSJJPJJXAL-OAHLLOKOSA-N 258.365 2.120 10 10 CECE C[C@@H]1[C@@H](O)CCCN1c1ccc2c(c1)CCC[C@@H]2O 2128274941 REJIURDVVHNITR-RLCCDNCMSA-N 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CN(C)CC1CCN(c2ccc(CN)c(F)c2)CC1 135223914 BVQWGNOIPPRMFW-UHFFFAOYSA-N 265.376 2.062 10 10 CECE CCCN(Cc1ccccc1O)C1CCS(=O)(=O)CC1 2143374394 KQESIRLIGQUWGD-UHFFFAOYSA-N 297.420 2.181 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H](CN)C(F)(F)F 2144330519 URPAFSGMXYNDNV-PSASIEDQSA-N 290.285 2.049 10 10 CECE Oc1ccc(Cl)cc1CN1CCO[C@H]([C@@H]2CCOC2)C1 1967740527 WDXUQTJFNZEOBO-ABAIWWIYSA-N 297.782 2.283 10 10 CECE O=C(O)c1ccoc1CNCc1ccc2c(c1)CCO2 1967992807 WLOCWEFXPYVBPY-UHFFFAOYSA-N 273.288 2.203 10 10 CECE CCN[C@H](c1ccc[nH]1)[C@H](O)c1ccc(N(C)C)cc1 2148169502 BSLDDQJLAATDRY-HZPDHXFCSA-N 273.380 2.465 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)[C@@H]1CCCOC1 2148151357 ITKHHDRGYRNFRH-WQVCFCJDSA-N 279.380 2.220 10 10 CECE CN[C@H](c1ccccc1O)[C@@](C)(O)c1ccc(O)cc1 2148146354 DAQITLQENHANDZ-CVEARBPZSA-N 273.332 2.266 10 10 CECE COc1cccc(CN(C)C[C@@]2(C)CCCO2)c1O 1973991610 PEFSQNRJLXRPNU-OAHLLOKOSA-N 265.353 2.402 10 10 CECE Oc1cc2c(cc1CNC1C[C@@H]3CSC[C@H]3C1)OCO2 1973975166 GLCBCPMUSHPQMM-GHMZBOCLSA-N 293.388 2.352 10 10 CECE COc1cccc(CN2CCC[C@@H]3CC[C@@]32CN)c1O 2145598785 ITEJMMGOCYWHLX-CZUORRHYSA-N 276.380 2.104 10 10 CECE CSc1cccc(O)c1[C@H]1C[C@@H](CN)CN1C 258548883 GDJDBGCKFWOWLU-VHSXEESVSA-N 252.383 2.066 10 10 CECE CC(C)[C@H]1CCN(c2cc3c(cc2N)OCC(=O)N3)C1 158352126 IUQMUOACUBKELZ-JTQLQIEISA-N 275.352 2.082 10 10 CECE C[C@H](CN[C@@H](C)c1ccc(O)cc1O)c1cnn(C)c1 2147087766 OOTBAWMXOMRZJK-MNOVXSKESA-N 275.352 2.286 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CC[C@@H](C)[C@@H](CN)C1 163474237 ATVNRBFECLFCDV-WOPDTQHZSA-N 264.369 2.076 10 10 CECE CC[C@@H]1CCN([C@@H](C)c2ccc(O)cc2O)[C@@H]1C(=O)O 2151503789 WWVSDXYVBBSJPT-RBZYPMLTSA-N 279.336 2.344 10 10 CECE OC[C@H](Cc1ccccc1)NCc1cccc(F)c1O 165041508 KHCRLJPNDYYFKN-AWEZNQCLSA-N 275.323 2.225 10 10 CECE OCc1ccc(N2C[C@]34CCC[C@@]3(COC4)C2)c(F)c1 2153078275 RZQNQOFIRRVYNG-HOTGVXAUSA-N 277.339 2.325 10 10 CECE CCCOc1cc(N2CC(NCC)C2)ccc1[N+](=O)[O-] 2153349361 SNWVDMMUCJWKQF-UHFFFAOYSA-N 279.340 2.182 10 10 CECE Oc1cc(F)ccc1CNC1CCN(C2CC2)CC1 293814584 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CCCOC1CN(c2c(F)cc(CN)cc2F)C1 2040862379 YKYMXEFJEFCJHI-UHFFFAOYSA-N 256.296 2.039 10 10 CECE CO[C@@]1(CO)CCCN(c2ccc([C@H](C)N)c(Cl)c2)C1 402967692 POADLQBRBFFGHK-NHYWBVRUSA-N 298.814 2.337 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1cn(C)cn1 311382243 NHHSQOSDVQOSHH-OAHLLOKOSA-N 258.369 2.185 10 10 CECE COc1ccc(N2C[C@@H](C)[C@](C)(CN)C2)cc1OC 311422370 FGUYPLATGSABON-IAQYHMDHSA-N 264.369 2.125 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCCO[C@H]1C(C)(C)C 2160267169 VICYYYQEPAQMCK-GWCFXTLKSA-N 284.360 2.023 10 10 CECE CN(C)C[C@@H]1CCN1c1ccc(CO)c(C(F)(F)F)c1 2160848734 WIBWLGXZLOEOEX-LBPRGKRZSA-N 288.313 2.338 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H]1CCS(=O)(=O)[C@@H](C)C1 2161420946 BZNDOYVENQEWTP-ZOWXZIJZSA-N 297.420 2.256 10 10 CECE O=C(O)CC[C@H]1CCCN(Cc2ccc(O)c(O)c2)C1 86810147 QJJPQWJIKKDERL-LLVKDONJSA-N 279.336 2.175 10 10 CECE CCCN(CCCS(=O)(=O)CC)c1ccc(CN)cc1 86973196 ATPUZEJCWOBAOS-UHFFFAOYSA-N 298.452 2.187 10 10 CECE CN1CCCc2cc(CN[C@@H]3[C@@H]4CCCO[C@H]43)ccc21 2176419559 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Cc1cccc(O)c1CN1CCC[C@]2(C[C@H]2C(=O)O)C1 2160786018 KGVYZYCGNJXAPZ-BBRMVZONSA-N 275.348 2.387 10 10 CECE COc1cccc(O)c1CNC1CCN(C(C)C)CC1 2160735877 LCWJHKQJLJNVFX-UHFFFAOYSA-N 278.396 2.363 10 10 CECE CP(C)(=O)[C@H]1CC[C@@H](NC(=O)c2cccc(O)c2O)C1 2160829598 MISGSOKMVCRKGU-ZJUUUORDSA-N 297.291 2.371 10 10 CECE C[C@H]1CCC[C@](O)(CNCc2ccc(O)c(O)c2)C1 87051094 MOUBQYXDXMZKKB-XHDPSFHLSA-N 265.353 2.129 10 10 CECE CCNCc1cc(F)c(N2CC=C(CO)CC2)c(F)c1 2170998012 VWIXIDUINZVVJT-UHFFFAOYSA-N 282.334 2.203 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)c1cccnn1 701780687 VOJZUJMEXIKWBY-UHFFFAOYSA-N 270.336 2.110 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)C1CCSCC1 703101710 RZEXSBFOPUZOKR-JTQLQIEISA-N 254.359 2.431 10 10 CECE CN(C)C[C@H]1CCN(Cc2ccc(F)c(F)c2O)C1 703504201 XGJUIYQAFJCIGP-SNVBAGLBSA-N 270.323 2.054 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@@H](CO)C2)c(C)c1 704009943 KJBQDYQPPPDROY-SWLSCSKDSA-N 262.397 2.169 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)C[C@@H]1CCCN(C)C1 705204008 YXZZHCIWOQWTFH-QWHCGFSZSA-N 278.396 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CNCc1cc(C)nn1Cc1cccc(Cl)c1O 2070161281 IOMDTXXZEOIBHH-UHFFFAOYSA-N 265.744 2.318 10 10 CECE C[C@H](c1cc([N+](=O)[O-])ccc1O)n1nc(O)cc1Cl 2070204267 UIZZSADBJVNTGV-ZCFIWIBFSA-N 283.671 2.465 10 10 CECE CCNCc1ccc(N2Cc3cnn(C)c3C2)cc1C 2168482031 BLYJTEJMCUSBHJ-UHFFFAOYSA-N 270.380 2.358 10 10 CECE CO[C@H]1C[C@H](CN[C@@H](C)c2ccccc2O)C[C@H]1OC 2174848205 XWUBUCJLXSTHFT-GVAFMPQTSA-N 279.380 2.483 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N(C)[C@H]3CCC[C@@H]3F)cc21 2175577443 HJLFENRVDPYWTL-SGMGOOAPSA-N 278.327 2.023 10 10 CECE CN[C@H](C)c1ccc(N2CC(=O)NCC2(C)C)cc1Cl 2175724899 KBCFTHADIRSYJO-SNVBAGLBSA-N 295.814 2.335 10 10 CECE NCc1cc(F)c(N2CCC[C@@H]3COCC[C@@H]32)c(F)c1 2170284289 SMFYHTLGNSSSOG-RISCZKNCSA-N 282.334 2.429 10 10 CECE CN(C)c1ccc([C@H](NN)C23CCC(CC2)OC3)cc1 2192883590 UOBPYLWBLQNKEO-PCKAHOCUSA-N 275.396 2.216 10 10 CECE COC1(C(F)(F)F)CC(C(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 2182022455 SCJAJPKGIFFDFQ-ZCUBBSJVSA-N 292.261 2.255 10 10 CECE Nc1ccc(CCOc2ccc(N)cc2C(=O)O)cc1 2199010240 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2.403 10 10 CECE Nc1ccc(O)c(CNC(=O)C[C@@H]2C[C@@H]2C(F)(F)F)c1 2185213676 PGGONQSQJMOKKU-XVKPBYJWSA-N 288.269 2.179 10 10 CECE C[C@@H](N)c1ccc(N2CC(C[S@@](C)=O)C2)cc1Cl 2047850644 QAPMRLUNQYCZEO-DYBLOJMWSA-N 286.828 2.174 10 10 CECE CNCc1ccc(N(C)Cc2cnsn2)c(C)c1 2048234861 PYKINMRDTBBSGP-UHFFFAOYSA-N 262.382 2.202 10 10 CECE C[C@H]1CC[C@@](CO)(NCc2ccc3c(c2)CCN3C)C1 2194682758 SRUKAKWSKXHRQU-SUMWQHHRSA-N 274.408 2.320 10 10 CECE N[C@H]1CCc2cc(N3CC[C@@H]4CCOC[C@H]4C3)ccc21 2185436273 DDNGKRPEDVJWMY-MRRJBJDNSA-N 272.392 2.495 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1C2C[C@@H]3C1[C@@H]3C2 2190913709 SENBNTPDCRXUAP-WAJSSGOGSA-N 270.376 2.314 10 10 CECE Cc1nnc(CN(C)c2c(F)cc([C@@H](C)N)cc2F)o1 2194701572 FMPJCXVNZLTGIG-SSDOTTSWSA-N 282.294 2.312 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CO[C@H](C(C)(C)C)C1 2185631794 LAVPFCWGEJDUIZ-GXFFZTMASA-N 284.360 2.023 10 10 CECE C[C@@H]1C[S@@](=O)CCN1[C@H](C)c1cc(F)ccc1O 2051940530 AOMSDSPDHJYPBJ-MHNGPXOMSA-N 271.357 2.045 10 10 CECE 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HSTJYKZJMRRZER-ZDUSSCGKSA-N 279.380 2.302 10 10 CECE CC[C@H](C)OC(=O)CN1CCNc2cc(OC)ccc21 76926803 PUDMGTGDPTZIQQ-NSHDSACASA-N 278.352 2.269 10 10 CECE C[C@H]1CCc2[nH]nc(C(=O)N3Cc4cccc(O)c4C3)c2C1 899172912 GVPANSCQAOXUOX-JTQLQIEISA-N 297.358 2.396 10 10 CECE CC[C@](NCCCN=[N+]=[N-])(C(=O)O)C(F)(F)F 702914443 ILSLIWPPXVKSBS-ZETCQYMHSA-N 254.212 2.072 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1C[C@@H](CN)CC[C@H]1C 70178689 QQCTZXQHAKKMDM-GRYCIOLGSA-N 264.369 2.218 10 10 CECE COc1cc(Cl)cc(CN2C[C@H]3CNC[C@]3(C)C2)c1O 703618846 HEBQHKRRXYJGCU-IAQYHMDHSA-N 296.798 2.096 10 10 CECE C[C@@H](O)[C@H]1CCCN(c2ccc(CO)cc2Cl)C1 689043086 JAGVLNZRTGYPMA-PWSUYJOCSA-N 269.772 2.430 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@]3(CCOC3)C2)cc1O 707653895 QVJKFVGMMRIMGU-IAQYHMDHSA-N 262.353 2.029 10 10 CECE CCN[C@H](C)c1ccc(N2CCNC(=O)C[C@H]2C)cc1 707637017 RQNGVRCQKCQSSF-CHWSQXEVSA-N 275.396 2.072 10 10 CECE CS[C@@H]1CCC[C@H]1N(C)c1ccc2c(c1)NC(=O)[C@H]2N 687916598 CVWIXXXWQKABED-MCIONIFRSA-N 291.420 2.359 10 10 CECE CCSC[C@@H](C)N(C)C[C@H](O)COc1ccc(N)cc1 687962421 PXZLWGKBTBCLLV-OCCSQVGLSA-N 298.452 2.082 10 10 CECE COc1ccc2[nH]c(Cc3ccc(N)cc3)nc2n1 88192659 FOKUBKZEAIIDRH-UHFFFAOYSA-N 254.293 2.140 10 10 CECE CCc1ccc(C(=O)NCCOc2ccc(N)cc2)o1 91759521 RDSXHXDYQSGKNF-UHFFFAOYSA-N 274.320 2.233 10 10 CECE Nc1ccc(NC(=O)c2ccc3nccn3c2)cc1 178352817 GEYUTWKXPACBCF-UHFFFAOYSA-N 252.277 2.169 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1C[C@H]2CCC[C@H]1C2 1158524990 OQCZMXNUWZQHHG-RYUDHWBXSA-N 261.321 2.041 10 10 CECE O=C(C[C@H]1Cc2ccccc2O1)NCc1ccccc1O 1150536644 PZKYTOICKIWUIF-CQSZACIVSA-N 283.327 2.402 10 10 CECE Oc1ccc(Cl)cc1CN[C@@H]1CO[C@@]2(CCOC2)C1 2122433314 GBZNTPWAFDBQRA-JSGCOSHPSA-N 283.755 2.083 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)[C@@H]1[C@H]2CCC(F)(F)[C@H]21 2119415682 IQPJXCFQGWKRNG-BGZDPUMWSA-N 274.271 2.021 10 10 CECE C[C@@H]1CC[C@H]([C@@H](O)c2ccc(N3CCCC3)cc2)N1 2119471782 VBJZARVYJNUIKE-WQVCFCJDSA-N 260.381 2.461 10 10 CECE C[C@H]1C[C@@H]2CN(c3ccc(CN)cc3Cl)CCN2C1 2124850268 GIDQHSMWYWWHDW-WCQYABFASA-N 279.815 2.329 10 10 CECE CCOc1cccc(CN[C@@H]2COC3CC2C3)c1O 2126737009 ZEHVVQSCOVJOLZ-WXRRBKDZSA-N 263.337 2.058 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3CC[C@@]3(CO)C2)c(F)c1 1903985223 VYWAWWUMSRRXBV-HCKVZZMMSA-N 265.328 2.088 10 10 CECE C[C@H]1[C@H](O)CCCN1c1ccc2c(c1)CCC[C@@H]2O 2128274944 REJIURDVVHNITR-XZJROXQQSA-N 261.365 2.406 10 10 CECE C[C@H]1COC[C@@H]1N(C)c1ccc2c(c1)CCC[C@H]2N 2128278552 YJSDHOPBILSHDU-XZJROXQQSA-N 260.381 2.494 10 10 CECE CC(F)(F)[C@@H](N)[C@@H](O)c1ccc(N2CCCC2)cc1 2128395434 ZUPWCZGHRRAFFJ-STQMWFEESA-N 270.323 2.303 10 10 CECE CN(C)[C@@H]1CCCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128316774 JNICTTVRZVXCJO-ZBFHGGJFSA-N 259.397 2.163 10 10 CECE CN(C)c1cc(F)c(CN2CC[C@@]23CCOC3)cc1F 1331690077 HBUIARJVIHYJNP-HNNXBMFYSA-N 282.334 2.396 10 10 CECE Cc1cc(N2CC[C@@H](O)[C@H]2C(C)(C)C)ccc1CO 2128759267 CSLDVXUWPJZNNE-CABCVRRESA-N 263.381 2.473 10 10 CECE CO[C@]1(CN(C)c2ccc(CO)cc2Cl)CCOC1 2129657654 VQDWNBWKLRDWFG-AWEZNQCLSA-N 285.771 2.074 10 10 CECE C[C@H]1CCSCCN1c1ccc(CO)c([N+](=O)[O-])c1 2132058119 MNJJDMMRFMZHJR-JTQLQIEISA-N 282.365 2.419 10 10 CECE C[C@]1(F)CCCN(c2ccc(CO)c([N+](=O)[O-])c2)C1 2132059327 UAGZCVBRMMIBDU-ZDUSSCGKSA-N 268.288 2.416 10 10 CECE O=[N+]([O-])c1cc(N2CCC[C@@H]2C2CC2)ccc1CO 2132051797 BFPXFGMUWDVUCZ-CYBMUJFWSA-N 262.309 2.466 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@@H](CN)CC1(C)C 2132470452 CZCIKLIFBUWGCK-GHMZBOCLSA-N 264.369 2.218 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C[C@@H]2CN3CCC2CC3)C1 1912170328 VUZMGQHAVOEMPS-OLZOCXBDSA-N 277.372 2.020 10 10 CECE [N-]=[N+]=NC1CCN(CCN2CCC(F)(F)CC2)CC1 1912184680 GPCFOFOAVNKUAQ-UHFFFAOYSA-N 273.331 2.492 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CCN2C(=O)c3ccccc3C2=O)C1 1912160408 VUTAEOSBQWYBCO-LLVKDONJSA-N 299.334 2.057 10 10 CECE CC(C)n1ccc(C(=O)NCCCCN=[N+]=[N-])n1 1912183752 TXEYXUFMILKZJL-UHFFFAOYSA-N 250.306 2.284 10 10 CECE Cc1ccc(S(=O)(=O)N2CC[C@H](CN=[N+]=[N-])C2)cc1 1912154280 BJLOKJDBDKFRBT-LLVKDONJSA-N 280.353 2.316 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1CCC[C@H]1C 1912156848 NXYXSVRXZOZOJF-GMTAPVOTSA-N 254.334 2.254 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(Cc2cnn(C(F)(F)F)c2)C1 2135053646 KCIDCAZMNKPVNM-MRVPVSSYSA-N 274.250 2.492 10 10 CECE CN(CCN=[N+]=[N-])C(=O)C1C[C@@H]2CC[C@H](C1)S2 1912206905 VCXUPENLMTZMNO-PBINXNQUSA-N 254.359 2.429 10 10 CECE C[C@@H](CN[C@H](C)c1c(O)cccc1O)N(C)C1CC1 217605922 ISUZOUAVFUPVLW-WDEREUQCSA-N 264.369 2.231 10 10 CECE CO[C@H]1CN(Cc2c(O)cccc2Cl)CC[C@H]1OC 2134859397 JAHLCDUXWCGYLX-KGLIPLIRSA-N 285.771 2.281 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2CC1(CO)CC1 1913933351 BMOZDJPWDKXTQP-LBPRGKRZSA-N 260.381 2.231 10 10 CECE CC[C@H]1C[C@H]1COCC(=O)N(C)c1ccc(N)cc1 2135819455 KRZQWVFFNOOSHY-RYUDHWBXSA-N 262.353 2.294 10 10 CECE O=C(NCc1cc(O)ccc1O)c1nccc(Cl)c1F 1455356677 JZIAPHJRMLEUKT-UHFFFAOYSA-N 296.685 2.215 10 10 CECE Nc1ccc(CCCN2CC[C@@]3(CCC[C@@H]3O)C2)cc1 1918916892 POQLAHUKSHMZFO-IRXDYDNUSA-N 274.408 2.438 10 10 CECE CC(C)(C)OC(=O)NC1([C@H](CO)N=[N+]=[N-])CCC1 1535972101 IZOSUEMKNZOHAK-QMMMGPOBSA-N 256.306 2.105 10 10 CECE CC(C)[C@@H]1CCCN1C[C@@H](O)COc1ccc(N)cc1 226565754 XRCRKPWIFAMSJQ-ZBFHGGJFSA-N 278.396 2.129 10 10 CECE CCOc1cc(CNC(C)C)ccc1N(CC)CCO 211959071 HEMUXNBDTBAYIR-UHFFFAOYSA-N 280.412 2.402 10 10 CECE COc1cc2c(cc1Cl)N(C)C[C@H]1CNCC[C@H]21 215595113 GAEQAOKALSQKGB-ZJUUUORDSA-N 266.772 2.492 10 10 CECE COc1ccc(CNCCN(C)C(=O)CC2CC2)cc1C 1713567480 QVWQGVNEJYAQDI-UHFFFAOYSA-N 290.407 2.352 10 10 CECE COc1ccc(O)c([C@@H](C)N(C)[C@H](C)CC(=O)O)c1 1926934030 LDQYQVHCUHTNNG-NXEZZACHSA-N 267.325 2.257 10 10 CECE COc1ccc(O)c([C@@H](C)N(C)[C@@H](C)CC(=O)O)c1 1926934032 LDQYQVHCUHTNNG-VHSXEESVSA-N 267.325 2.257 10 10 CECE Cc1cc(CC(=O)NCc2cc(Cl)ccc2O)no1 1640919863 CRJSENPAGJKTRX-UHFFFAOYSA-N 280.711 2.201 10 10 CECE C[C@H](N)Cc1ccc2ccn(Cc3ccn(C)n3)c2c1 229748368 DZXVIHGTCTXLIX-LBPRGKRZSA-N 268.364 2.313 10 10 CECE CCN(CC)C(=O)CN(C)CCCc1ccc(N)cc1 122649186 VIRMXCYNYRZQBO-UHFFFAOYSA-N 277.412 2.002 10 10 CECE COc1ccc([C@@H](C)NCC(C)(C)CCO)c(O)c1 230665167 MXRONIHCADXZBB-LLVKDONJSA-N 267.369 2.460 10 10 CECE CNCc1ccc(N2CCC(OC)CC2)cc1OC 2139697648 XYHZBLHWJMCFEC-UHFFFAOYSA-N 264.369 2.030 10 10 CECE CC(C)C[C@H](N[C@H](C)c1c(O)cccc1O)C(=O)O 232624476 OXSPRKUDRTWHJC-ZJUUUORDSA-N 267.325 2.248 10 10 CECE CC[C@@H]1COC[C@H]1N(C)c1ccc(CO)c(OC)c1 2139700369 IVNHIUUSWGTHCA-BXUZGUMPSA-N 265.353 2.049 10 10 CECE Oc1cc(F)ccc1CNCC1(n2cccn2)CC1 2139886246 ZNSPNNMYFMCVCX-UHFFFAOYSA-N 261.300 2.007 10 10 CECE NCc1ccc(N2CCn3ccnc3C2)c(C(F)(F)F)c1 163713365 DYXHAQLKGZFDOD-UHFFFAOYSA-N 296.296 2.381 10 10 CECE Oc1cc2c(cc1O)[C@H](O)[C@H](c1ccccc1)CO2 201996262 MLYJXOGQMWPMGJ-NHYWBVRUSA-N 258.273 2.307 10 10 CECE COc1cc(C)c(N(C)CC2(CO)CC2)c(OC)c1 258867243 HPYOJAKMVTUWDM-UHFFFAOYSA-N 265.353 2.221 10 10 CECE CCCOCCOc1ccc(N2CCNCC2)cc1C 233227038 OZVHEELLPAADSM-UHFFFAOYSA-N 278.396 2.210 10 10 CECE CCN(C(=O)c1cc(O)cc(O)c1)c1ccc(N)cc1 233451861 BVRAOIGJHULQSY-UHFFFAOYSA-N 272.304 2.347 10 10 CECE C[C@@H]1C[C@@]1(F)[C@@H](NN)c1ccc2c(c1)CCCN2C 2141336449 YZODJVDOTGPYDR-ONERCXAPSA-N 263.360 2.322 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1C[C@H]2COC[C@H]21 1940426968 SNMOEKXJVYHEKV-MKPLZMMCSA-N 253.729 2.170 10 10 CECE CC[C@@H]1CCN(Cc2cc(OC)ccc2O)[C@@H](CN)C1 233931196 WHHQQMAQADIXLK-TZMCWYRMSA-N 278.396 2.350 10 10 CECE CC[C@H]1C(=O)NCCN1c1ccc([C@@H](CC)NC)cc1 233903596 HSYWYDPWPOBKOY-CABCVRRESA-N 275.396 2.072 10 10 CECE C[C@@H](O)c1ccc(N(C)C2CN(C)C2)cc1Cl 1941725705 NDBJSBHAEDMGQO-SECBINFHSA-N 254.761 2.144 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)CCN1CCCC1 235172315 ISOVIDOLLIYGHH-GFCCVEGCSA-N 264.369 2.186 10 10 CECE CC[C@@](N)(CCCSc1nccs1)C(=O)OC 1940639019 NTEQRTDLBRDLID-LLVKDONJSA-N 274.411 2.296 10 10 CECE COc1ccc(N(C)Cc2nnnn2C(C)(C)C)cc1 844352786 HPFWNRFVSIOTBZ-UHFFFAOYSA-N 275.356 2.073 10 10 CECE Cc1cc(CN2CCn3nccc3C2)ccc1N(C)C 1139673150 AHJJUNWOBAOTAX-UHFFFAOYSA-N 270.380 2.273 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H]2CCC[C@@]2(C(N)=O)C1 2144092371 CAPHWPZVPQYLBF-BFQNTYOBSA-N 274.364 2.041 10 10 CECE Cc1cccc(N[C@H](C(N)=O)c2cc(F)ccc2O)c1 235927713 ZQKFXARUVQZZMA-AWEZNQCLSA-N 274.295 2.478 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)CC(C)(C)CO)c(F)c1 1880925379 BJLWYFYLZMBPMT-SECBINFHSA-N 272.339 2.439 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCO[C@@H]2COCC[C@H]21 2143770750 YWBZMBFZAOIDMI-WDBKCZKBSA-N 281.327 2.082 10 10 CECE CC(C)(C)OC(=O)NCCC(C)(C)C(=O)NCCN=[N+]=[N-] 1885561413 QZIMKZLNJBYKEP-UHFFFAOYSA-N 299.375 2.354 10 10 CECE COC1(CNCc2ccc3c(c2)CCCN3C)CC1 1964560197 ABDXXXXUEFMZBV-UHFFFAOYSA-N 260.381 2.338 10 10 CECE CN(Cc1ccc(Cl)cc1O)C[C@H]1CCNC1 1948870587 YOJSEQKHLJIJQG-JTQLQIEISA-N 254.761 2.087 10 10 CECE Cc1ccc(O)c([C@@H](N)CC(=O)OC(C)(C)C)c1 1951377123 NOIUAWXTDVOCFK-NSHDSACASA-N 251.326 2.432 10 10 CECE CN1CCc2cc([C@H](CN)N3C[C@H]4CC[C@H]3C4)ccc21 250375472 KGUBJQGPAPSERY-NUTKFTJISA-N 271.408 2.163 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)[C@H](OC)C(C)C 2148163644 NBHSHEMGBZUYIU-BZUAXINKSA-N 281.396 2.465 10 10 CECE COc1cccc(C(=O)N(C)c2ccc(N)cc2)c1O 20373786 BDZHPJDCRGZCQS-UHFFFAOYSA-N 272.304 2.260 10 10 CECE 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CECE CN(Cc1ccccc1O)C(=O)c1cc(Cl)ncc1N 234288101 KTOITUFGKAOCEM-UHFFFAOYSA-N 291.738 2.295 10 10 CECE CN(C)c1ccc2nc(-c3ccc(O)c(O)c3)[nH]c2n1 234259606 BUAKBWSPRPJCEH-UHFFFAOYSA-N 270.292 2.102 10 10 CECE CCOc1cccc(CN2CC[C@@]23CCOC3)c1O 1203615042 KXKUWPVIXPHCST-HNNXBMFYSA-N 263.337 2.156 10 10 CECE C[C@@H](NCC[C@@]1(C)COCCO1)c1ccccc1O 1875565418 YSPORHWKLGBADA-DOMZBBRYSA-N 265.353 2.238 10 10 CECE COc1ccc(N2CCNC[C@@H]2C(C)(C)C)c(N)c1 1876664971 KHEMZJFDHTZZMN-CQSZACIVSA-N 263.385 2.102 10 10 CECE CNCc1ccc(N2C[C@H](C)N(C)[C@@H](C)C2)c(F)c1 127920454 OGRXDNSEEDJQOV-RYUDHWBXSA-N 265.376 2.074 10 10 CECE CC[C@@H](C)NC(=O)CN(C)[C@@H](C)c1ccccc1O 1877539608 XLKZBRFBBJQHBB-NEPJUHHUSA-N 264.369 2.300 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H]4COCC[C@H]43)ccc21 1878826345 ZPJKNQDZVJBGCL-VBNZEHGJSA-N 258.365 2.248 10 10 CECE C[C@H]1CC[C@](C)(NC(=O)c2cc(O)c(O)c(O)c2)C1 1878820279 WOGGQAQOSMYLAX-RTHLEPHNSA-N 265.309 2.112 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@]23CNC[C@H]2C3)cc1 1902284139 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CCCc1cnn(CC(=O)N(C)c2ccc(N)cc2)c1 402023756 SSRAYQQISZVUIN-UHFFFAOYSA-N 272.352 2.081 10 10 CECE COC[C@H](OCCC(=O)Nc1ccc(N)cc1)C(C)C 404078432 RMGALJDIPDEICH-AWEZNQCLSA-N 280.368 2.285 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H]2CN3CCC2CC3)cc1 312467628 WTOZBLSWNNAABG-GUYCJALGSA-N 273.424 2.497 10 10 CECE CCN1CCCN(Cc2cccc(F)c2O)[C@@H](C)C1 320294722 ZMVBOVOFNZEAFY-LBPRGKRZSA-N 266.360 2.447 10 10 CECE C[C@H](C1CCC1)N(C)CC(=O)N(C)c1ccc(N)cc1 325479270 XENMBTOITQVIKB-GFCCVEGCSA-N 275.396 2.352 10 10 CECE CCc1nc([C@@H](NCCCN=[N+]=[N-])C(=O)OC)cs1 328473490 NVOLSAADJAONHC-SNVBAGLBSA-N 283.357 2.210 10 10 CECE CC(C)(C)CCNC(=O)[C@@H](N)c1cccc(F)c1O 83510003 MEWUTXCOXLQAQV-NSHDSACASA-N 268.332 2.084 10 10 CECE CC[C@H](CN)C(=O)N(CC)Cc1ccc(N(C)C)cc1 87525581 YKUOEGCBNHVOCF-CQSZACIVSA-N 277.412 2.086 10 10 CECE CCc1cccc(CNCC2(O)CCSCC2)c1O 702306773 NKGKUZRFQNHJBE-UHFFFAOYSA-N 281.421 2.302 10 10 CECE C[C@H]1CN(c2ccc(CO)cc2Cl)C[C@]1(C)CO 703715543 AKLYWYFTPGBRCT-IINYFYTJSA-N 269.772 2.287 10 10 CECE Nc1ccc(CCC(=O)NC[C@H]2C[C@]23CC3(F)F)cc1 2172026477 PJQFFHLGTCPYFJ-RISCZKNCSA-N 280.318 2.363 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CCCC[C@H]43)ccc21 706770120 WDYSDMFYHHYVGB-FZZIBODNSA-N 257.337 2.017 10 10 CECE CC1(C)OCC[C@@H]1NCc1cc(F)cc(F)c1O 708438794 YSQZQWMZHSZIDV-NSHDSACASA-N 257.280 2.328 10 10 CECE C[C@@H]1CC[C@H](CO)CN1c1c(F)cc(CO)cc1F 688732955 XGOUTBWASJFPRJ-ZJUUUORDSA-N 271.307 2.054 10 10 CECE CC(C)OCCC[C@H](NN)c1ccc(N(C)C)cc1 689656143 UXFSECQHUQLTSI-HNNXBMFYSA-N 265.401 2.462 10 10 CECE C[C@H]1CCN(c2ccc(CN)c(Cl)c2)CCO1 720483994 QKWJTZAVRMXMET-JTQLQIEISA-N 254.761 2.414 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2CCC[C@H](C)O 388982866 RDSFUEOGHHSHIJ-QWHCGFSZSA-N 262.397 2.491 10 10 CECE COc1cc(N[C@@H](C)c2cc(F)ccc2O)nn1C 381739588 PCBPFIPQQUUFBM-QMMMGPOBSA-N 265.288 2.447 10 10 CECE C[C@H](N[C@H]1CCN2CCC[C@H]1C2)c1c(O)cccc1O 383203702 XKLZHIGLLQXULV-AVGNSLFASA-N 276.380 2.233 10 10 CECE CCN(C[C@H](C)OC)[C@H](CN)c1ccc(N(C)C)cc1 383222854 OJYLVVTVDLXYRY-XJKSGUPXSA-N 279.428 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268.788 2.428 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@H](C)CO)c(Cl)c1 228529402 HJKBVXYOQHPADU-UWVGGRQHSA-N 256.777 2.437 10 10 CECE CC[C@H](C)N(C)C(=O)CCOc1ccc(N)cc1 42269066 TXPJJGGUZSUXRD-NSHDSACASA-N 250.342 2.295 10 10 CECE CCN(C(=O)C[C@@H](C)COC)c1ccc(N)cc1 95034076 IRPMTLZKORASSC-LLVKDONJSA-N 250.342 2.294 10 10 CECE COC(=O)CN(Cc1ccc(OC)cc1O)C1CCCC1 93707531 BJEODQSXWTVBAV-UHFFFAOYSA-N 293.363 2.318 10 10 CECE CC[C@H](CCO)CN[C@@H](C)c1cc(O)ccc1O 94948508 ZRPXMDYSKLXERP-WDEREUQCSA-N 253.342 2.157 10 10 CECE C[C@H]1C[C@H](N[C@H](C)c2cc(O)ccc2O)CCO1 235681232 NPCXPISLKJVHSO-HBNTYKKESA-N 251.326 2.316 10 10 CECE CN1CC[C@H](N(C)Cc2cccc(Br)c2O)C1 383657269 IMWFAWXMXOPSLU-NSHDSACASA-N 299.212 2.291 10 10 CECE C[C@@H]1COC[C@@H](C)N1Cc1ccc(N2CCOCC2)cc1 93606975 YMRVBUZUNZWVBV-HUUCEWRRSA-N 290.407 2.132 10 10 CECE CCOc1cccc(CN2C[C@@H]3CNC[C@H]3C2(C)C)c1O 250502707 AOVSKIQFTUOLPN-UONOGXRCSA-N 290.407 2.221 10 10 CECE COc1cc(O)c(CN(C)[C@H]2CC[C@H](O)CC2)cc1OC 275961389 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282.723 2.319 10 10 CECE CC[C@@H](O)[C@H](N)c1c(Br)ccc(C)c1O 396856109 XRNZBHMYLBGQEX-SCZZXKLOSA-N 274.158 2.234 10 10 CECE CC(F)(F)[C@H]1C[C@H]1C(=O)NCCOc1ccc(N)cc1 2164462611 NADJWDHWWYZWFJ-NEPJUHHUSA-N 284.306 2.055 10 10 CECE CC(C)N(Cc1ccc(N)cc1)S(=O)(=O)C[C@H]1C[C@H]1C 2164640707 DJCJRGBRAMXKBQ-TZMCWYRMSA-N 296.436 2.465 10 10 CECE O=C(O)[C@@H]1C[C@H]2CCC[C@H]2N1Cc1c(O)cccc1F 2164701587 JZWLCZKOXOHOGW-WQAKAFBOSA-N 279.311 2.359 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CCOC[C@H]2F)c(F)c1 2130205658 PJVCFLOWANDAQV-BHYNMZESSA-N 270.323 2.409 10 10 CECE Cc1cc(Br)cc([C@@H](N)[C@H](O)C2CC2)c1O 713772492 PMBUZZRLEFNSBJ-ZYHUDNBSSA-N 286.169 2.234 10 10 CECE CO[C@H]1C=CCN(c2ccc([C@@H](C)O)cc2[N+](=O)[O-])C1 2165062461 QKPYFBYQFBIFCV-PWSUYJOCSA-N 278.308 2.039 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)[C@@H]3[C@H]4CCC[C@H]43)ccc21 2167425398 LRKHQPBSEKUERC-DRBLLZIRSA-N 272.392 2.086 10 10 CECE CC(=O)C(=O)COC(=O)C1(c2c(F)cccc2F)CCC1 817251768 RWRUTYSVAPVRNB-UHFFFAOYSA-N 296.269 2.088 10 10 CECE 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2269291061 SYQZDKHRWHXULX-WFASDCNBSA-N 265.353 2.163 10 10 CECE Cc1cc(N2Cc3cnn(C)c3C2)ccc1[C@@H](C)O 2269680321 ZCEJFCTULFWATQ-LLVKDONJSA-N 257.337 2.302 10 10 CECE CC(=O)c1cc(F)cc(CN(C)Cc2nncs2)c1O 2281330972 IKCJCRVFSWACFQ-UHFFFAOYSA-N 295.339 2.217 10 10 CECE COc1ccc(N2CC[C@@]3(CCNC3)C2)c2c1CCC2 2284590774 JCXDVXHUEKHSMH-QGZVFWFLSA-N 272.392 2.374 10 10 CECE C[C@@H]1CCCC[C@H]1CNC(=O)c1cc(O)c(O)c(O)c1 1148585921 DXKKNDJBGTXIST-ZJUUUORDSA-N 279.336 2.360 10 10 CECE CCOC(=O)N1CCN(N=Nc2ccccc2)CC1 2318776148 YZFBHSMXHPBSAM-UHFFFAOYSA-N 262.313 2.459 10 10 CECE COC[C@@H]1CCCN1c1ccc(CN)c(SC)c1 2328544074 AWDXRCNSCGSJCW-ZDUSSCGKSA-N 266.410 2.482 10 10 CECE C[C@H](N[C@H]1C[C@@H]2OCCC[C@H]12)c1c(O)cccc1O 2328822264 SPVBZNWHLRSWTE-MIJXAVMKSA-N 263.337 2.316 10 10 CECE Cc1c(CN2C[C@@H]3C[C@H]2[C@@H]3N)n(C)c2ccccc12 2328843139 HSRGTBFIRAZBHN-HZUKXOBISA-N 255.365 2.018 10 10 CECE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@]3(C)O)c(O)c1 2333191086 VTKGJPNBMPHVDY-YXWQFLTLSA-N 261.365 2.340 10 10 CECE COc1cc(C)c(N2C[C@@H]3C[C@H](N)[C@@H](C3)C2)cc1C 2333673547 IAPMGCXUEGPJRZ-IHRRRGAJSA-N 260.381 2.486 10 10 CECE CCO[C@H]1C[C@@H]2CN(c3ccc(OC)cc3N)C[C@@H]21 2333621620 MQWYLTGOZODWEI-GMXABZIVSA-N 262.353 2.139 10 10 CECE C[C@@]1(CO)CCCN1c1ccc(CN)c(C2CC2)c1 2339158162 RKNQMAANJJOCRH-INIZCTEOSA-N 260.381 2.374 10 10 CECE N[C@H](c1ccccc1O)[C@]1(O)C[C@H]2C[C@H]1CC21CC1 2339249025 BCDITVSRACERGV-KTMIJUKYSA-N 259.349 2.333 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H](C(=O)O)C12CCC2 2339385034 VZYKTHCEERDBKF-CMPLNLGQSA-N 261.321 2.392 10 10 CECE CO[C@@H]1COCCN([C@H](C)c2cc(C)ccc2O)C1 2351625237 AGXVHHWJQSXFST-OLZOCXBDSA-N 265.353 2.109 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3C[C@@H](C)[C@@H](F)C3)c(Cl)cc21 2354091083 UZKUQRVMCZCSBD-LIEFSGRHSA-N 297.761 2.347 10 10 CECE CCCCN(CCC)C(=O)c1cc(O)nc(O)c1 170223284 HYHLUEXJQBTVHF-UHFFFAOYSA-N 252.314 2.145 10 10 CECE COc1cccc(N(C)C(=O)c2ccccc2CCN)c1 70552881 YAJXZMKUSZRJOU-UHFFFAOYSA-N 284.359 2.473 10 10 CECE COCCCCC[S@@](=O)CCOc1ccc(N)cc1 2271845386 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280.412 2.490 10 10 CECE Cc1ccc(Br)c([C@H](N)[C@H](O)C(C)C)c1O 95804068 UVCRNVCJIWBRIE-WDEREUQCSA-N 288.185 2.480 10 10 CECE CC[C@H]1CC[C@](NCCCN=[N+]=[N-])(C(=O)OC)C1 90259640 WEZOEMQBYWUROW-CMPLNLGQSA-N 254.334 2.398 10 10 CECE O=C1N[C@H](c2cc(F)cc(Br)c2O)CCO1 95718621 FOLCPQBPRJNISY-QMMMGPOBSA-N 290.088 2.465 10 10 CECE CN(C)c1ccc([C@@H](O)c2ccn(C3CC3)n2)cc1 2130232048 WURILCQZHAYZRM-OAHLLOKOSA-N 257.337 2.366 10 10 CECE COC[C@@H]1CCN([C@@H](C)c2c(O)cccc2O)C1 234842033 ARWKORMSHGATPY-WDEREUQCSA-N 251.326 2.127 10 10 CECE COc1cc(Cl)cc(CN[C@H]2CCOC[C@@H]2F)c1O 2130260973 RLFRAVQRVIWTNC-QWRGUYRKSA-N 289.734 2.271 10 10 CECE Cc1ccc(O)c(CN2C[C@H]3CNC[C@@H]3C2(C)C)c1 90335120 VRTIBKNNFDAJLT-KGLIPLIRSA-N 260.381 2.130 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@@H](O)C2)cc1Cl 234375707 WHYGUNFOKIDUNK-HZMBPMFUSA-N 268.788 2.267 10 10 CECE c1cc2c(cc1CN[C@@H]1CCO[C@@]3(CCOC3)C1)CCO2 367424001 YFRGQFXHTSSFBZ-WBVHZDCISA-N 289.375 2.049 10 10 CECE CN(C)c1ccc(CN[C@H]2CCc3nc[nH]c3C2)cc1F 377787131 SDGDJQJRBYHBRA-LBPRGKRZSA-N 288.370 2.262 10 10 CECE C[C@@H](CNC(=O)[C@@H]1CNc2ccccc2N1)CC(F)F 700029989 OPIYLSLRPCRFOI-SKDRFNHKSA-N 283.322 2.300 10 10 CECE CON(CCC(=O)Nc1ccc(N)cc1)C1CCCC1 2164729279 BOJNGEQUODTUPP-UHFFFAOYSA-N 277.368 2.403 10 10 CECE COC[C@]1([C@@H](O)[C@H](N)c2ccccc2O)CC=CCC1 2166474049 LRYIEAWRFHJRTC-PMPSAXMXSA-N 277.364 2.126 10 10 CECE CCN1CCc2cc(N3C[C@H](C)C(N)[C@@H](C)C3)ccc21 2163062427 MADDONMPRJOTEV-STQMWFEESA-N 273.424 2.489 10 10 CECE CCN1CCc2cc([C@](C)(O)[C@@H]3CCCCN3)ccc21 2163066246 JUNPCXNHAMHJHI-IRXDYDNUSA-N 274.408 2.419 10 10 CECE C[C@@H]1C[C@@H]([C@@H](NN)c2ccc(N3CCCC3)cc2)CO1 2163097578 PDMWOQAYYJZTMO-XPKDYRNWSA-N 275.396 2.216 10 10 CECE Cc1ncncc1[C@@H](O)c1ccc(N2CCCC2)cc1 2163114154 SNLBTKJTONYEGS-INIZCTEOSA-N 269.348 2.467 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)[C@@H]1CC12CC2 2163141638 WNYVPWMZXLFGGM-IMJJTQAJSA-N 272.392 2.100 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@]1(O)CC[C@@H]1C 2163242031 DWNLSCWUIDWIGG-JCURWCKSSA-N 274.408 2.491 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc(C[C@@H](C)N)c(C)c1)C2 2165444585 UICIXMYDONLGDE-FRFSOERESA-N 274.408 2.357 10 10 CECE CNCc1ccc(N(C)Cc2cnccn2)cc1C 700056977 AVSRFNKRYHJPOT-UHFFFAOYSA-N 256.353 2.141 10 10 CECE CO[C@@H](C)CCOc1ccc(N2CCC(N)CC2)cc1 2165536251 LNBGHQSGHUVSAA-ZDUSSCGKSA-N 278.396 2.418 10 10 CECE CO[C@@H](C)CCOc1ccc(N2CCCNCC2)cc1 2165540783 VTPYAGINVODYRP-AWEZNQCLSA-N 278.396 2.290 10 10 CECE COCCOCCCNCc1cc(Cl)c(F)cc1O 294185879 JZXPUCVCFPZVTO-UHFFFAOYSA-N 291.750 2.327 10 10 CECE CC(C)C1(NCC(=O)NCc2ccc(N(C)C)cc2)CC1 293165415 VXFMCXOTROTTDL-UHFFFAOYSA-N 289.423 2.147 10 10 CECE CC(=O)C(=O)COC(=O)/C=C(\C)c1ccccc1Cl 808513510 GUKIZCCVNDAQHL-VQHVLOKHSA-N 280.707 2.445 10 10 CECE Cc1cc(Br)cc([C@H](N)[C@@H](O)C2CC2)c1O 713772487 PMBUZZRLEFNSBJ-JQWIXIFHSA-N 286.169 2.234 10 10 CECE COc1ccc(CNC(=O)C2(C)C[C@@H]3C[C@H]3C2)c(O)c1 816550479 SBBWCAZMRJCEDC-RYUDHWBXSA-N 275.348 2.453 10 10 CECE OCc1ccc(N2C[C@@H]3C[C@H]2CO3)c(C(F)(F)F)c1 718277897 OZWOCFYRPZZEIT-UWVGGRQHSA-N 273.254 2.175 10 10 CECE CC(C)(C)OC(=O)N1CC(C2CN(CCCN=[N+]=[N-])C2)C1 1892838384 ADOBPHHJLVQTHO-UHFFFAOYSA-N 295.387 2.486 10 10 CECE NCCCC[C@@H](N)c1cc(Br)ccc1O 575438720 DEECDSWMXSDWDH-SNVBAGLBSA-N 273.174 2.284 10 10 CECE CN1[C@H]2CC[C@@H]1CN(c1ccc(CNC3CC3)cc1)C2 723927817 CKKRMCASBXBQAD-CALCHBBNSA-N 271.408 2.221 10 10 CECE C[C@H](CNC(=O)NCc1ccccc1O)CC(F)F 826035967 QQTYSSXQOVXOPZ-VIFPVBQESA-N 272.295 2.483 10 10 CECE CCc1cccc(CN[C@@H]2C[C@H](O)C23CCC3)c1O 827366495 WJBDMYXQMHPQNI-KGLIPLIRSA-N 261.365 2.348 10 10 CECE Cc1cc(Cl)cc(CN(C)C[C@@H]2COCCO2)c1O 827140537 LFASDSPVERHSSO-CYBMUJFWSA-N 285.771 2.201 10 10 CECE O=C(NCc1c(O)cccc1F)NC1CCCC1 902944780 MKMZGILQYDFYRQ-UHFFFAOYSA-N 252.289 2.273 10 10 CECE CN(C)c1ccc(/C=C\CNCCc2cnccn2)cc1 835043232 RGSMGYWAOPBIFM-ARJAWSKDSA-N 282.391 2.388 10 10 CECE CC(C)(CO)CCCNC(=O)/C=C\c1ccc(O)c(O)c1 588404936 TWGPLOQVVIRUAE-ALCCZGGFSA-N 293.363 2.026 10 10 CECE COC(=O)[C@@H]1CCN(C/C=C/c2ccc(N(C)C)cc2)C1 835026668 ZNQYMTYFASCBQE-MBVDDHJVSA-N 288.391 2.261 10 10 CECE CC(C)NC(=O)[C@H](C)NC/C=C\c1ccc(N(C)C)cc1 840974262 DAMJFILECDFOGU-AFNCTOJWSA-N 289.423 2.269 10 10 CECE Oc1ccc(F)cc1CN[C@H]1CCNC12CCCC2 843128380 KPIRPBBYUQZXBQ-AWEZNQCLSA-N 264.344 2.296 10 10 CECE CC[S@](=N)(=O)Cc1ccc(O)c(O)c1Br 1953082396 JUIKCEPLRUPXBY-HNNXBMFYSA-N 294.170 2.427 10 10 CECE Nc1ccc(NC(=O)CCN2CC[C@@H](C(F)F)C2)cc1 687839756 JDVPWBNQNYWPDP-SNVBAGLBSA-N 283.322 2.184 10 10 CECE CCN(C[C@H]1CCC2(CNC2)O1)c1ccc(OC)cc1 852745316 RATCXRPFFJRFLC-OAHLLOKOSA-N 276.380 2.043 10 10 CECE COc1ccc(N2CC[C@H](NC[C@H]3CCCOC3)C2)cc1 850346265 DLNTYRRGFKDSOW-CABCVRRESA-N 290.407 2.290 10 10 CECE COc1cccc([C@H](C)NCCOC2CCOCC2)c1O 927076639 KTOCDGHAYNNSLF-LBPRGKRZSA-N 295.379 2.247 10 10 CECE COc1cc(C)cc(CN2CCC(CN(C)C)CC2)c1O 754731459 DKECDLZWSKZFSL-UHFFFAOYSA-N 292.423 2.483 10 10 CECE CCN(CC)c1ccc(CNC[C@@H](O)CC(C)(C)O)cc1 872200933 NDIIXENWBOUXOU-INIZCTEOSA-N 294.439 2.144 10 10 CECE Cc1cccc(CN2CCSC[C@@H]2CCO)c1O 775736934 HBGBQQYOTVYQTP-ZDUSSCGKSA-N 267.394 2.000 10 10 CECE CC(C)(O)[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1 895478002 SIPLLVGOXQKCAI-SNVBAGLBSA-N 271.307 2.263 10 10 CECE NCc1ccc(N2CCC[C@H]2CCO)c(Br)c1 393878892 JUEVZQINOCBGDE-NSHDSACASA-N 299.212 2.259 10 10 CECE CCC[C@H](NCc1ccccc1O)C(=O)OCC 83385010 BHQNIBOTZNHXOQ-LBPRGKRZSA-N 251.326 2.214 10 10 CECE CCCNC(=O)[C@H](N)c1ccc(N(CC)CC)cc1 83460800 ZDTTZJYGUXYALN-CQSZACIVSA-N 263.385 2.059 10 10 CECE COc1ccc2c(c1O)[C@H](C1CCOCC1)NCC2 83708162 KWNBANQFQUNGKY-AWEZNQCLSA-N 263.337 2.014 10 10 CECE Cc1cc(N2CC[C@@H](CCN(C)C)C2)ccc1CO 700828564 BOMFXPAHFZKPQL-CQSZACIVSA-N 262.397 2.265 10 10 CECE OCC1(CNCc2ccccc2O)CC2(CCC2)C1 278564698 CXMLWFHFTBYCMR-UHFFFAOYSA-N 261.365 2.425 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)N1CCCC[C@@H]1C 80357819 UWIOZVYNXDRAII-NSHDSACASA-N 284.381 2.232 10 10 CECE CO[C@@H]1CN([C@@H](C)c2ccccc2O)[C@](C)(C(=O)O)C1 702729473 VVEBMFYKXJULAI-PGUXBMHVSA-N 279.336 2.017 10 10 CECE C[C@@H](CNCc1ccc(F)c(F)c1O)N1CCCC1 703327801 KGDIBVREBSEGGW-JTQLQIEISA-N 270.323 2.244 10 10 CECE 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262.269 2.042 10 10 CECE C[C@]1(C(=O)Nc2ccc(N)cc2)CC[C@@]1(C)C(=O)O 2225924962 JJBAPJPFQNYNPN-KGLIPLIRSA-N 262.309 2.098 10 10 CECE COc1ccc(N2CC(CO)(OC)C2)cc1C(C)C 2226830587 UHOWLJJQXFZGOR-UHFFFAOYSA-N 265.353 2.016 10 10 CECE COc1ccc(N(C)C[C@H]2OCC[C@@H]2F)c(C=O)c1 2227694366 HFJRSEOSQNOTEK-GXTWGEPZSA-N 267.300 2.071 10 10 CECE COc1ccc(N2CCC23CC(CF)C3)c(CN)c1 2227681807 DWIFBIMCFAKGSM-UHFFFAOYSA-N 264.344 2.482 10 10 CECE CC[C@@](C)(CN(C)c1ccc(OC)cc1CO)OC 2227710131 BUAVODBOBAYAQM-HNNXBMFYSA-N 267.369 2.439 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc(OC)cc1C=O 2227707348 VYFWPVCZRXIMEP-SMDDNHRTSA-N 263.337 2.105 10 10 CECE CNCc1cc(F)c(N2C[C@@H]3CC[C@@]3(OC)C2)c(F)c1 2239083520 HULFBEMTQOQJBZ-XHDPSFHLSA-N 282.334 2.299 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC(CCCO)C2)c1O 2239118627 QSVYKFPLBRBWQT-UHFFFAOYSA-N 297.782 2.453 10 10 CECE CN(C)c1ccc(CN2CCC=C[C@]2(C)C(=O)O)cc1 2239434159 VJCPTPOYPVOFGD-MRXNPFEDSA-N 274.364 2.358 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1CC(CCO)C1 2240000496 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CCNCCN(C)Cc1c(O)cccc1Br 1937740723 RYOFZGXDDIWYKN-UHFFFAOYSA-N 287.201 2.196 10 10 CECE C[C@H]1CN(Cc2c(O)ccc3ccccc23)C[C@@H]1N 235711706 WGRFWTOEVHHUFK-NHYWBVRUSA-N 256.349 2.324 10 10 CECE Nc1ccc(N2CC[C@@](N)(c3ccccc3)C2)cc1 1876349328 GDSQSWFILORALC-INIZCTEOSA-N 253.349 2.333 10 10 CECE Nc1ccc(CC(=O)N2[C@H]3CC[C@H]2CC(F)C3)cc1 1876894586 RTHSBQYNJNLGCF-KBPBESRZSA-N 262.328 2.303 10 10 CECE CCN(c1c(F)cc([C@H](C)O)cc1F)C1CN(C)C1 1880489849 ZXGRWUGWWTXMTE-VIFPVBQESA-N 270.323 2.158 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCO[C@H](CF)C2)c(F)c1 1880488467 VSDYBNCUVDEBPV-PSASIEDQSA-N 275.270 2.193 10 10 CECE CN1CCC[C@@H](CCNCc2ccc(F)cc2O)C1 1964568419 OKANIPTUWBFIAK-LBPRGKRZSA-N 266.360 2.353 10 10 CECE CC(C)(O)C1CC(NCc2ccc3c(c2)CCO3)C1 1965947475 XNILNUFZTBWDGM-UHFFFAOYSA-N 261.365 2.261 10 10 CECE Nc1ccc(NC(=O)[C@@H]2CC[C@@H]3[C@@H]2C3(F)F)cc1 1966815538 HDXGLXSMKLBSON-GMTAPVOTSA-N 252.264 2.499 10 10 CECE NC(=O)Nc1ccc(NCc2cccc(O)c2O)cc1 41117544 NRUPQFZHHXBEDM-UHFFFAOYSA-N 273.292 2.201 10 10 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NCc1ccccc1OC[C@@H](O)CSc1nccs1 402823390 QZWRVZHTSOSFOC-LLVKDONJSA-N 296.417 2.134 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)Cc2ccccc2O)C1 403586483 CCAPXOAQJKHFQS-LLVKDONJSA-N 260.297 2.236 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccc(O)c(O)c2)C1 403701402 UOTSFJXFSMAIHX-SECBINFHSA-N 262.269 2.013 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)COCc1ccccc1 404529273 BWUZRLCAKIKMSM-UHFFFAOYSA-N 284.359 2.444 10 10 CECE CO[C@@]1(C)CCN(c2ccc([C@@H](C)N)c(O)c2)C1 311167866 RIUGWSDQQPDHFA-YGRLFVJLSA-N 250.342 2.027 10 10 CECE CN(C)c1ccc(CNC2CCC(CO)CC2)cc1 311478971 KNWPPZISFUBDKX-UHFFFAOYSA-N 262.397 2.393 10 10 CECE CC(C)N(C)C[C@H](C)NCc1ccc2c(c1)CCN2C 312593347 DEKANXSSMYYJLH-AWEZNQCLSA-N 275.440 2.497 10 10 CECE COCCOC1CCN(c2ccc([C@@H](C)N)cc2)CC1 2158995598 URPSSWUJJUQFCZ-CYBMUJFWSA-N 278.396 2.338 10 10 CECE CCN1CCCN(C(=O)Nc2ccc(N)cc2)[C@@H](C)C1 320677034 KMACDWYFGABEJB-LBPRGKRZSA-N 276.384 2.217 10 10 CECE CN1CCCc2cc(CN[C@@H]3CCC[C@H]3O)ccc21 323835572 MZVYCICAGCEITQ-GDBMZVCRSA-N 260.381 2.072 10 10 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2.215 10 10 CECE COc1ccc(N2CC(F)(F)[C@@](C)(CN)C2)cc1C 2351665701 CPUIHUPLJLVYHE-ZDUSSCGKSA-N 270.323 2.424 10 10 CECE CSc1cc(N(C)Cc2nnc(C)o2)ccc1CN 2353855635 ODIFBTWQXIVCDD-UHFFFAOYSA-N 278.381 2.195 10 10 CECE CN1CCc2cc([C@H](N)[C@@]3(O)CCC[C@@H]4C[C@@H]43)ccc21 2354609347 BLNFGLWNHQQSSF-RNCIANSQSA-N 272.392 2.230 10 10 CECE CCN(CC)c1ccc([C@@H](O)C(C)(C)N)c(O)c1 1951404245 ZLMKMRWMHLFNOJ-CYBMUJFWSA-N 252.358 2.009 10 10 CECE C[C@@H]1CN([C@H](C)c2cc(F)ccc2O)C[C@@H]1C(=O)O 227805141 DZRHLGASUGSYKW-LNLATYFQSA-N 267.300 2.245 10 10 CECE C[C@H]1CN(CCCC(=O)Nc2ccc(N)cc2)C[C@H](C)O1 22153023 HUUPOEPUOLCQJV-STQMWFEESA-N 291.395 2.097 10 10 CECE COc1cccc(CNC(=O)N[C@H](C)C(C)C)c1O 173330226 LVVXERNMLPQWEL-SNVBAGLBSA-N 266.341 2.245 10 10 CECE Nc1cccc(Cl)c1N[C@H]1CN2CCC1CC2 20383782 OPEBRVNGWVXUFU-LBPRGKRZSA-N 251.761 2.428 10 10 CECE Nc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 63129734 ZUQLBZCBWYZHBU-UHFFFAOYSA-N 285.303 2.150 10 10 CECE N[C@H]1CCCN(c2ccc(OC[C@@H]3C[C@@H]3F)cc2F)C1 2356860636 JFFWXVSRFWDOOX-GVXVVHGQSA-N 282.334 2.490 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3[C@@H]4C=CC[C@H]3CC4)ccc21 2357022553 CGFDYDMOEVKZQN-ZETOZRRWSA-N 269.348 2.197 10 10 CECE CC1CCN(C(=O)[C@@H](C)Oc2ccc(N)cc2)CC1 41353944 OHFZSSXKBFVCPI-GFCCVEGCSA-N 262.353 2.295 10 10 CECE COCCNCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(C)c1 62734278 KLSHRRCYHRIXHP-GASCZTMLSA-N 292.423 2.345 10 10 CECE CCC(=O)c1cc(Br)c(O)c(CN)c1 34186649 YZOJKSABEYNBRH-UHFFFAOYSA-N 258.115 2.206 10 10 CECE COc1ccc(CN2C[C@H](C)O[C@H](C)C2)c(O)c1 126923133 UECZMWNNRLLBIG-PHIMTYICSA-N 251.326 2.010 10 10 CECE CCOc1cccc(CNN2CCCCC2)c1O 213977261 TYKLPDFTJDJYAG-UHFFFAOYSA-N 250.342 2.281 10 10 CECE CCO[C@@H]1CCCN(c2ccc(OC)cc2N)C1 213390093 QZIAVXIDHWEWFJ-GFCCVEGCSA-N 250.342 2.283 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1ccc(CCO)cc1 40737515 GJIABQOVEWSSCP-UHFFFAOYSA-N 259.305 2.327 10 10 CECE CC(=O)c1cnc(NC(=O)c2ccc(C)c(O)c2O)s1 182463608 FTVHAXOZYKZUTK-UHFFFAOYSA-N 292.316 2.318 10 10 CECE COc1ccc(CNC2CC2)cc1CSCCO 81798127 AAUBSHQJNYHZJU-UHFFFAOYSA-N 267.394 2.173 10 10 CECE CCC(CC)[C@H](O)CNCc1cccc(F)c1O 226609949 SNWXQZGAYFSBPZ-CYBMUJFWSA-N 255.333 2.418 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCc1ncn(C)n1 148741765 IGPDSZHAWVGTKQ-VXGBXAGGSA-N 286.379 2.210 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1ccsc1 90259381 WOXBPGVNAKYSBK-VIFPVBQESA-N 254.315 2.252 10 10 CECE COc1ccc2c(c1)[C@](NCCN=[N+]=[N-])(C(=O)O)CCC2 92387089 QDRWSQRRZSBHTK-AWEZNQCLSA-N 290.323 2.211 10 10 CECE CC[C@@H](O)[C@@H](N)c1c(F)ccc(Br)c1O 95804263 ZZXYKOYZTDLMJF-VXNVDRBHSA-N 278.121 2.065 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCOC[C@@H]1F 2130263004 FOZSVAMTRCDQNX-GJZGRUSLSA-N 265.328 2.233 10 10 CECE CO[C@@H]1CN(c2c(F)cc(CN)cc2F)CC[C@H]1C 299959611 WZFWVBQJKFTMHN-NOZJJQNGSA-N 270.323 2.285 10 10 CECE COC(=O)[C@@H](N[C@H](C)c1cc(OC)ccc1O)C1CC1 272963237 AYJNRQRCCPDSKZ-OTYXRUKQSA-N 279.336 2.003 10 10 CECE OC[C@@H]1CN(Cc2ccccc2)C[C@@H]1c1ccc(O)c(O)c1 382718889 MFTAUJNETXMWLN-JKSUJKDBSA-N 299.370 2.306 10 10 CECE CCOc1ccc(O)c(CN2CCn3cncc3C2)c1 291473186 FCPSFACNNIAUNK-UHFFFAOYSA-N 273.336 2.003 10 10 CECE CNC1C[C@@H]2CC[C@H](C1)N2Cc1c(O)cccc1F 1276354567 XPZOPKFJWHXKBY-YOGCLGLASA-N 264.344 2.246 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)C(C)(C)CN1 2162631840 RLPBOIXSYPNPBY-LBPRGKRZSA-N 276.380 2.425 10 10 CECE CP(C)(=O)[C@@H]1CCCN1C(=O)COc1ccc(N)cc1 2164506498 ICOMVDHGHHQUDY-CQSZACIVSA-N 296.307 2.219 10 10 CECE OC[C@@H](NCc1c(O)cccc1Cl)C(F)(F)F 1942832392 UMORLFNGSNLCSM-SECBINFHSA-N 269.650 2.058 10 10 CECE CN1CCC[C@@](O)(c2ccc3c(c2)CCCN3C)CC1 2163091040 CMCGBKOZNNJCKY-KRWDZBQOSA-N 274.408 2.372 10 10 CECE CN1CCCc2cc([C@](C)(O)c3ccnn3C)ccc21 2163094451 LPHRDFUVBLTPSJ-INIZCTEOSA-N 271.364 2.058 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)[C@@H](COC)OC 2163097333 NDLBNZXMXWKGQA-HZPDHXFCSA-N 278.396 2.209 10 10 CECE CN1CCCc2cc([C@H](O)[C@H]3CC=C[C@H](N)C3)ccc21 2163101131 YDIKPBVSUUXWAD-JLJPHGGASA-N 272.392 2.396 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)c1cnn(C)c1 2163109998 FBQTUEYWCHMDFH-MRXNPFEDSA-N 270.380 2.329 10 10 CECE Cc1coc([C@@H](O)[C@H](N)c2ccc3c(c2)CCN3C)c1 2163133750 PDNKMIWGSGGPFZ-HZPDHXFCSA-N 272.348 2.314 10 10 CECE CO[C@@H]1CC(N(C)c2ccc(CN)cc2C)C[C@H]1OC 2166102309 LTFURZJWBPCNKE-HZPDHXFCSA-N 278.396 2.082 10 10 CECE C[C@H](N)c1ccc(N2CC[C@]3(CNC(=O)C3)C2)c(Cl)c1 2163343086 RPFGOSRZZOYATM-BONVTDFDSA-N 293.798 2.076 10 10 CECE O=C(C1CC1)[C@H]1CN(Cc2c(O)cccc2Cl)CCO1 811501860 ANKCHQKZRSDHCR-CQSZACIVSA-N 295.766 2.226 10 10 CECE C[C@H](N[C@H]1CNCC[C@@H]1C)c1cc(F)cc(F)c1O 817968863 NWGKYYKKBWPDOQ-RVBZMBCESA-N 270.323 2.319 10 10 CECE Cc1ccc(F)c(O)c1[C@@H](C(F)F)N1CCOCC1 575301657 DCQYENZMRNZGGT-NSHDSACASA-N 275.270 2.478 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1[C@H]2CC[C@H]1CNC2 723866070 ZZXAKAVKNSFJOW-KCXAZCMYSA-N 259.397 2.250 10 10 CECE COCC1(CCNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 843961720 LFRPNWHFPTXZPD-HWKANZROSA-N 291.347 2.044 10 10 CECE COCC1(CCNC(=O)Nc2ccc(N)cc2)CC1 843043181 JBKUAJWCDXQUTG-UHFFFAOYSA-N 263.341 2.207 10 10 CECE FC1(F)CC12CN(Cc1ccc(N3CCOCC3)cc1)C2 848922651 WSEXYYINVLLAAJ-UHFFFAOYSA-N 294.345 2.364 10 10 CECE COC1(CO)CCN(Cc2c(O)cc(C)cc2Cl)CC1 840940629 INBOPTYRUGZOGX-UHFFFAOYSA-N 299.798 2.327 10 10 CECE Cc1ccc(C(=O)NC[C@@H](C)c2ccccn2)c(O)c1O 855176940 DONHKSJYDAETSA-LLVKDONJSA-N 286.331 2.335 10 10 CECE O=C(NCc1ccc(N2CCCCC2)cc1)c1cccnn1 858836431 XZDZUYKXFTYUHS-UHFFFAOYSA-N 296.374 2.397 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3[C@H]4CCC[C@H]3C4)ccc21 1899669893 SGUPSJKRCSMNGM-PKFCDNJMSA-N 257.337 2.030 10 10 CECE COc1ccc(N2CC[C@@H](NCc3c[nH]nc3C)C2)cc1 850345599 FSWBFRIHEMNTDC-CQSZACIVSA-N 286.379 2.095 10 10 CECE CCN(CC)C1CN(c2ccc(CNC)cc2F)C1 829314825 CQYBRKIHFAZGDO-UHFFFAOYSA-N 265.376 2.076 10 10 CECE Oc1cc(Br)ccc1CNCCCN1CCC1 691440524 RGLKHOMDIPIPTJ-UHFFFAOYSA-N 299.212 2.340 10 10 CECE CC[C@@H]1NCC[C@H]1N[C@H](C)c1ccc(F)cc1O 863542020 DJUWHNZCQOTFOF-JIMOISOXSA-N 252.333 2.322 10 10 CECE C[C@@H](N[C@@H]1CCCC[C@@H]1O)c1cc([N+](=O)[O-])ccc1O 866638576 IPKNBTBSRWOXOZ-IUPBHXKESA-N 280.324 2.255 10 10 CECE Cc1ccc(O)c(CNC(=O)Nc2nn(C)cc2C)c1 861216459 HRVHVNVOFWQENE-UHFFFAOYSA-N 274.324 2.064 10 10 CECE COc1cc(O)c(CN2C[C@H](C)O[C@@H](C)[C@H]2C)cc1OC 783545876 VAWRVJXROFMYDR-TUAOUCFPSA-N 295.379 2.407 10 10 CECE CCOc1ccc(O)c(CN(CCOC)[C@H]2CCOC2)c1 787334223 HCFUUNRNALQJNJ-AWEZNQCLSA-N 295.379 2.028 10 10 CECE CC[C@H]1CN(Cc2ccc(OC)cc2O)[C@@H](CC)CN1 83586841 NSTBLHHVARKCES-KBPBESRZSA-N 278.396 2.363 10 10 CECE COc1ccc([C@@H](N)c2nnc(C3CCC3)o2)c(O)c1 83543993 FYLSTAQPENSVLS-GFCCVEGCSA-N 275.308 2.099 10 10 CECE CCC[C@@H](C)[C@H]1NCCc2c1cc(O)c(O)c2O 83658215 ATPHIQNVYOKIRG-PRHODGIISA-N 251.326 2.426 10 10 CECE C[C@H]1CCN(CCC(=O)O)c2cc3c(cc21)OCO3 84801299 GXYMODJOFRBVEP-VIFPVBQESA-N 263.293 2.204 10 10 CECE CNCc1ccc(N(C)C[C@@H](C)CO)cc1Cl 688428225 YXMLUWYNKNHWQE-SNVBAGLBSA-N 256.777 2.124 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CC[C@H]4CC[C@@H](C3)S4)ccc21 707713043 CBLQSWFLBVAHQW-UHIISALHSA-N 289.404 2.113 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2O)[C@H]1CCCSCC1 709564788 WXHYPBFXGQQTQK-IINYFYTJSA-N 292.404 2.394 10 10 CECE CN[C@@H](C)c1ccc(N2CCCC[C@H]2C(N)=O)cc1Cl 689074643 CPDJXCDLQDIXTD-HZMBPMFUSA-N 295.814 2.465 10 10 CECE C[C@@H](C(=O)NCc1ccccc1O)[C@@H]1CCCCO1 711917057 YZKAHTUTRKCYIR-RISCZKNCSA-N 263.337 2.214 10 10 CECE CCCN(CC(=O)N(C)C)[C@H](C)c1cc(F)ccc1O 133665936 ROSWNAADVSTIMR-LLVKDONJSA-N 282.359 2.393 10 10 CECE Cc1cc(N2CC[C@@H]3COC[C@H]3C2)ccc1C[C@H](C)N 690356384 YSHWIFCASNQRAN-NUEKZKHPSA-N 274.408 2.357 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1cc(O)cc(O)c1 691688416 HSGIEUDQSMJYNG-SECBINFHSA-N 262.269 2.013 10 10 CECE C[C@H](O)c1ccc(N(C)CC2CN(C)C2)c(Cl)c1 692223772 ROVOXHNOMAMAHL-JTQLQIEISA-N 268.788 2.391 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)C2CCS(=O)(=O)CC2)c1 694188105 FWAZIOJTEHSLFK-GFCCVEGCSA-N 297.420 2.271 10 10 CECE C[C@H](CO)[C@@H]1CCCCN1c1ccc(CN)c(F)c1 696716713 ZOZRXCQUIWWLQE-ABAIWWIYSA-N 266.360 2.272 10 10 CECE CCc1cc(CN(C)c2ccc(CN)cc2)n(C)n1 89181705 SRKWMBAHPYWAFZ-UHFFFAOYSA-N 258.369 2.078 10 10 CECE CC[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ccc(C)cc1 90260482 FCBCXEILJNCFHZ-AWEZNQCLSA-N 275.356 2.376 10 10 CECE Cc1csc(COc2ccc(N3CCNCC3)cc2)n1 94965272 ZISWJRYTFDKTCA-UHFFFAOYSA-N 289.404 2.440 10 10 CECE COCC1CN(c2ccc([C@H](C)O)c(Cl)c2)C1 1916830538 JZJVZZVVULSTJF-VIFPVBQESA-N 255.745 2.476 10 10 CECE CN[C@H](C)c1ccc(N2CC[S@](=O)[C@@H](C)C2)c(F)c1 2115327547 BVGAPMBYFYYAQB-QQKBFRNYSA-N 284.400 2.063 10 10 CECE CN1CCc2cc([C@@H](O)C[C@@](C)(N)C(F)F)ccc21 2115441022 SVMXLLTXXDDDMM-GXTWGEPZSA-N 270.323 2.085 10 10 CECE Nc1ccc(CNc2ncc(C(=O)O)cc2F)cc1 2126871550 QPDCYPDHNHFTKJ-UHFFFAOYSA-N 261.256 2.113 10 10 CECE COC(=O)[C@@H]1C[C@H]1COCCCc1ccc(N)cc1 2122968048 BNBJYILUPKRCJE-GXTWGEPZSA-N 263.337 2.027 10 10 CECE CCN[C@@H](C)c1ccc(N2CC=CC[C@@H]2CO)cc1 2119817001 YDVSTWQZPFJAJK-XJKSGUPXSA-N 260.381 2.484 10 10 CECE CNCc1ccc(N2[C@H]3CCC[C@@H]2COC3)c(C)c1 1900774226 GUHMHDXURXJOAR-GASCZTMLSA-N 260.381 2.472 10 10 CECE CC(C)C1(O)CN(c2ccc3c(c2)CCC[C@H]3N)C1 2128278376 DASVSPUSWLHFNU-OAHLLOKOSA-N 260.381 2.230 10 10 CECE OCC[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128271556 DLYCILGCBJJZPV-MLGOLLRUSA-N 261.365 2.265 10 10 CECE CC(C)(C)[C@H]1C[C@H](NCc2ccc(O)c(O)c2)CO1 2129162423 QKXHLWHWBGNSOU-SMDDNHRTSA-N 265.353 2.391 10 10 CECE CCN(C)CCCN1CCc2cc([C@@H](C)N)ccc21 2129774766 XBCWZEQMRUTMPH-CYBMUJFWSA-N 261.413 2.411 10 10 CECE CN1CC[C@@H](N(C)c2ccc(C=CC(=O)O)cc2F)C1 1911825243 LQXWEUSXKOBIFH-GFCCVEGCSA-N 278.327 2.064 10 10 CECE C[C@@H](Oc1ccccc1F)C(=O)N(C)CCN=[N+]=[N-] 1912145995 OAVQMHWVXMBRTN-SECBINFHSA-N 266.276 2.362 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(=O)O)c1cccs1 1912188236 MUDJCNGZJXMJAI-SNVBAGLBSA-N 254.315 2.338 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1nc(C)c(C)s1 1912180651 DMAYSHLFOFYRAZ-SECBINFHSA-N 283.357 2.264 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(Cc2cn3ccccc3n2)C1 1912150857 ZFVVZLQYZJMPPR-LLVKDONJSA-N 256.313 2.467 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@H]2CCCOCC2)CC1 1912197320 RSABMACDUIJVDT-SNVBAGLBSA-N 252.318 2.104 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1ccc(Cl)s1 1912189459 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2.230 10 10 CECE CC(C)c1cc(C(=O)NCc2c(O)cccc2O)no1 1635847171 JGABXCJILDVGEG-UHFFFAOYSA-N 276.292 2.139 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cc(C=O)[nH]c2C)c1 1633283259 XTJFBOKSVWLTNS-UHFFFAOYSA-N 272.304 2.080 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccc(CF)cc1 1635847632 QNQUFMFYHBYLDJ-UHFFFAOYSA-N 275.279 2.497 10 10 CECE CC(C)c1ocnc1CNC(=O)c1ccc(O)c(O)c1 1926438784 ZXVKGPBSCGGJJB-UHFFFAOYSA-N 276.292 2.139 10 10 CECE COC[C@@](C)(CO)CN[C@@H](C)c1ccc(N(C)C)cc1 1926959957 PPPSCEWRSIVWHZ-XJKSGUPXSA-N 280.412 2.048 10 10 CECE CC(=O)C(=O)[C@H](O)c1cc(C)cc(Br)c1F 1927658745 FCNJZZAQYUSVNR-LLVKDONJSA-N 289.100 2.088 10 10 CECE Cc1ccc(CN[C@H]2C[C@H](c3ncc[nH]3)C2)c(O)c1 2139767992 UYNGCSPRDBRYNF-JOCQHMNTSA-N 257.337 2.460 10 10 CECE COc1cc(N(C)C[C@@H]2C[C@@H](C)CO2)ccc1CO 2139710082 FJJSQNDAMSTKPZ-RISCZKNCSA-N 265.353 2.049 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCN2CCCC(=O)NC 162179812 VQAYRFIGODDLBG-CYBMUJFWSA-N 289.423 2.246 10 10 CECE COc1ccc([C@@H](C)N[C@@H](C)CN(C)C)c(O)c1 168605732 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10 10 CECE CN1CCCc2cc(C3=C[C@H]4COC[C@@H](C3)N4)ccc21 2285833459 LLCQMCNUXXDHRN-JKSUJKDBSA-N 270.376 2.213 10 10 CECE O[C@H](c1ccccc1)c1ccc(N2CCNCC2)cc1 2286070530 AFJRLQGUQQQAPH-QGZVFWFLSA-N 268.360 2.178 10 10 CECE CC[C@@H](NCCc1ccc(O)c(O)c1)[C@H](C)CN(C)C 2288709957 RSNOBCSREWWOJH-TZMCWYRMSA-N 280.412 2.206 10 10 CECE Cc1ccc2c(n1)OCCN2C(=O)/C=C\c1cccnc1 492384066 DCSMQQBSFFYNGH-ALCCZGGFSA-N 281.315 2.224 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)CC(F)(F)C(F)F 2300531295 DKAYKZIUHLWXHV-UHFFFAOYSA-N 256.203 2.436 10 10 CECE CCN(CCN1CCCC1)Cc1cccc(OC)c1O 1203595839 QRWQHLSLIQSZBT-UHFFFAOYSA-N 278.396 2.319 10 10 CECE C[C@H]1CCNCCN1Cc1ccc2c(c1)CCCN2C 1205326452 ZMFWGLVFHLCZEC-AWEZNQCLSA-N 273.424 2.253 10 10 CECE CCCC[C@@H](COC)NC(=O)C=Cc1ccc(O)c(O)c1 2308001420 HCZQZVULTFINTF-ZDUSSCGKSA-N 293.363 2.432 10 10 CECE C[C@@H]1CCNCC[C@]1(Sc1nccs1)C(=O)O 2306960432 PVLAHLZUQUBOIE-LDYMZIIASA-N 272.395 2.078 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1cccc(F)c1N 2315993130 XGNLERNNPVCNEF-UHFFFAOYSA-N 251.265 2.180 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)c(F)c1 2325321340 CBAXHNANNOODBJ-HERUPUMHSA-N 251.301 2.184 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)cc1 2330782665 YTSCWLJKQDHTPK-RKLWJJNISA-N 260.381 2.317 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H]2[C@@H]1C[C@H]2C(=O)O 2334561107 CTLPKYGJYPLTHJ-SQNXGDPESA-N 261.321 2.248 10 10 CECE CC1(C)COC[C@@H]1CNCCCc1ccc(N)cc1 2336117001 GMUYNRMIGHIKID-AWEZNQCLSA-N 262.397 2.464 10 10 CECE COc1ccc(N2CC3(CC[C@H](CO)O3)C2)cc1Cl 2336728645 QKZSLIRJJCWXRK-LLVKDONJSA-N 283.755 2.079 10 10 CECE C[C@H]1COC[C@@H]1N(C)c1ccc(CN)c(C2CC2)c1 2339156270 UODGWXVCZVFBJJ-ZBEGNZNMSA-N 260.381 2.494 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1N(c1ccc3c(c1)CCCO3)C2 2339658913 MZVYVLAXQAOOLV-HFBAOOFYSA-N 259.349 2.361 10 10 CECE Cc1ccnc(COC(=O)Cc2ccc(N)cc2)c1 2343576922 WCHOJDHQBAQIJD-UHFFFAOYSA-N 256.305 2.258 10 10 CECE CC(C)[C@@H]1C[C@@H](O)CN1c1ccc([C@H](C)N)cc1F 2344614366 PRVLVGWAXUYKHX-NVBFEUDRSA-N 266.360 2.441 10 10 CECE O=C(NC[C@@]1(Cl)CC12CCC2)c1cccc(O)c1O 2351862084 LKQDDMYXNGRMMK-AWEZNQCLSA-N 281.739 2.379 10 10 CECE CSc1cc(N2CC[C@@H]3[C@@H](O)C[C@@H]3C2)ccc1CN 2353849638 VTWMEOXCLXWNTD-XBFCOCLRSA-N 278.421 2.074 10 10 CECE CSc1cc(N2C[C@H]3C[C@H]2CN(C)C3)ccc1CN 2353850110 CPDZVYDADSLLMN-FZMZJTMJSA-N 277.437 2.008 10 10 CECE C[C@@H](NC[C@]12COC[C@H]1C2(F)F)c1ccc(O)cc1O 2354587228 FQHSOEHZZYMOAV-WQHBLYJGSA-N 285.290 2.030 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]23C[C@H]4CC[C@H](N4)[C@@H]2C3)cc1 2354609072 UAQXDCFKBZLMPK-YYESSZKYSA-N 272.392 2.317 10 10 CECE N[C@@H]1C[C@H]2C[C@@H]1C[C@H]2NCc1ccc2c(c1)CCCO2 2354678010 QQXQWWUAVUCIMK-KLHDSHLOSA-N 272.392 2.227 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H]3C[C@@H]4C[C@@H]4CO3)ccc21 2355828885 VFHDQXZPSHQOCQ-HDEZJCGLSA-N 272.392 2.494 10 10 CECE CN1CCc2cc([C@](C)(N)C(=O)OC(C)(C)C)ccc21 1951678984 KFOXXTLXKJPWJZ-INIZCTEOSA-N 276.380 2.195 10 10 CECE CCN[C@@H](CCSc1nccs1)C(=O)OCC 62601611 DDARLENQMLPSMK-VIFPVBQESA-N 274.411 2.167 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H]3[C@H]4CC[C@H](O4)[C@@H]23)c1 2356932539 XELOBCOKWRNFKC-QVKMIARZSA-N 275.348 2.056 10 10 CECE Nc1ccc(OC[C@@H](O)CS[C@@H]2CCC[C@H](O)C2)cc1 2356997920 ZEIFQIHTVMOWEG-GZBFAFLISA-N 297.420 2.045 10 10 CECE O=C1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cccc(O)c1O 126166861 TWFJDQRLQAKIED-JQWIXIFHSA-N 289.331 2.072 10 10 CECE CC(C)(C)OC(=O)C(C)(C)[C@@H](N)c1c(O)cccc1O 1951862515 BULOKPYNSMNWRY-LBPRGKRZSA-N 281.352 2.466 10 10 CECE Cc1cc(NC(=O)/C=C\c2ccc(N(C)C)cc2)n[nH]1 211112049 MMWMJOXKGAOUJN-TWGQIWQCSA-N 270.336 2.436 10 10 CECE CC[C@@H](NC(C)(C)C(=O)OC)c1ccccc1O 37085358 BGIOFOZOTQHOCI-LLVKDONJSA-N 251.326 2.385 10 10 CECE CSCCCOC(=O)CCc1ccc(N)cc1 122409189 KLWNNIKJHZOFET-UHFFFAOYSA-N 253.367 2.498 10 10 CECE COc1ccc(N(C)CC(=O)c2ccn(C)c2)cc1 49970753 VIHRHWPPDFPMCM-UHFFFAOYSA-N 258.321 2.353 10 10 CECE C[C@@H]1CCC[C@H](OC[C@@H](O)CNCc2ccccc2O)C1 228414699 DRCCUFNGHQFMLV-KBMXLJTQSA-N 293.407 2.438 10 10 CECE CCN(CC)c1ccc(CNOCCOC)cc1 134048129 PXXRQXHTYZTHLP-UHFFFAOYSA-N 252.358 2.200 10 10 CECE CS[C@@H]1CCC[C@@H]1NCc1ccc(O)c(O)c1 226758287 RYEGYRFSDNDZPW-GXFFZTMASA-N 253.367 2.472 10 10 CECE CN(CCC(F)(F)F)c1ccc2c(c1)NC(=O)[C@H]2N 88422025 XODASFLMSVADMX-JTQLQIEISA-N 273.258 2.027 10 10 CECE CN1CCCc2cc([C@@H](CN)NCC3CC3)ccc21 87912322 DGQWBPKDKJFALV-OAHLLOKOSA-N 259.397 2.068 10 10 CECE C[C@@H](NC(=O)c1cc(O)nc(O)c1)[C@H]1C[C@H]2CC[C@H]1C2 243793883 QMIRSDYBVSLYMN-FYLLDIAZSA-N 276.336 2.047 10 10 CECE CN[C@H](c1ccccc1O)[C@@](O)(C(F)F)C1CCC1 1893006625 BPKYJWXEFRJPIY-TZMCWYRMSA-N 271.307 2.449 10 10 CECE COc1cc2c(cc1OC)N1CC(C)(C)OC[C@H]1CN2 2165818744 XJSLBCFNJAZFMC-SNVBAGLBSA-N 278.352 2.113 10 10 CECE CCN1CCc2cc([C@@H](O)c3ncc(C)n3C)ccc21 2163068737 LAWRXCHVNNNPIP-OAHLLOKOSA-N 271.364 2.193 10 10 CECE CN1CCc2cc([C@@H](N)C34CCN(CC3)CC4)ccc21 2163069222 PCHNLCRNSUFGJQ-MRXNPFEDSA-N 271.408 2.165 10 10 CECE CCc1nn(C)c(COc2cc(F)cnc2N)c1Cl 723427680 SNBFWBACZKDJEW-UHFFFAOYSA-N 284.722 2.331 10 10 CECE CCN(CC)c1ccc([C@H](NC)[C@H](C)S(C)(=O)=O)cc1 2163101709 DKOPRUHFMZQKTB-SWLSCSKDSA-N 298.452 2.226 10 10 CECE C[C@@H]1CNC[C@](O)(c2ccc(N3CCCCC3)cc2)C1 2163104893 HCOSVOWSAMNLHK-YOEHRIQHSA-N 274.408 2.494 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)[C@@]1(C)C[C@H]1C 2163143035 FMWQOGMZKFOIDX-JKEMJCCQSA-N 274.408 2.346 10 10 CECE CN(Cc1ccccc1O)C(=O)C1(CCN)CCCC1 2163180353 HYALAFQGLAQEFF-UHFFFAOYSA-N 276.380 2.260 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)[C@@H]2CC3(CC3)CO2)C1 2166461070 FMGLNYDSNCSKFT-NEPJUHHUSA-N 278.356 2.495 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)c1ccsc1 714354740 OCYRMBQHUZCKKY-UHFFFAOYSA-N 260.344 2.117 10 10 CECE Cc1cc(Br)c(O)c(CNc2cn(C)nn2)c1 812345858 SFBMJZYNIRVVJO-UHFFFAOYSA-N 297.156 2.204 10 10 CECE CCN(Cc1cn(C)nn1)Cc1cc(Cl)c(F)cc1O 816566894 KPIMHZFYVFZSKG-UHFFFAOYSA-N 298.749 2.335 10 10 CECE CCCN(CC(=O)NC)c1ccc([C@@H](C)N)c(Cl)c1 723180850 BTNJVEVFKKFZTP-SNVBAGLBSA-N 283.803 2.322 10 10 CECE CCOC(=O)[C@H](F)[C@H](N)c1cc(F)cc(Cl)c1O 725275310 SAJJOULRLLEORI-RKDXNWHRSA-N 279.670 2.086 10 10 CECE CNCc1ccc(N2CCC[C@@H]2C2(O)CC2)c(F)c1 2130496576 KBJZMODBEANHBE-CQSZACIVSA-N 264.344 2.039 10 10 CECE CCCN(CC(N)=O)c1ccc([C@H](CC)NCC)cc1 723168916 FFFARKNEBXYKMA-HNNXBMFYSA-N 277.412 2.449 10 10 CECE Cc1cccc(CN[C@@H](C)CN(C)CCCN(C)C)c1O 826903126 NVDRWHUQQQNGFD-HNNXBMFYSA-N 293.455 2.062 10 10 CECE O=C(c1cc(O)cs1)N1CCOC[C@H]1CC1CCC1 832927165 PZXVRRBAPPLAHD-LLVKDONJSA-N 281.377 2.485 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H]2CCCCN12 901055242 LBVBMYVLINBUME-CABCVRRESA-N 288.391 2.368 10 10 CECE CCCN(C/C=C\c1ccc(N(C)C)cc1)CCO 835025263 HDZQBTMJAFSCGS-WAYWQWQTSA-N 262.397 2.470 10 10 CECE Cc1cc(O)c(CN(C2CC2)[C@@H]2CCNC2)cc1C 843056366 ZTZBJGPBKQQNBD-OAHLLOKOSA-N 260.381 2.335 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@H]1CCC[C@H]2C[C@H]21 910944179 SWKRJYKBCKULLS-ZWKOPEQDSA-N 261.321 2.150 10 10 CECE C[C@H]1CN[C@H](C)CN1C/C=C\c1ccc(N(C)C)cc1 843119732 GDAPQARGVFIRII-JGUVHBTRSA-N 273.424 2.448 10 10 CECE O=[N+]([O-])c1cccc(O)c1[C@@H]1NCCCC1(F)F 1953018598 ZPTOFQXDXAAYPA-JTQLQIEISA-N 258.224 2.360 10 10 CECE Cc1cc(N(C)C)ccc1CN1CCNC[C@@H]1C(F)F 843124861 NQXWSJFCJNBYRY-CQSZACIVSA-N 283.366 2.100 10 10 CECE C[C@H]1COC[C@H]1NC(=O)c1cc2cc(O)c(O)cc2s1 928913458 ACPGTZXNHPTXQF-IONNQARKSA-N 293.344 2.077 10 10 CECE Cc1cc(O)c(CNCC2(C(=O)O)CCC2)cc1C 854244745 RGOITLGHRSLQMY-UHFFFAOYSA-N 263.337 2.354 10 10 CECE C[C@@H]1CC[C@@H](CCC(=O)NCc2c(O)cccc2F)O1 928705983 PXGZLCCQYRLQHB-MNOVXSKESA-N 281.327 2.495 10 10 CECE Cc1ccc(O)c(CNC(=O)[C@]2(C)C[C@H]3CC[C@H]2O3)c1 862756909 AEJFLUPXPGGQCY-XNRPHZJLSA-N 275.348 2.274 10 10 CECE COc1ccc2c(c1)CCCN2CN1CCOC1=S 766341745 ONTZTKAOGHXFEB-UHFFFAOYSA-N 278.377 2.022 10 10 CECE COc1cnc(F)c(CNCc2ccc3c(c2)CCO3)c1 876995211 BUQXMVGYZKVAAY-UHFFFAOYSA-N 288.322 2.454 10 10 CECE CCOc1cccc(CN[C@@H](C(=O)O)[C@H](C)CC)c1O 75436180 BGKARMSZGMDJAY-ZWNOBZJWSA-N 281.352 2.380 10 10 CECE COC1CCC(CNC(=O)c2ccc(C)c(O)c2O)CC1 780961290 QDWIJYDGUFSHNX-UHFFFAOYSA-N 293.363 2.341 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@@H]1CCN(C)C1 386892110 XXGCHBLPPIKSAC-CMPLNLGQSA-N 252.333 2.228 10 10 CECE O=C(NCc1ccccc1O)c1cn2ccnc2s1 785410042 RJOMLKRQLKWPPB-UHFFFAOYSA-N 273.317 2.031 10 10 CECE Oc1c(CN2CCC3(CC2)COCCO3)ccc(F)c1F 895700427 RFTDTICQDAMICD-UHFFFAOYSA-N 299.317 2.052 10 10 CECE Cc1cc(O)c([C@]2(C)COC(C)(C)CN2)c(C)c1N 83479681 WCIQIEJZQNKVRG-HNNXBMFYSA-N 264.369 2.205 10 10 CECE Oc1cc2c(c(O)c1O)CCN[C@@H]2c1ccc(F)cc1 83658179 PJOIUKGNHSVEDT-CYBMUJFWSA-N 275.279 2.178 10 10 CECE Oc1c(CN2C[C@H]3C[C@@]3(O)C2)ccc2ccccc12 895653043 KSXLPNMGHNEPAX-CZUORRHYSA-N 255.317 2.112 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H](CCF)C2)c(F)c1 700558016 YQMAPHLLYOXTTE-PWSUYJOCSA-N 270.323 2.410 10 10 CECE C[C@@H]1CC[C@@H](N(C)c2ccc3c(c2)NC(=O)[C@H]3O)CS1 689590162 YYFXWRSPSKUJLI-UDZFHETQSA-N 292.404 2.392 10 10 CECE COc1ccc(CNc2nc(C)cnc2C)c(O)c1 795285704 UVPPWIJUEFXRGW-UHFFFAOYSA-N 259.309 2.420 10 10 CECE CNCc1ccc(N(C)C[C@@H](COC)OC)c(Cl)c1 691354365 GYIZEGYTPPEMMS-LBPRGKRZSA-N 286.803 2.157 10 10 CECE COC[C@H](CN(C)c1ccc([C@@H](C)O)cc1Cl)OC 691378706 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290.367 2.330 10 10 CECE CC(C)CN(CCO)c1ccc(CO)c(Cl)c1 1948631191 YJNFGLOMUBFDKX-UHFFFAOYSA-N 257.761 2.287 10 10 CECE Cc1cc(N(CC(F)(F)F)C2COC2)ccc1CN 1886841741 VAFLTRIRFPDLED-UHFFFAOYSA-N 274.286 2.221 10 10 CECE Cc1cc(CN)ccc1N(C)[C@H]1[C@H]2[C@H]3[C@H]2C[C@@H]2[C@H]3[C@H]12 2143306825 GAAKOBFUAFANHM-VQTGRZPPSA-N 254.377 2.400 10 10 CECE C[C@H]1CCC[C@@H]1S(=O)(=O)NCc1ccccc1O 1965758473 KPCBSBJKUUMOHF-GWCFXTLKSA-N 269.366 2.000 10 10 CECE Cc1ccc([C@H](C)N2CC[C@H](C(=O)N(C)C)C2)c(O)c1 2143694480 KCKKXVUIWFYVAI-STQMWFEESA-N 276.380 2.172 10 10 CECE C[C@H](NCCN1C[C@@H]2C[C@H]2C1)c1ccc(F)cc1O 1967518109 XNXBUNUQXUXSSU-SRVKXCTJSA-N 264.344 2.134 10 10 CECE OC[C@@H](CC1CCOCC1)NCc1cc(Cl)ccc1O 1967737790 DJPUZPMGQFZSBM-CQSZACIVSA-N 299.798 2.313 10 10 CECE CCCOc1cc(N(C)C[C@@H]2CCN2)ccc1[N+](=O)[O-] 2143807363 YKJZTIAUQBDRSC-NSHDSACASA-N 279.340 2.182 10 10 CECE C[C@@H]1CN2CCCC[C@H]2CN1Cc1ccc(N)cc1 251904484 WRDJSVRYSPGTAK-CJNGLKHVSA-N 259.397 2.327 10 10 CECE Nc1ccc(OCc2cn(C3CC=CC3)nn2)cc1 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2.243 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@@H](O)C[C@@H]2C)c(F)c1 1880932426 UMZOIUZRZNABCE-NGZCFLSTSA-N 270.323 2.205 10 10 CECE CN(CC1(CCF)CC1)C(=O)Cc1ccc(N)cc1 1882416105 VSHMFIVMBNSOEF-UHFFFAOYSA-N 264.344 2.410 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H]2COCCO2)c(Cl)c1 2143689544 XUZNUHRXTBHVFS-YPMHNXCESA-N 298.814 2.472 10 10 CECE CO[C@@H]1CC[C@@H]2CN(c3ccc([C@H](C)N)c(O)c3)C[C@H]21 2144214321 ZAVGOFMLOGONJV-KYXHQGGESA-N 276.380 2.273 10 10 CECE CO[C@H]1CCN(Cc2c(O)cccc2F)C[C@@H]1C 1964598687 ZURXWCIIXDNKGP-HZMBPMFUSA-N 253.317 2.388 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc(CN)c(Br)c1 1950536839 RFTUCMOAJYCIEH-VHSXEESVSA-N 299.212 2.115 10 10 CECE COc1ccccc1NC[C@H](O)C[C@@H]1CCCO1 1964698009 HIPZLLVAUVCZAJ-NEPJUHHUSA-N 251.326 2.037 10 10 CECE COc1ccc([C@H](O)[C@@H](N)c2ccccc2O)cc1C 2148165615 TXDZRHHYCYTENW-HOTGVXAUSA-N 273.332 2.443 10 10 CECE CC(C)C[C@H](CNCc1cccc(O)c1O)N(C)C 41116705 KTXNRYHWKKFSFC-CYBMUJFWSA-N 266.385 2.164 10 10 CECE CCN1CC[C@@H](N(C)Cc2ccc(F)cc2O)C1 1969306709 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10 10 CECE CN1CCc2cc(CNCCOC3CCC3)ccc21 690700917 JUGKKLCSMXGDNR-UHFFFAOYSA-N 260.381 2.338 10 10 CECE NCc1ccc(N2C[C@H]3CCO[C@H]3C2)cc1C(F)(F)F 2172034435 GLOVHWONVIHHFV-MFKMUULPSA-N 286.297 2.389 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1cc(C)n(C)n1 2163075587 GAFAPMOJRHMSFG-INIZCTEOSA-N 272.396 2.493 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)[C@@H]1CC1(C)C 2163140629 LNIZVHQTGABNOX-NUEKZKHPSA-N 274.408 2.346 10 10 CECE CNCc1cc(F)c(N2CCC[C@@H](O)[C@H]2C)c(F)c1 384896543 VJQQBJMLHHGOIL-NOZJJQNGSA-N 270.323 2.034 10 10 CECE Nc1ccc(OCCNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1 717684715 FRYHZRVUVQWDJT-TYNCELHUSA-N 274.364 2.200 10 10 CECE CCN(CC)c1ccc([C@H](O)c2cnn(CC)n2)cc1 2172445788 GUPXDOZWNJORJA-HNNXBMFYSA-N 274.368 2.226 10 10 CECE CN(C[C@@H]1CCCCS1)c1ccc2c(c1)NC(=O)[C@@H]2O 718386410 JWNVAAUIHNTRQS-SMDDNHRTSA-N 292.404 2.394 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CC23CCCC3)cc1 387114024 JBDMOUSSJHNLFU-CQSZACIVSA-N 274.364 2.487 10 10 CECE CC(C)(O)[C@@H]1CCCN(c2ccc(CN)c(F)c2F)C1 719650867 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2.397 10 10 CECE C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1nccs1 181049204 PNYICDUJLYSVCG-SGRBOOSSSA-N 290.344 2.445 10 10 CECE Oc1c(F)cccc1CNCCCOCC1CC1 158680674 LDHPBPCFMAJFDW-UHFFFAOYSA-N 253.317 2.438 10 10 CECE CCN(c1ccc(N)cc1)[C@@H](C)C(=O)NCC(C)C 63114731 UABPGCQDOKXXDD-LBPRGKRZSA-N 263.385 2.256 10 10 CECE Cc1ccc(C(=O)NC[C@@](C)(O)CCC(C)C)c(O)c1O 182533359 XFRSRJCEOYRUIE-INIZCTEOSA-N 295.379 2.323 10 10 CECE CC(C)C[C@H](C)NC(=O)COc1ccc(N)cc1 40303084 WSUBSNJKOGQALT-NSHDSACASA-N 250.342 2.198 10 10 CECE CC[C@@](C)(O)CN[C@@H](C)c1ccc(OC)cc1O 87013099 LCFMSPXKOIGMMR-IINYFYTJSA-N 253.342 2.212 10 10 CECE Oc1c(F)cc(Br)cc1CN1CCC1 1235058221 ZHKGLVZGFVLSNV-UHFFFAOYSA-N 260.106 2.500 10 10 CECE COc1cc(N(C)CC2CC(OC)C2)ccc1CO 2139709938 DNQGWFQIKWPGQV-UHFFFAOYSA-N 265.353 2.049 10 10 CECE CCCN[C@](C)(CCO)c1ccc(N(C)C)cc1 87563600 XRTIHSLBZZVOPY-OAHLLOKOSA-N 250.386 2.350 10 10 CECE CCCNCc1ccc(N2CCn3cnnc3C2)c(C)c1 83923708 HWJLEBWULKFSHM-UHFFFAOYSA-N 285.395 2.106 10 10 CECE C[C@H](CC(F)(F)F)NCc1ccc(O)c(O)c1O 235454733 OKGFHYZDDDSBFI-ZCFIWIBFSA-N 265.231 2.234 10 10 CECE C[C@@H](CNCc1cc(Cl)ccc1O)CN(C)C 383910880 PHBPCGXRDASDFM-JTQLQIEISA-N 256.777 2.333 10 10 CECE CC[C@@H]1COCCN1Cc1cc(CNC)ccc1OC 50124946 RFARYGAUDVFOLN-OAHLLOKOSA-N 278.396 2.025 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H](C)c1ccccc1 90257034 ZHJLOTDMVQEIQT-JQWIXIFHSA-N 262.313 2.232 10 10 CECE CC(C)C1=N/C(=C/c2ccc(N(C)C)cc2)C(=O)N1 253440335 RXPMQHXUBDBYQO-UKTHLTGXSA-N 257.337 2.278 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N1CCOC[C@H]1C(=O)O 250989415 XKNJEWJSGDABCO-UTUOFQBUSA-N 291.347 2.034 10 10 CECE COc1c([N+](=O)[O-])ccc(CN(C)CC2CC2)c1O 278245013 OKRGKKLZHRDNMZ-UHFFFAOYSA-N 266.297 2.151 10 10 CECE Oc1ccccc1CNC[C@H]1CCC2(CCOCC2)[C@H]1O 282984409 ZVWRJXZTACDRNA-ZBFHGGJFSA-N 291.391 2.050 10 10 CECE Cc1cc(N(C)[C@H]2CCN(C)C2)ccc1/C=C/C(=O)O 383250387 DRPIEQGFEWMNKR-ZKKXHLJNSA-N 274.364 2.233 10 10 CECE CN(C[C@@H]1CCCCN1)c1ccc2c(c1)OCCCO2 2162619568 CPLQBUIMXRQTKW-ZDUSSCGKSA-N 276.380 2.426 10 10 CECE CCCOc1ccc(N2CCC[C@H](NCCO)C2)cc1 2162654203 YDMWKUPVPIYMRT-AWEZNQCLSA-N 278.396 2.026 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](C)c1ccc(Cl)s1 808523109 JJBSRVMAVNTAFJ-LURJTMIESA-N 274.725 2.206 10 10 CECE CCN1CCc2cc([C@H](O)[C@]34CC[C@H]3CNC4)ccc21 2163074969 XSLHCCKTEQXFSY-XIRDDKMYSA-N 272.392 2.102 10 10 CECE Cc1nn(C)c(C)c1C[C@@H](O)c1ccc(N(C)C)cc1 2163074559 UBJLNYQMRHLRGL-MRXNPFEDSA-N 273.380 2.379 10 10 CECE CCN1CCc2cc([C@H](N)C3CCN(C)CC3)ccc21 2163074204 PYKZLGBRWRRKFR-QGZVFWFLSA-N 273.424 2.411 10 10 CECE CCn1ccc([C@H](NC)c2ccc3c(c2)CCN3C)n1 2163144120 LKORITFFBHDLLU-MRXNPFEDSA-N 270.380 2.204 10 10 CECE Cc1cc(CN)ccc1N1C[C@@H](CO)[C@@H](C(F)(F)F)C1 2163291593 GMYMBEURYATUAH-RYUDHWBXSA-N 288.313 2.061 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1C[C@@H]1C(F)F 801185998 IUFUBVWROQALRV-JEZHCXPESA-N 285.290 2.046 10 10 CECE CC(C)NCc1ccc(N2CC(C[S@@](C)=O)C2)c(F)c1 2166649989 HWIPDWAISZEUKR-HXUWFJFHSA-N 298.427 2.138 10 10 CECE 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YHSYHJUFZROUSO-OLZOCXBDSA-N 262.397 2.483 10 10 CECE O=C(O)C[C@]12CC[C@@H]1CN(Cc1ccc(F)cc1O)C2 2207534005 VRVZLWZJKOMNNQ-ABAIWWIYSA-N 279.311 2.218 10 10 CECE CCN(c1ccc(CO)cc1F)[C@@H]1CCC[C@@H]1O 2217692943 GGELVSOGRGZCAH-KGLIPLIRSA-N 253.317 2.058 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@@H]2C2CC2)c(F)c1 2219608499 IWVRAXHCTXVODY-KGLIPLIRSA-N 251.301 2.184 10 10 CECE COc1ccc(N2CC[C@H]2CF)c(C[C@@H](C)N)c1 2220416497 ALRBCYUZVJNAPA-PWSUYJOCSA-N 252.333 2.133 10 10 CECE COc1ccnc(CNCc2cc(F)ccc2O)c1 2230825546 FYJVTXZBXBADPX-UHFFFAOYSA-N 262.284 2.225 10 10 CECE CCN(CC1CN(C)C1)c1ccc([C@@H](C)O)cc1C 2232099896 FHVREAAKHNAUSW-CYBMUJFWSA-N 262.397 2.436 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CC(F)(F)CO 2223982530 GNLJUKTVXOUBFP-SNVBAGLBSA-N 259.296 2.112 10 10 CECE COc1ccc(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])cc1O 2234167385 BQKYEIBFRXMJMS-UWVGGRQHSA-N 276.296 2.362 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H](C(=O)O)C2)CC1 2234173748 ZAFUTFFUZBZXHE-OUAUKWLOSA-N 280.328 2.179 10 10 CECE COc1cccc(O)c1CN1[C@H]2CCC[C@@H]1CN(C)C2 2234739301 LESYRXUVKZHAGJ-BETUJISGSA-N 276.380 2.069 10 10 CECE CN1CCc2cc(N3C[C@H](O)C4(CCCC4)C3)ccc21 2235122076 XMYTZFRTQSDRRZ-INIZCTEOSA-N 272.392 2.420 10 10 CECE Cc1ccc2c(n1)N[C@@H](Cc1ccc(O)c(O)c1)CN2 2235294425 AWIONZQDPRWFLG-NSHDSACASA-N 271.320 2.250 10 10 CECE COc1ccc(N2CCC[C@@H]3COC[C@H]32)c(C(=O)O)c1 2235958869 UUFTVGRSXJNANY-QMTHXVAHSA-N 277.320 2.009 10 10 CECE COc1cccc(CN(C)c2cncc(Cl)n2)c1O 2226327860 SHWGXNNBJILLEP-UHFFFAOYSA-N 279.727 2.481 10 10 CECE CCN1CCc2cc(N(C)CC3(CO)CC3)ccc21 2226663991 WHAUQGKXOCBAPX-UHFFFAOYSA-N 260.381 2.278 10 10 CECE COc1ccc(N2CCC[C@@](C)(CO)C2)cc1OC 2226802621 REINJJVXLDHIED-OAHLLOKOSA-N 265.353 2.303 10 10 CECE C[C@H]1[C@H](O)C[C@@H](C)CN1c1ccc2c(c1)CC[C@@H]2O 2227602984 JEXGNMJTNHGJTH-LZJQFABFSA-N 261.365 2.262 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@]2(C)CC(=O)O)c1 2237833989 PSYFYAXYVMEHSQ-ZUZCIYMTSA-N 279.336 2.401 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC=C[C@]1(C)C(=O)O 2239429188 GNMZGNDPHJWWFQ-ZUZCIYMTSA-N 277.320 2.264 10 10 CECE CCn1nncc1CN(C)c1ccc([C@H](C)N)cc1C 2240836077 GNLGWDLPFVENAJ-LBPRGKRZSA-N 273.384 2.263 10 10 CECE C[C@@H]1C[C@H](CC(=O)N(C)[C@H](C)c2ccccc2O)CN1 2285687135 MFPMOXXNCVWTAS-JHJVBQTASA-N 276.380 2.300 10 10 CECE CCCc1ncc(N)c(OCc2ccc(N)cc2)n1 2271104581 KPTNRZMPRJFPOT-UHFFFAOYSA-N 258.325 2.173 10 10 CECE COc1cccc(CNC[C@]2(C)CCC[C@H]2O)c1O 2271301865 PUYVKUXICKPCLK-HIFRSBDPSA-N 265.353 2.042 10 10 CECE COc1ccc(N2CCC=C[C@@]2(C)CO)c([N+](=O)[O-])c1 2279062918 BLAWFQNPAATADM-AWEZNQCLSA-N 278.308 2.121 10 10 CECE CSc1ncc(CNC(=O)C23CCC(CC2)CN3)s1 2269091375 WUQCIULPFOQWIL-UHFFFAOYSA-N 297.449 2.013 10 10 CECE CCN[C@@H](c1ccccc1O)[C@]1(O)CC2C[C@@H]3C1[C@@H]3C2 2279163242 SFWRQYLJRMIKHT-AHDPICDESA-N 273.376 2.450 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1COC2(CCC2)C1 2269335046 SOZSHOVJZIPBJI-QWRGUYRKSA-N 264.329 2.247 10 10 CECE Cc1cc(N2CC(O)(C(F)(F)F)C2)ccc1[C@@H](C)N 2269666635 MGMLRNXERSZFCK-SECBINFHSA-N 274.286 2.128 10 10 CECE Cc1cc(N2CC[C@@H]3OCCO[C@@H]3C2)ccc1[C@@H](C)O 2285163723 AFPMMSIBAVYKMX-UHOFOFEASA-N 277.364 2.042 10 10 CECE COC[C@]1(OC)CCN(c2ccc([C@@H](C)N)c(C)c2)C1 2285128415 AHRYOAUTTCSQEE-CJNGLKHVSA-N 278.396 2.256 10 10 CECE CCOC[C@@H]1CN(c2ccc([C@@H](C)O)c(C)c2)CCO1 2285149104 ODKLHHUHSVWADE-HIFRSBDPSA-N 279.380 2.290 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](OC)[C@H](OC)C2)cc1C 2285144071 OJSDJNUHWZMGGZ-DAXOMENPSA-N 278.396 2.125 10 10 CECE CN[C@H]1CCc2cc(N3C[C@@H]4C[C@H](C3)[C@@]4(C)O)ccc21 2286199091 HPYJDZCHYWGYHB-RMHZUWNSSA-N 272.392 2.100 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2CCC(F)(F)[C@@H]21 2315990389 ZECFPSDPWDODPY-YIZRAAEISA-N 258.272 2.437 10 10 CECE Cc1nn(C)cc1[C@](C)(Sc1nccs1)C(=O)O 2326903523 KDIUDBBOCSKXKD-NSHDSACASA-N 283.378 2.277 10 10 CECE CS[C@@H]1CC[C@@H]1N(C)C(=O)c1cccc(O)c1O 2328068887 BDHXBMOKSWRWCN-GXSJLCMTSA-N 267.350 2.064 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H]1CCC[C@H]1N 2329520180 VUTHNHLWBJPGIR-CYZMBNFOSA-N 262.353 2.039 10 10 CECE C[C@H]1C[C@@]2(CCN(c3ccc(CN)c(F)c3)C2)CO1 2335497680 DLHNKJRHPALKQK-XHDPSFHLSA-N 264.344 2.290 10 10 CECE COc1ccc(N2CC[C@@H]3CCCN[C@@H]3C2)c(F)c1 2336202975 CCTIHTGNMKRFAN-SMDDNHRTSA-N 264.344 2.413 10 10 CECE CC(C)(CNC(=O)COc1ccc(N)cc1)C(F)F 2336658924 SZVKOTVVHZGQOI-UHFFFAOYSA-N 272.295 2.055 10 10 CECE CNCc1ccc(N2CC=C[C@H](O)C2)cc1C1CC1 2339156862 BHFDMSDMXUWZCP-HNNXBMFYSA-N 258.365 2.021 10 10 CECE Cc1cc(CO)ccc1N1C[C@H]2C[C@@H]1C[C@H]2N(C)C 2340986851 FJETYLZEWJGRAA-IIAWOOMASA-N 260.381 2.016 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2O[C@H]3CC[C@H]2C3)CC1 2352539090 MZVASFPFTPADEV-USZNOCQGSA-N 264.329 2.245 10 10 CECE CSc1cc(N2CCCC[C@H](CO)C2)ccc1CN 2353857966 DHVHVAGCWATSSL-LBPRGKRZSA-N 280.437 2.466 10 10 CECE CSc1cc(N2C[C@@H]3CC[C@@H](O)[C@H]3C2)ccc1CN 2353859110 XIBYNBYIALYTPQ-FPMFFAJLSA-N 278.421 2.074 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CCC[C@@H]3CN)ccc21 2354608885 MXEDIJXYPHUQHB-BFYDXBDKSA-N 274.408 2.477 10 10 CECE NC(=O)c1cccc(N)c1N[C@H]1CC[C@@H]2[C@H](C1)C2(F)F 2354783989 QWHMBMCYEWQSFT-SFGNSQDASA-N 281.306 2.213 10 10 CECE CCNCc1ccc(N2CC(OC)C2)cc1Br 310191814 AIQTZUIGBUJYNG-UHFFFAOYSA-N 299.212 2.394 10 10 CECE COCCNCc1cc(Cl)c(O)c(Cl)c1O 76275700 YULKPDUQRCWQPK-UHFFFAOYSA-N 266.124 2.141 10 10 CECE CC[C@H](Nc1c(N)cccc1C(N)=O)c1nccs1 130416285 AMGVYENOMMDRCO-JTQLQIEISA-N 276.365 2.387 10 10 CECE Cc1nn([C@H](C)c2ccc(N(C)C)cc2)c(N)c1[N+](=O)[O-] 43670988 OUIDBHWMABEORD-SNVBAGLBSA-N 289.339 2.357 10 10 CECE CC[C@@H](C)[S@](=O)CCC(=O)Nc1ccc(N)cc1 40964391 GRACCSJGSDQWAC-MGNBDDOMSA-N 268.382 2.145 10 10 CECE CO[C@]1(C)CCN(c2ccc(CN)c(Cl)c2)C1 384061132 YDKIBGFIDCSQIT-CYBMUJFWSA-N 254.761 2.414 10 10 CECE C[C@H](N)[C@H](Sc1nccs1)c1cnn(C)c1 43238475 KIYOWEVGBZOUOS-CBAPKCEASA-N 254.384 2.057 10 10 CECE CCN([C@@H](C)c1ccc(O)cc1O)[C@H](C)CC(=O)O 86763349 BBLNGVUMJVETLA-ZJUUUORDSA-N 267.325 2.344 10 10 CECE C[C@@H](NC[C@H]1CCCOC1)c1c(O)cccc1O 235215551 MPEHOTUNQQNDOS-GHMZBOCLSA-N 251.326 2.175 10 10 CECE COC(=O)C(C)(C)N[C@@H](C)c1cc(F)ccc1O 94617417 XYYOUFJNOJPLSW-QMMMGPOBSA-N 255.289 2.134 10 10 CECE Cc1ccc(O)c(CNCC(C)(C)C(=O)N2CCCC2)c1 527812491 PXIYREWJGWIABU-UHFFFAOYSA-N 290.407 2.439 10 10 CECE CCN1CCN(c2ccc(/C=C\C(=O)O)cc2)C[C@H]1C 252419275 YSCNYMNCQRWUML-OYVUYXNMSA-N 274.364 2.315 10 10 CECE C[C@@H](N)c1c(F)cc(O)c(O)c1Br 258249840 AVALKPQMUWKTRB-GSVOUGTGSA-N 250.067 2.019 10 10 CECE C[C@@H](CCN)c1c(Br)cc(F)c(O)c1O 258603408 NOGTYOYUCSSIAW-YFKPBYRVSA-N 278.121 2.452 10 10 CECE Nc1cc(-c2ccc(Br)c(O)c2O)on1 258584045 UOPFBKSYTDBSDY-UHFFFAOYSA-N 271.070 2.098 10 10 CECE Nc1ccc(CCC(=O)OC[C@H]2CCCOC2)cc1 690528456 SONQRJOOSJJRCM-ZDUSSCGKSA-N 263.337 2.171 10 10 CECE CN(c1c(F)cc(/C=C\C(=O)O)cc1F)[C@@H]1CCOC1 382894824 LRXDZBFNQRFOJH-MXQLGCADSA-N 283.274 2.288 10 10 CECE CCCn1c(C(=O)OCC(=O)C(C)=O)cc2ccccc21 808540013 NXUBUYYNOGVEHO-UHFFFAOYSA-N 287.315 2.366 10 10 CECE CC[C@@](C)(C(=O)OC)[C@H](O)c1ccc2c(c1)CCN2C 2164710646 JRVNCBYCVNBCHS-GDBMZVCRSA-N 277.364 2.302 10 10 CECE Nc1ccc(O)c(CN2CCC[C@@H]3CC[C@H](O)C[C@H]32)c1 2167007779 FTQUCOWXRZFKHS-BYCMXARLSA-N 276.380 2.100 10 10 CECE CCN1CCc2cc([C@H](N)[C@]3(O)CC[C@H]4C[C@@H]43)ccc21 2163123342 KJVMFFUGLZLFFC-GQGQLFGLSA-N 272.392 2.230 10 10 CECE CN1CCc2cc([C@H](CC[C@@H]3CCCO3)NN)ccc21 2163142495 GDIZXODNHKVRIB-GJZGRUSLSA-N 275.396 2.143 10 10 CECE Cc1ocnc1[C@H](NN)c1ccc(N2CCCC2)cc1 2163144295 QNZSOKNUMFQRMA-OAHLLOKOSA-N 272.352 2.136 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)CC1(F)CCCC1 2165893016 WIEVOXCVLMCUDZ-UHFFFAOYSA-N 281.327 2.495 10 10 CECE C[C@@H]1[C@@H](CO)CCN1c1ccc(CNC2CC2)cc1F 395139605 GQKHUMGFTNENFV-DGCLKSJQSA-N 278.371 2.285 10 10 CECE C[C@@H](NCCCN)c1cc(Br)ccc1O 817938499 LSHJIGZJGXGYHT-MRVPVSSYSA-N 273.174 2.154 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])C[C@@H]2CCCC[C@@H]21 712472836 GUCQZZADLGXUIY-GMXVVIOVSA-N 266.345 2.398 10 10 CECE CCN(C(=O)/C=C/c1cnc(OC)nc1)c1cccnc1C 492970826 DVWNABJFBNRGIG-BQYQJAHWSA-N 298.346 2.255 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H](N)C(C)(C)C2)c1O 903551498 MSKLGGFPRLIGPE-ZDUSSCGKSA-N 296.798 2.417 10 10 CECE Oc1ccccc1CN(C[C@H]1CCCO1)C[C@H](O)C1CC1 838894866 KNQPFHMZSYEWHP-WBVHZDCISA-N 291.391 2.144 10 10 CECE CN(Cc1ccccc1O)C(=O)Cc1cn2c(n1)CCCC2 845792010 PJCKYLVIFZLOJU-UHFFFAOYSA-N 299.374 2.126 10 10 CECE Cc1cc(O)c(CNC[C@H]2CCCNC2)c(Cl)c1 841033159 NSHGDJJKIVOZHS-NSHDSACASA-N 268.788 2.443 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@@H]1CN(C)C[C@H]1C 756118325 LZZSEFVHJQLXAQ-CZUORRHYSA-N 261.413 2.101 10 10 CECE Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H](C)O2)c1 858614409 MCYVEGPBKCVGKG-OCCSQVGLSA-N 292.379 2.457 10 10 CECE COc1ccc(N2CC[C@H](N[C@H]3CCOC3(C)C)C2)cc1 850486060 DSJNMTXGUHHJID-BBRMVZONSA-N 290.407 2.431 10 10 CECE CO[C@H](C(=O)NCc1ccc(N(C)C)cc1)C1CCC1 854270721 QNEPJBWPKMSSOL-HNNXBMFYSA-N 276.380 2.184 10 10 CECE C[C@H](C(=O)NCc1ccccc1O)C1CCOCC1 756001811 IDNASLUQLZOVOX-NSHDSACASA-N 263.337 2.071 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)CCSC)C2)cc1 855229294 MFURMAHNLCRFMT-LBPRGKRZSA-N 294.420 2.143 10 10 CECE CC[C@@H](NC[C@H]1COCCN1C)c1ccc(C)cc1O 858522394 DQXVGGSSUCRXDC-DZGCQCFKSA-N 278.396 2.072 10 10 CECE C/C=C/CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 863533857 ZIHCESZPGOEBLZ-NSCUHMNNSA-N 294.738 2.386 10 10 CECE C[C@@H]1NCC[C@H]1N[C@H](C)c1cc(Cl)ccc1O 863545893 BACDUMUIQHAEEX-VDDIYKPWSA-N 254.761 2.447 10 10 CECE Oc1cccc2c1CN(C(=S)NCCc1cccnc1)C2 865258498 GGIGLVPXFRSFLK-UHFFFAOYSA-N 299.399 2.220 10 10 CECE Cc1ccc(O)c(CNC(=O)CCOCC2CC2)c1 862758196 SGALACSGBOYELI-UHFFFAOYSA-N 263.337 2.134 10 10 CECE COc1cc(O)c(CNCCOC(C)(C)C)cc1OC 776118628 SQEJPPPEFBTROG-UHFFFAOYSA-N 283.368 2.314 10 10 CECE CO[C@@]1(C)CCN(c2ccc(CN)c(F)c2F)C1 386155898 PSFIKESMUQBKMI-ZDUSSCGKSA-N 256.296 2.039 10 10 CECE CCOc1ccc2c(c1)N[C@H](CC)CN2CC(=O)O 76929826 ZBRPYIMZGRUHJL-SNVBAGLBSA-N 264.325 2.180 10 10 CECE O=C(O)c1cc(Sc2nccs2)nc(Cl)n1 386894245 NXGKWJURXGTTBV-UHFFFAOYSA-N 273.726 2.436 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)CCCC(=O)O 94622280 YQXDJBRGYPDBSK-VIFPVBQESA-N 255.289 2.389 10 10 CECE Oc1ccc([C@H]2NCCc3ccc(F)cc32)cc1O 83596019 KLXKSWFSTYSGFE-OAHLLOKOSA-N 259.280 2.472 10 10 CECE COc1ccc([C@H](N)c2nnc(CC(C)C)o2)c(O)c1 83580659 BMSWONBAHHDFDD-ZDUSSCGKSA-N 277.324 2.030 10 10 CECE Cc1ncccc1[C@H]1NCCc2cc(O)c(O)cc21 83724849 WPQQPWNRNAJZGV-OAHLLOKOSA-N 256.305 2.036 10 10 CECE CC(=O)c1ccc(O)c(CN2CC[C@@H](C)[C@@H](CO)C2)c1 700391940 GTVWAFGBVDHTSG-IAQYHMDHSA-N 277.364 2.045 10 10 CECE CC1(C)CCCN(C(=O)COc2ccc(N)cc2)C1 70257713 JYFINROSKJKEJG-UHFFFAOYSA-N 262.353 2.296 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)C[C@H]2C)c(F)c1 705988806 SUBMXPMGLGMXOK-CKYFFXLPSA-N 252.333 2.195 10 10 CECE O=Cc1ccc(F)c(C(=O)NCc2ccccc2O)c1 1137471527 PESNKKYOCUXRIH-UHFFFAOYSA-N 273.263 2.274 10 10 CECE CCC[C@@]1(O)CCCN(CCc2ccc(N)cc2)C1 710194200 XPXPOHDSRBNJEH-MRXNPFEDSA-N 262.397 2.438 10 10 CECE COc1ccc(N2CCCC[C@H]2[C@H](C)N)c([N+](=O)[O-])c1 63196874 WSFXDHYPZVRVAH-JQWIXIFHSA-N 279.340 2.310 10 10 CECE O=[N+]([O-])c1cc(O)ccc1NS(=O)(=O)c1ccccc1 81571147 SHNNCMMAEJVABU-UHFFFAOYSA-N 294.288 2.101 10 10 CECE CN(Cc1c(O)ccc(Cl)c1F)[C@H]1CCOC1 792167657 NWFVTDSFSRAJBC-QMMMGPOBSA-N 259.708 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Cc1cc(C)cc(NC(=O)CN2C(=O)CSC2=S)c1 82322922 QDKVQQVSMSBVCT-UHFFFAOYSA-N 294.401 2.102 10 10 CECE COc1ccc(Br)c(C(=O)NCCN=[N+]=[N-])c1 42012578 RWKKFDVVDQXSNY-UHFFFAOYSA-N 299.128 2.498 10 10 CECE CO[C@@H]1C[C@@H](NCc2ccc(O)cc2O)C1(C)C 227831725 VBXTUCHKXRXMBA-CHWSQXEVSA-N 251.326 2.001 10 10 CECE O=C1N[C@@H](c2ccc(Br)c(F)c2O)CO1 95718774 HKCLGMACSWRSQX-ZCFIWIBFSA-N 276.061 2.075 10 10 CECE Cc1cc(N2CC[C@H]3CC[C@@H](C2)N3C)ccc1CN 92002232 VTVXXPVKRGDKCQ-ZBFHGGJFSA-N 259.397 2.127 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@H](C(=O)O)C1 94622177 JJOALSAOMREDHF-ZJUUUORDSA-N 267.300 2.389 10 10 CECE CN(Cc1ccc(N)cc1)Cc1ccn(C2CC2)n1 2130252868 FCXFWHAIRKELPR-UHFFFAOYSA-N 256.353 2.432 10 10 CECE O=C(O)CCCc1c(O)c(O)cc(Br)c1F 258687249 XSUIKHSDHFBGMZ-UHFFFAOYSA-N 293.088 2.407 10 10 CECE Cc1cccc(CNC[C@@H](O)Cc2ccccc2)c1O 289894635 TWXCHVZZUIVEHA-INIZCTEOSA-N 271.360 2.394 10 10 CECE C[C@@H]1Cc2ccccc2N(Cc2ncoc2CCN)C1 2164506588 HACGQUIRZDINJD-GFCCVEGCSA-N 271.364 2.375 10 10 CECE FC1(F)Oc2ccc(N3CC[C@H]4CC[C@@H](C3)N4)cc2O1 2162623737 QXMBCNPBYWMEKA-ZJUUUORDSA-N 282.290 2.339 10 10 CECE CC[C@@H](COC)N(C)c1ccc(CNCCOC)cc1 2165982215 IBJYNJFFCUUIAA-HNNXBMFYSA-N 280.412 2.284 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H](C)[C@H](CO)C2)cc1 709476561 NHBVINYIBIPSJQ-IVMMDQJWSA-N 262.397 2.422 10 10 CECE CCN1CCc2cc([C@](C)(O)C[C@@H]3CCCN3)ccc21 2163065953 GOWSQGNPRSNJFC-DOTOQJQBSA-N 274.408 2.419 10 10 CECE CCN1CCc2cc([C@H](O)[C@@]3(CC)CCNC3)ccc21 2163067415 WSALOODYNIXAQD-IRXDYDNUSA-N 274.408 2.492 10 10 CECE CC[C@@H]1CCN[C@@H]1[C@@H](O)c1ccc2c(c1)CCN2CC 2163073295 HTKQOKYVZAGMKM-DQYPLSBCSA-N 274.408 2.491 10 10 CECE CCN1CCc2cc([C@@]3(O)CCN(C)[C@H](C)C3)ccc21 2163079176 NAYPJDLVWVSTGH-CXAGYDPISA-N 274.408 2.371 10 10 CECE COC[C@]1([C@H](O)c2ccc(N(C)C)cc2)CCCCO1 2163078095 GMZJTGXRTCNVEA-CVEARBPZSA-N 279.380 2.372 10 10 CECE CCN[C@H](CS(C)(=O)=O)c1ccc(N(CC)CC)cc1 2163101416 AXDYZMAEPLPPHH-OAHLLOKOSA-N 298.452 2.228 10 10 CECE CN(C)c1ccc([C@@H](NN)C(C)(C)[C@@H]2CCCO2)cc1 2163103699 WVDSJZMUJNSGRB-LSDHHAIUSA-N 277.412 2.462 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2C[C@@H](C)CO2)cc1 2163158099 LPQLOMLPJONOQL-KCXAZCMYSA-N 277.412 2.462 10 10 CECE CCOc1cccc(CN2CC[C@H](CN)C2(C)C)c1O 2163180901 KCQOZLYTTCAFIE-CYBMUJFWSA-N 278.396 2.350 10 10 CECE C[C@H]1CC[C@H](CO)N(CCCOc2ccc(N)cc2)C1 2166922311 VDTXQYJAJKJPSO-DZGCQCFKSA-N 278.396 2.131 10 10 CECE N[C@H](c1ccccc1O)[C@]1(O)CCc2ccc(F)cc21 2163707899 WILPKQOGZTVIIL-CVEARBPZSA-N 273.307 2.365 10 10 CECE CNCc1ccc(N2C[C@H](OC)C[C@@H](OC)C2)cc1Cl 2165508288 WOMPEYQUIYFKNT-ZIAGYGMSSA-N 298.814 2.300 10 10 CECE CCOc1ccc(O)c(CN[C@@](C)(CO)C(C)C)c1 810173029 VKWGMFBCVWFOAV-HNNXBMFYSA-N 267.369 2.288 10 10 CECE Cc1cncc(/C=C/C(=O)N2CCOc3ccncc32)c1 132465097 UKJIAJOZJRPDMJ-NSCUHMNNSA-N 281.315 2.224 10 10 CECE CSc1ncc(CN[C@H](CN)C(C)(C)C)s1 2243832039 GZUSYEFJKLTVMX-SECBINFHSA-N 259.444 2.328 10 10 CECE CCCC[C@H](NC(=N)N)c1cc([N+](=O)[O-])ccc1O 575245864 BIMGGNSAFVEBQN-JTQLQIEISA-N 266.301 2.015 10 10 CECE Cc1cccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)n1 588404032 XKLYFECJZCRQOU-VURMDHGXSA-N 284.315 2.131 10 10 CECE COc1ccc2c(c1)CCN2C[C@@H]1CCN[C@H](C)C1 841003099 NKLCPRWZXTVCEW-CHWSQXEVSA-N 260.381 2.446 10 10 CECE CN(C)c1ccc(/C=C\CN[C@@H]2CC[C@@H](CN)C2)cc1 841084773 PJKDHFSQXVKJCJ-JGPFYOFESA-N 273.424 2.483 10 10 CECE CCOC(=O)[C@@H]1CCN[C@@H]1c1cc(C)c(C)cc1O 1953065723 ZFQUUDMTLXARPG-RISCZKNCSA-N 263.337 2.223 10 10 CECE Cc1cc(O)c(CNCC[C@]2(O)CCCOC2)c(Cl)c1 846106286 DSSQDNFQUGCMII-OAHLLOKOSA-N 299.798 2.375 10 10 CECE COc1ccc(N(C)CCc2nnc(C)o2)cc1OC 929348815 VUPAZAMDDDZKAS-UHFFFAOYSA-N 277.324 2.074 10 10 CECE CC[C@@H](NC[C@H](O)c1ccnn1C)c1ccc(C)cc1O 927125572 AEFLQSGFOYWOGQ-CJNGLKHVSA-N 289.379 2.208 10 10 CECE CN(CCCN)c1ccc(CNC(=O)OC(C)(C)C)cc1 1955924022 FSCYXPNXJYYJDU-UHFFFAOYSA-N 293.411 2.496 10 10 CECE Cc1cc(Cl)cc(CN2C[C@H]3COC[C@H]3C2)c1O 872266163 ALQMWJRSNAVHPP-TXEJJXNPSA-N 267.756 2.432 10 10 CECE CC(C)CN(CC(=O)O)c1ccc2c(c1)OCCO2 76681008 QMBOHUDBDUESPE-UHFFFAOYSA-N 265.309 2.005 10 10 CECE CC[C@@]1(C)CN(CCN)c2cc(OC)c(OC)cc2N1 76930861 YOOAJJLDUXZEKK-HNNXBMFYSA-N 279.384 2.063 10 10 CECE CC1(C)CN(Cc2cc(F)cc(F)c2O)[C@@H]2COC[C@H]2O1 895150243 IQGFBQCPVFAETR-CHWSQXEVSA-N 299.317 2.049 10 10 CECE CN[C@]1(CO)CCC[C@@H]1CCSc1nccs1 93623207 MJBIUTSDGBRWFH-PWSUYJOCSA-N 272.439 2.376 10 10 CECE CCN(C)c1ccc([C@H](C)NCc2cn(C)nn2)cc1 783530974 AFCGNPGIJQBPAV-LBPRGKRZSA-N 273.384 2.122 10 10 CECE COC(=O)c1ccnc(NCc2ccccc2O)c1 83429921 DBMFNVKNHVPNFC-UHFFFAOYSA-N 258.277 2.186 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(F)cnc1Cl 701316531 LEEMFXAFQQXFBY-UHFFFAOYSA-N 257.656 2.304 10 10 CECE Oc1c(CNCC(O)(C2CC2)C2CC2)ccc(F)c1F 703340950 LZCREZFRMQDYNH-UHFFFAOYSA-N 283.318 2.311 10 10 CECE C[C@H]1CCCCCN1C(=O)COc1ccc(N)cc1 70407710 GYHWBLBMPBECNL-LBPRGKRZSA-N 262.353 2.439 10 10 CECE C[C@H](N)c1ccc(N2CC(N(C)C)C2)cc1C(F)(F)F 705551432 DXWRNPFNVOITMZ-VIFPVBQESA-N 287.329 2.475 10 10 CECE CCCNC(=O)CN(C)c1ccc([C@@H](C)NC)cc1F 707676673 MLMPWJRRLYAOHJ-LLVKDONJSA-N 281.375 2.069 10 10 CECE CC[C@@H](NCc1cc(C(N)=O)co1)c1ccc(F)cc1O 796954875 RAVVNWPVEVAEKF-CYBMUJFWSA-N 292.310 2.464 10 10 CECE CN(c1ccc(CN)cc1Br)[C@@H]1CCC[C@H]1O 709398767 IORRREHRCYVWDI-CHWSQXEVSA-N 299.212 2.257 10 10 CECE CN[C@H](C)c1ccc(N2CCNC(=O)C2(C)C)cc1Cl 78928211 ROOOBDVKDWHYEB-SNVBAGLBSA-N 295.814 2.335 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CC1CC(N)C1 718103955 ODBLKTNGBFSACO-VOMCLLRMSA-N 262.353 2.039 10 10 CECE Cc1ccnc(Cn2ccc3ccc(CCN)cc32)n1 692607943 VKHAVIOVRJVOLC-UHFFFAOYSA-N 266.348 2.289 10 10 CECE Nc1ccc2c(ccn2CC2CCS(=O)(=O)CC2)c1 693359712 MCRQLIURAPPOOY-UHFFFAOYSA-N 278.377 2.048 10 10 CECE COc1cccc(CN[C@H]2C[C@@H](O)CC(C)(C)C2)c1O 693847797 LPKBJWMGJJPYJW-QWHCGFSZSA-N 279.380 2.430 10 10 CECE COc1cccc(CN2CCC[C@](C)(C(=O)O)C2)c1O 86783128 IELWAQCEOWRMMK-HNNXBMFYSA-N 279.336 2.088 10 10 CECE CCN[C@@H](C)c1ccc(N2CCN(CC)CC2)cc1O 93670207 HSVLBXCBBXPPOA-ZDUSSCGKSA-N 277.412 2.205 10 10 CECE CN(C)c1ccc(-c2nc3ccc(N)nc3[nH]2)cc1 94264557 VGSFDTZLWPKOEB-UHFFFAOYSA-N 253.309 2.273 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F 1153885366 MPMMTFDNSIKOJX-FXAINCCUSA-N 297.301 2.395 10 10 CECE CO[C@@H]1C[C@H]2[C@@H]1CCN2c1ccc([C@@H](C)N)cc1F 2121832006 ODQGLTRBQUGLND-PBUVFVDJSA-N 264.344 2.459 10 10 CECE Nc1ccc(CNCC2(O)CCC(F)(F)CC2)cc1 2123034118 ZDIKJMGVGGTDKS-UHFFFAOYSA-N 270.323 2.299 10 10 CECE Nc1cccc(NCc2ccccc2O)c1[N+](=O)[O-] 2117083848 FYGXIWLVOSANFD-UHFFFAOYSA-N 259.265 2.495 10 10 CECE COC[C@@H]1CN(c2ccc([C@H](C)N)c(O)c2)C[C@H]1C 2118626832 PVDVHCYSRDXOPO-WOPDTQHZSA-N 264.369 2.131 10 10 CECE Cc1cccc(O)c1CN(C[C@H](C)C(=O)O)C1CC1 2131184602 LSQBXJLSFFVTRW-NSHDSACASA-N 263.337 2.386 10 10 CECE CN1CC[C@@H](N(C)c2ccc3c(c2)CCC[C@H]3N)C1 2128270065 ZSDICPLQDPIRCC-GDBMZVCRSA-N 259.397 2.163 10 10 CECE C[C@]1(CO)CCCN(c2ccc3c(c2)CC[C@H]3N)C1 2128316067 ZZHOXJAOVRUBFE-CVEARBPZSA-N 260.381 2.231 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H](O)C34CCC4)ccc21 2128319915 ZBIQKHVXHFBSQT-LSDHHAIUSA-N 259.349 2.160 10 10 CECE CN1C[C@H](NCc2c(O)cccc2Cl)CCCC1=O 2131976376 OAYJDUTXVRCODB-SNVBAGLBSA-N 282.771 2.146 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CC(=O)N(C)C2)cc1Cl 2131955254 LPVNZNBJQSGGHS-GXSJLCMTSA-N 282.771 2.060 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(CCO[C@@H]2CCOC2)C1 1912152632 WQFZKJXHNUIBPK-QWHCGFSZSA-N 268.361 2.204 10 10 CECE C[C@H]1CCCN(C(=O)CN2CCC[C@@H](CN=[N+]=[N-])C2)C1 1912180546 CECKJASPNIZAIM-STQMWFEESA-N 279.388 2.267 10 10 CECE CCOC(=O)CCCCCN1CC[C@H](N=[N+]=[N-])C1 1912204500 XBHYAAZEDWXESI-NSHDSACASA-N 254.334 2.495 10 10 CECE CCn1ccnc1CN(C)c1ccc([C@H](C)N)c(O)c1 1913365893 SJPBRMGKMFLUOG-NSHDSACASA-N 274.368 2.265 10 10 CECE COC[C@@H]1C[C@@H]1CN(C)c1ccc2c(c1)CC[C@H]2N 2133436675 IKGDAPOHISNXHS-DVOMOZLQSA-N 260.381 2.351 10 10 CECE COc1ccc(CN2CC(C)(C)C[C@@H]2C(=O)O)c(O)c1 1912571141 MCTZYGQWULMFJA-GFCCVEGCSA-N 279.336 2.086 10 10 CECE Cc1cccc(O)c1CN1C[C@@H](O)CC2(CCOCC2)C1 1353606181 ZSSAWUDBVCWTBS-AWEZNQCLSA-N 291.391 2.064 10 10 CECE COc1cccc(O)c1CNC[C@H]1C2C[C@@H]3C1[C@@H]3C2 2134360807 NCPKHOYXKVPOSV-RLKDASMCSA-N 259.349 2.392 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H](O)[C@H]2C)c(F)c1 1914236874 RXMSHLCHQVANAR-IAQYHMDHSA-N 266.360 2.283 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)C[C@@H](O)COC)cc1 220250157 CJYLMFDXBWBTOJ-XJKSGUPXSA-N 280.412 2.191 10 10 CECE CN(c1ccc(CNC2CC2)cc1)C1(CO)CCC1 1914985486 UEURYVFTHAXIFG-UHFFFAOYSA-N 260.381 2.290 10 10 CECE CC(C)(C)[C@H]1C[C@H](S(=O)(=O)NCCN=[N+]=[N-])C1 2217208866 AWBUEZGCAVCWNU-KYZUINATSA-N 260.363 2.041 10 10 CECE CC(=O)N[C@H](C)CN=NNc1cc([N+](=O)[O-])ccc1C 1860492380 QGECBXGXYDFQOW-SECBINFHSA-N 279.300 2.207 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC[C@@H]2C(F)(F)F)cc1 1916187480 UPUYYWSAUPDDDC-CHWSQXEVSA-N 287.329 2.389 10 10 CECE Cc1ncc(/C=C\C(=O)NCc2cccc(O)c2O)s1 1455313484 BMKQNJRGOSUOIL-WAYWQWQTSA-N 290.344 2.192 10 10 CECE COC[C@@H]1CC[C@@H](NCc2cccc(O)c2O)C1 1918651656 GKPYZACCFQUKSA-ZYHUDNBSSA-N 251.326 2.003 10 10 CECE OC[C@H]1CC[C@H](CNCc2cccc(F)c2O)CC1 1922212334 MFSZRYQCKWISAR-HAQNSBGRSA-N 267.344 2.420 10 10 CECE CCOc1cccc(CNCC2(O)CCSCC2)c1O 119415803 GJSGLIGVSFCKTK-UHFFFAOYSA-N 297.420 2.139 10 10 CECE CSc1ccc(C(=O)NCc2cccc(O)c2O)o1 1633507353 GIRCDTPQPFAFTR-UHFFFAOYSA-N 279.317 2.343 10 10 CECE O=[N+]([O-])c1ccc(N2CC3(CC=CC3)C2)cc1CO 1925237598 TZTNECATYOUOSN-UHFFFAOYSA-N 260.293 2.244 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)OCC1CC1 1634938736 HQKBAMAEWGBGLS-NSHDSACASA-N 298.379 2.309 10 10 CECE CCC[C@H](CO)[C@](C)(N)c1ccc(N(C)C)cc1 1927409002 USKKTXBSPCGKNK-UKRRQHHQSA-N 250.386 2.335 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccccc1F 1647178915 YEVYTXRNZXNRCF-UHFFFAOYSA-N 261.252 2.167 10 10 CECE Cc1ccc(CN2[C@H]3CC[C@H]2CC(CN)C3)c(O)c1 2139770987 RBZCLMWYUBZLLB-GJZGRUSLSA-N 260.381 2.402 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCCN2C[C@@H](C)C(N)=O 162269929 GNRWQOFTIUXPKD-CHWSQXEVSA-N 289.423 2.231 10 10 CECE Cc1ccc(O)c([C@H](C)NCCC[S@](C)=O)c1 168780333 FIAOKSJAIRAMTB-APPDUMDISA-N 255.383 2.120 10 10 CECE CC1(C)[C@H](CO)CCN1c1ccc2c(c1)OCCO2 259234104 DMGNGBDRKUMIFI-NSHDSACASA-N 263.337 2.055 10 10 CECE COc1ccc(N2CCC[C@H]2CCO)c(OC)c1 259367572 UYIIZCZGHJSNEP-NSHDSACASA-N 251.326 2.055 10 10 CECE CC(C)C(=O)N[C@H]1CCCN(Cc2ccc(N)cc2)C1 586064836 LZAMFYCXKKFUTG-HNNXBMFYSA-N 275.396 2.005 10 10 CECE [N-]=[N+]=NCCCCNC(=O)C1C[C@H]2COC[C@H](C1)C2 2141875786 LPBBUVUNDJUDLX-QWRGUYRKSA-N 266.345 2.256 10 10 CECE CC(C)CCONC(=O)CCOc1ccc(N)cc1 1876424095 QASAIXHISSAIFT-UHFFFAOYSA-N 266.341 2.132 10 10 CECE CCN(CCCC(=O)O)Cc1ccc(C)cc1O 1963267134 DKIZADOMIIXXHG-UHFFFAOYSA-N 251.326 2.387 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1CC[C@H]2C[C@H]1CO2 897497437 UOGHFYLUIOJPSW-OSMZGAPFSA-N 265.328 2.436 10 10 CECE C[C@H](N)c1ccc(N2CC[C@]2(C)CO)c(Cl)c1 1947983063 QJKAMPDOXJLRQC-TVQRCGJNSA-N 254.761 2.321 10 10 CECE O=C(NCc1ccccc1O)[C@H]1C(F)(F)C12CC2 1964888568 GLANLAGMOMSBGB-SNVBAGLBSA-N 253.248 2.054 10 10 CECE Oc1cc(F)ccc1CN1CC[C@@H](N2CCCC2)C1 1964557013 UETQTTMGQWLCME-CQSZACIVSA-N 264.344 2.201 10 10 CECE CCOC(=O)C[C@H](N)c1c(O)cccc1Br 1951393906 AHYBUWNXFMHNGM-QMMMGPOBSA-N 288.141 2.108 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)Cc1ccccc1 20374289 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2.035 10 10 CECE CCN1CCC(CN[C@H](C)c2cc(O)ccc2O)CC1 44517453 JXMULNNSUVKQEY-GFCCVEGCSA-N 278.396 2.480 10 10 CECE C[C@H](NC[C@H]1CCCN(C)C1)c1cc(O)ccc1O 44534899 PGWPTMDHJCQNDH-NWDGAFQWSA-N 264.369 2.090 10 10 CECE CCc1cccc(CNC[C@H]2C[C@@H](OC)CCO2)c1O 2154202195 VUGIDJYVLQAVTM-LSDHHAIUSA-N 279.380 2.238 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCCNC(=O)C2CC2)c1 2158722913 ZFRMCZITFIDYOJ-GFCCVEGCSA-N 276.380 2.268 10 10 CECE NCc1ccc(N2CCC[C@@H]2CO)cc1C(F)(F)F 48859498 BRNGKJWGJNVQHC-LLVKDONJSA-N 274.286 2.125 10 10 CECE CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4cccc(F)c4O)[C@@H]1[C@H]3C2 289873380 VVYZMMNSICNPTK-UQJZFXKTSA-N 277.339 2.387 10 10 CECE CN[C@H](CC(C)C)[C@H](O)c1ccc(N(C)C)cc1 2031357538 HMKYTFZJKNPUOA-HUUCEWRRSA-N 250.386 2.420 10 10 CECE CC(C)(C)n1ccnc(NCc2ccc(N)cc2)c1=O 61768540 MKXWZBCTLQTYGE-UHFFFAOYSA-N 272.352 2.193 10 10 CECE Oc1cccc(CN[C@@H]2CC[C@H]3[C@@H]2C3(F)F)c1O 2040565072 YHAUKXDSDBBUDB-NGZCFLSTSA-N 255.264 2.231 10 10 CECE CO[C@H]1CC[C@@H](NCc2ccc3c(c2)CCN3C)C1 190942234 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Oc1c(Cl)cccc1CN[C@@H]1CO[C@]2(CCCOC2)C1 2178974041 GSNRLUMVWKETRU-SWLSCSKDSA-N 297.782 2.473 10 10 CECE O[C@H]1CCCN(c2ccc(CNC3CC3)cc2F)CC1 378684006 ZWZUKCOQYFRGPU-AWEZNQCLSA-N 278.371 2.429 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H]2CCC[C@H]2O)cc1O 689870533 KMEQPQGXFSLSLT-LALPHHSUSA-N 278.396 2.270 10 10 CECE CCNCc1ccc(N(C)[C@@H]2CCN(C)C2=O)c(Cl)c1 690324830 AYIUQPAXWADLQV-CQSZACIVSA-N 295.814 2.116 10 10 CECE Cc1cc(N2C[C@@H]3CCO[C@H]3C2)ccc1CNC1CC1 2172040670 ZZSUOOAEZRXGKS-YOEHRIQHSA-N 272.392 2.472 10 10 CECE c1cc2c(cc1CN[C@@H]1CCN3CCC[C@H]1C3)CCO2 383114704 FUHCNSYMVFHLEH-JKSUJKDBSA-N 272.392 2.195 10 10 CECE CCS[C@H]1CCCN(CC(=O)Nc2ccc(N)cc2)C1 383113293 FOIRVJWDYILDGO-AWEZNQCLSA-N 293.436 2.425 10 10 CECE C[C@@H]1C[C@H](N[C@H](C)c2c(O)cccc2O)[C@@H](C)O1 384629632 RBMJUROIIRRUEA-DBIOUOCHSA-N 251.326 2.314 10 10 CECE COCCNCc1ccc(N2C[C@H](O)C[C@H]2C)c(Cl)c1 384777919 JQKKYDYWHZAWNI-DGCLKSJQSA-N 298.814 2.036 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H](O)[C@@H]2C)cc1O 384774515 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C[C@H](N)c1ccc(N2CC[C@H]3OCCC[C@H]3C2)cc1O 2170285199 YWXGFFHTAXVDLB-MQIPJXDCSA-N 276.380 2.417 10 10 CECE CCCN1C[C@H]2C[C@H]1CN2Cc1ccc(OC)cc1O 2187562176 JDZJURRCLIKUJE-UONOGXRCSA-N 276.380 2.069 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@H]1C[C@@]12CCOC2 2198185692 RTRPVBVXMZRHTD-XGWLTEMNSA-N 272.392 2.495 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cncc(C(=O)O)n1 2192592169 PVBUDSLPPOHRCJ-VIFPVBQESA-N 273.292 2.078 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cc(C(N)=O)ccn1 2192601113 USPBOPXDOIHQAQ-SNVBAGLBSA-N 271.320 2.084 10 10 CECE CN1CCC[C@H](N(C)c2c(F)cc(CN)cc2F)CC1 2192750739 QUTOAHPPMMZIQA-LBPRGKRZSA-N 283.366 2.344 10 10 CECE OCc1ccc(N2CCC=C[C@@H]2CO)c(C(F)(F)F)c1 2182333817 VTSRABJTMYIRDX-LLVKDONJSA-N 287.281 2.325 10 10 CECE O=C(Nc1ccc(O)cc1Cl)c1cc(O)c(O)c(O)c1 2188868792 WYVQUOPWYWVLJE-UHFFFAOYSA-N 295.678 2.415 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@H]3C[C@@H]32)c(Cl)c1 1907001146 VGMZSKFXVRHBKA-AQUOVQTQSA-N 253.729 2.371 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@H](C)[C@@H](CO)C3)ccc21 2184684073 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[N-]=[N+]=NCCCN[C@H](C(=O)O)c1ccc([N+](=O)[O-])cc1 1912204380 AYRQWSLYOWSNHY-JTQLQIEISA-N 279.256 2.011 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1Br 1914287539 JIYJIYHNYXLNKE-JRKPZEMJSA-N 299.212 2.428 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1Br 1914303284 JIYJIYHNYXLNKE-JRKPZEMJSA-N 299.212 2.428 10 10 CECE COC(C)(C)[C@@H](C)NC(=O)c1ccc(N=NC(N)=O)cc1 1456073922 XUPZMOXTYAJKLA-SECBINFHSA-N 292.339 2.392 10 10 CECE Nc1ccc(NC(=O)N2CC[C@@H]2C(F)(F)F)cc1 1916175286 WJHOPNUZIPRWJS-SECBINFHSA-N 259.231 2.437 10 10 CECE Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)cc1 1866091839 DVCPCOVAHWMXGR-UHFFFAOYSA-N 273.248 2.135 10 10 CECE COc1ccc(O)c(CNCc2cccnc2C)c1 114505869 QYGAKYPFAMGXGY-UHFFFAOYSA-N 258.321 2.394 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CCc2sccc2C1 226953277 QKZIXFVATGZYKD-UHFFFAOYSA-N 275.329 2.358 10 10 CECE COc1cc(CNCCC(C)C)ccc1N(C)CC(=O)O 212683370 NIYRUZIOAPMEEW-UHFFFAOYSA-N 294.395 2.352 10 10 CECE C[C@H](Oc1cccnc1)C(=O)NCc1c(O)cccc1F 1471975649 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CC[C@H](CCCO)NCc1ccc(N(C)C)cc1 1967699413 MQPJZXBYAHDEDQ-CQSZACIVSA-N 250.386 2.393 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)OCO3)[C@H](C)[C@H]1C 252595679 HPXWISPTXZKJCN-NQBHXWOUSA-N 262.353 2.238 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2C[C@H]2C2CCCC2)cc1 2145110620 CQKUZXBFZFPFBV-GJZGRUSLSA-N 274.364 2.343 10 10 CECE O=C(c1cccc(O)c1O)N1CC[C@@](F)(C(F)(F)F)C1 1973859337 GXBRRRCLQOTUET-NSHDSACASA-N 293.216 2.214 10 10 CECE Oc1cc2c(cc1CNCCOCCC1CC1)OCO2 1974179165 UZBCDRZWEROSII-UHFFFAOYSA-N 279.336 2.027 10 10 CECE C[C@H](CCNC(=O)Cc1ccc(N)cc1)C(F)F 1974207689 PCIBOBZQKGETDQ-SECBINFHSA-N 256.296 2.219 10 10 CECE COc1ccc(O)c(CN[C@@H](C)COC(F)(F)F)c1 1974269883 FYVNFRMMPWIVQK-QMMMGPOBSA-N 279.258 2.415 10 10 CECE Oc1cccc(F)c1CNC[C@H]1COCCC1(F)F 1974459131 PMAXQKIOMAGYPL-VIFPVBQESA-N 275.270 2.293 10 10 CECE CN(C)Cc1cc(F)c(O)c([C@H]2CCCCN2)c1 258553496 GNPVSEYWJBRYJA-CYBMUJFWSA-N 252.333 2.408 10 10 CECE COc1ccc(CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c(O)c1 2148992870 UNRGTVZUMHICGI-PJODQICGSA-N 277.364 2.448 10 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10 10 CECE Oc1ccnc(NCc2ccc(Br)cc2O)n1 1995651942 DVHISPNKDJJEQV-UHFFFAOYSA-N 296.124 2.262 10 10 CECE COc1cccc(O)c1CN[C@H]1CSC[C@H]1C 1997940930 KPVLQSNTTQZGAU-KOLCDFICSA-N 253.367 2.242 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CC2(CC2)CN1 2152455821 AEFHVMWAUGXVJH-WCQYABFASA-N 274.364 2.054 10 10 CECE Oc1cccc(Br)c1CN[C@H]1[C@H]2OCCC[C@@H]21 2007564355 GIJCWZKJGOXVOM-WQHBLYJGSA-N 298.180 2.422 10 10 CECE CN1CCc2cc([C@H](O)[C@@H](N)C3CC4(CC4)C3)ccc21 2153879473 KFLBTSDWIYUWKP-HOTGVXAUSA-N 272.392 2.230 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H](F)C(F)(F)F 2009556491 ZCXGEJCTUUOYEI-RITPCOANSA-N 254.187 2.188 10 10 CECE Oc1c(F)cc(F)cc1CNCC12CCCN1CCC2 2154939759 PEEXDOYNLHYUNI-UHFFFAOYSA-N 282.334 2.388 10 10 CECE COc1ccc(CN(C)C2C[C@@H]3COC[C@H]3C2)c(O)c1 2156111002 VRWVDMRJYHHLEM-CHWSQXEVSA-N 277.364 2.258 10 10 CECE Oc1cccc(Cl)c1CNCCc1cn[nH]c1 289917123 RZRFCUIAJWQGIN-UHFFFAOYSA-N 251.717 2.101 10 10 CECE CC(C)CN(CCN)[C@@H](C)c1cc(O)ccc1O 2030265716 KSBXHPLEJGTTBK-NSHDSACASA-N 252.358 2.076 10 10 CECE CNCc1ccc(N2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1Cl 300498535 MBJSFGPYYIYDRR-LNSITVRQSA-N 280.799 2.267 10 10 CECE CO[C@@H]1C[C@]2(C(=O)N(C)[C@@H](C)c3ccccc3O)C[C@H]12 2157456720 PARYLIBOEJXHEK-UOJODKQESA-N 275.348 2.337 10 10 CECE CC(C)NCc1ccc(N2C[C@H](C)C[C@@H](O)C2)cc1 401492001 HKVHIXNYSFLGAR-CZUORRHYSA-N 262.397 2.392 10 10 CECE C[C@@H](CC(F)(F)F)C(=O)NCCOc1ccc(N)cc1 402493089 FVZYZYSJEDLAQS-VIFPVBQESA-N 290.285 2.352 10 10 CECE CC[C@@H](N[C@H](C)c1cc(F)ccc1O)C(=O)OC 311019742 UIZPHNDRWMIKQA-LDYMZIIASA-N 255.289 2.134 10 10 CECE NCc1ccc(NC(=O)C2=S=Nc3ccccc32)cc1 2159961823 BVSKDKXMRHPRDY-UHFFFAOYSA-N 283.356 2.216 10 10 CECE Nc1ccc(NC(=O)CN2C[C@@H]3CCCC[C@H]3C2)cc1 313431657 ZDHBIPWXVDPYPQ-STQMWFEESA-N 273.380 2.329 10 10 CECE CC(F)(F)[C@H]1CCCN1c1ccc2c(c1)NC(=O)[C@@H]2O 2160116023 JBAOKAHPAYSJMT-VXGBXAGGSA-N 282.290 2.296 10 10 CECE C[C@@H]1C[C@H](F)CN1CCCC(=O)Nc1ccc(N)cc1 2160288122 HLYLVVCJWLCBGT-NEPJUHHUSA-N 279.359 2.420 10 10 CECE 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10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@]3(COC)C2)cc1 2109174669 HCOWIJBPNCHASR-IVMMDQJWSA-N 260.381 2.440 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CC[C@H](CO)C2)c1 2090018146 MWIKRBFLBVLMPG-SRVKXCTJSA-N 265.353 2.212 10 10 CECE CCOC1(C(=O)N2CCCC[C@H](CN=[N+]=[N-])C2)CC1 2110252908 GQBLHAXDYZASIB-LLVKDONJSA-N 266.345 2.495 10 10 CECE CCOc1cccc(CN(C)[C@@H](C)CCNC)c1O 2111835937 UMWOBYMURVLKBT-LBPRGKRZSA-N 266.385 2.221 10 10 CECE C[C@@H](N)c1ccc(N2CCN(C)CC2(C)C)c(F)c1 2094038021 BWAAVRKQWZUBDN-LLVKDONJSA-N 265.376 2.376 10 10 CECE COc1ccc(CNC[C@](C)(O)C(C)(C)C)c(O)c1 2094719240 KCDHFGPIVFNYGV-HNNXBMFYSA-N 267.369 2.288 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@@H](N)C2 2094908940 JPIQWPDFLSMRMR-KKOKHZNYSA-N 262.353 2.113 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@H]3CO[C@@H](C3)C2)cc1 2095955084 BXGMYCFBCNBULU-JSGCOSHPSA-N 259.305 2.010 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@H]2CC(F)(F)C(=O)O2)CC1 2099336406 KDXODXCYKGKAGX-RKDXNWHRSA-N 274.271 2.102 10 10 CECE 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252.318 2.293 10 10 CECE CC[C@H](O)c1ccc(N2C[C@H](O)C[C@@H](F)C2)cc1 2219183904 RNHHBLXGBWQHIS-BNOWGMLFSA-N 253.317 2.039 10 10 CECE COc1ccc(N2CCCC(F)(F)C2)c(CO)c1 2220433414 ZZIZYVHRLJHETG-UHFFFAOYSA-N 257.280 2.423 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2CCN2C)c(C)c1 2232029430 YECXILWBXXWYDV-HIFRSBDPSA-N 261.413 2.416 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCSC[C@@H]1CCO 2232100791 QODTVOBZBVINTM-OCCSQVGLSA-N 281.421 2.353 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2OC[C@H]3CCC[C@@H]32)cc1 2233214723 GFCXJWRZSIRWIE-SWHYSGLUSA-N 275.352 2.205 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H](C)CO)c(C)c1 2223971739 PMFMSLVWOCXUNZ-WCQYABFASA-N 250.386 2.340 10 10 CECE Cc1ccc(C)c(C(=O)NCCCN=[N+]=[N-])c1C(=O)O 2234173763 ZEHPVOITCVCRSW-UHFFFAOYSA-N 276.296 2.432 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)C1C[C@H]2COC[C@H](C1)C2 2234168125 ZGZRWSLDSVIFIZ-XRRVDJEJSA-N 278.356 2.397 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@H](F)C2)c(F)c1 2234672960 JGPFDMRRXYCSHE-STQMWFEESA-N 284.350 2.234 10 10 CECE 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CSc1ncc(CNCc2ccc(CO)nc2)s1 2257132754 RSQDDCCSDXPHAO-UHFFFAOYSA-N 281.406 2.042 10 10 CECE Cc1ccc(N)c(C(=O)N2CCC[C@H]2CN=[N+]=[N-])c1 2271351258 VLQXCIQLXOMUTI-JTQLQIEISA-N 259.313 2.492 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H]3COC[C@H]2C3)c(F)c1 2271366167 GOVKTPVTCLXUMP-ATZCPNFKSA-N 268.307 2.210 10 10 CECE CCCN[C@@H](CNC)c1ccc2c(c1)CCCN2C 2271952266 DUHRVYKSHHTRRS-HNNXBMFYSA-N 261.413 2.329 10 10 CECE COC[C@]1(C)[C@@H]2C[C@@H]2CN1c1ccc(CO)cc1F 2269099888 QCLCFJVRLXAZNU-LALPHHSUSA-N 265.328 2.179 10 10 CECE CSc1ncc(CNC(=O)[C@@H]2CCC[C@H](N)CC2)s1 2269194362 AUYXCXNRSUPGJO-ZJUUUORDSA-N 299.465 2.389 10 10 CECE COc1ccnc(N(C)Cc2ccccc2O)c1C=O 2281156240 BUGVSJGNAYOIIA-UHFFFAOYSA-N 272.304 2.245 10 10 CECE C[C@@H]1CC[C@H](C[S@@](=O)CC(=O)Nc2ccc(N)cc2)C1 2284000117 OKKZIUWRCHRFNP-XAAFQQQXSA-N 294.420 2.392 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(N(C)OC)C2)cc1C 2285146933 VSBWIYFTJAFEIO-ZDUSSCGKSA-N 277.412 2.347 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2ncn(C)n2)cc1C 2285128026 GBMPKRQWEIOEQH-GFCCVEGCSA-N 273.384 2.040 10 10 CECE Nc1ccc(C[C@@H](O)c2ccn(CC(F)(F)F)n2)cc1 2296118697 OFAQZHDHNKFIQT-GFCCVEGCSA-N 285.269 2.304 10 10 CECE Nc1ccc(CCN=c2ccn(CC(F)(F)F)[nH]2)cc1 2296120512 IARBAUCZCNLICA-UHFFFAOYSA-N 284.285 2.104 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2c(N)cc(F)cc2F)C1 2286944886 LAXCQEXCKMIESF-QMMMGPOBSA-N 281.266 2.462 10 10 CECE CCNCc1cc(OC)ccc1N1CC[C@H](O)[C@H]1CC 2288900286 NLCZHNOYAIBIBK-ZBFHGGJFSA-N 278.396 2.154 10 10 CECE Cc1ccc(CN2CCN(C)CC2)c(O)c1Br 2307454129 FFZQNOZLYCDLGJ-UHFFFAOYSA-N 299.212 2.211 10 10 CECE C[C@H]1CC[C@@H](CN[C@@H](C)c2cc(O)ccc2O)O1 2311227310 XHSQDWIUIXMJFW-NHCYSSNCSA-N 251.326 2.316 10 10 CECE COc1cc(Cl)c(N2CCNC[C@@H]2C)c(OC)c1 2319563575 SUXHBERFQLGRCS-VIFPVBQESA-N 270.760 2.155 10 10 CECE CCOc1ccc(N=NN2CCC(C(N)=O)CC2)cc1 2330271456 KXFHEVGSRGSJLS-UHFFFAOYSA-N 276.340 2.281 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@H]2CC[C@@H]3C[C@@H]3C2)c1 2328626211 RQRNDQQAIUTHLI-OUAUKWLOSA-N 260.337 2.027 10 10 CECE C[P@@]1(=O)C[C@@H](O)[C@H](N2CCCC[C@H](CN=[N+]=[N-])C2)C1 2330319687 WTIWQFDQJSEGHE-UWNFWVIDSA-N 286.316 2.135 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)cc1 2333105178 QQSCAAVFMOZKDT-TUUVXOQKSA-N 260.381 2.174 10 10 CECE Cc1nnsc1COC(=O)CCc1ccc(N)cc1 2335919486 UBPLBDFZXCKDBH-UHFFFAOYSA-N 277.349 2.105 10 10 CECE OCc1ccc(N2C[C@@H](O)C23CCC3)cc1C1CC1 2339156456 WNKMPGXBUOZYGB-OAHLLOKOSA-N 259.349 2.160 10 10 CECE Cn1ncc(Cl)c1N1CCc2cc(O)c(O)cc2C1 2341215118 UKSLDGWBIHDRIL-UHFFFAOYSA-N 279.727 2.047 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CC[C@H]2C2CC2)cc1 2342604689 XVMVXEOXGSUJSY-HIFRSBDPSA-N 258.365 2.364 10 10 CECE C[C@H](NC[C@@]1(O)CCCSC1)c1ccc(F)cc1O 2343694652 UBAMHCNNDBXAPM-HZMBPMFUSA-N 285.384 2.440 10 10 CECE COc1ccc(N(C)[C@@](C)(C(=O)O)C2(F)CC2)cc1 2348558688 UQGVPHUOKORAAL-ZDUSSCGKSA-N 267.300 2.477 10 10 CECE CO[C@@H]1COCCN([C@@H](C)c2ccc(C)cc2O)C1 2351612252 SXXZLGBXGRHDSI-STQMWFEESA-N 265.353 2.109 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C[C@@H]2CCc3nccn32)C1 2351804835 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CCN(CCN=[N+]=[N-])C(=O)[C@@](C)(F)C(F)(F)F 2300529881 HSXBYYIGNZEBKK-SSDOTTSWSA-N 256.203 2.436 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)[C@H]1C[C@@H]2CCC[C@@H]21 2356960762 JRTXBJZEAGTUQI-YIVQXAGMSA-N 271.364 2.263 10 10 CECE CN[C@@H](c1ccccc1O)[C@@]1(O)C[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21 2357278926 ZFPLLKSZORCADQ-MQJOUDLZSA-N 273.376 2.450 10 10 CECE CCOc1cccc(CNC[C@@H](O)[C@@H](C)CC)c1O 304034154 HBDLQKBZTZDZOQ-WCQYABFASA-N 267.369 2.288 10 10 CECE COCCn1cc(N[C@H](C)c2ccc(OC)cc2O)cn1 37090285 KVNYEWDDGZWVON-LLVKDONJSA-N 291.351 2.417 10 10 CECE COc1cc(CC2CCC(CN)CC2)cc(O)c1O 1951855850 NUSULFWPHYANOY-UHFFFAOYSA-N 265.353 2.414 10 10 CECE NCc1c(O)c(Br)cc2c1CCCC2 212588651 RGRAWLUZUBXMML-UHFFFAOYSA-N 256.143 2.492 10 10 CECE O=C(Nc1cccc(O)c1)Nc1cc(O)c(O)c(O)c1 217278611 NXNASKGQZPXGCG-UHFFFAOYSA-N 276.248 2.153 10 10 CECE CCOc1cccc(CN(C)C[C@H]2CCCO2)c1O 132964861 ZQEFJYNVYMFWFS-CYBMUJFWSA-N 265.353 2.402 10 10 CECE C[C@@H](NC[C@H]1CCCC[C@@H]1O)c1cc(O)ccc1O 85974471 JUZUFWGZIUZZQI-GYSYKLTISA-N 265.353 2.300 10 10 CECE CN(C)c1ccc(CNC(=O)CC2(N)CCCCC2)cc1 84184167 VJASCXNJSNWBPL-UHFFFAOYSA-N 289.423 2.421 10 10 CECE CC(C)[C@H](C)NC(=O)CN(c1ccc(CN)cc1)C1CC1 49307734 ZKCQMHFFEJFKKG-ZDUSSCGKSA-N 289.423 2.275 10 10 CECE CCOC(=O)[C@@](C)(CC1CCC1)NCCN=[N+]=[N-] 229727997 KOICOMGNDVPQSF-GFCCVEGCSA-N 254.334 2.398 10 10 CECE O=C(CN1CC2CCC1CC2)c1ccc(O)c(O)c1 382341421 YPUBGQVHVFHOTM-UHFFFAOYSA-N 261.321 2.155 10 10 CECE CC(C)c1ccc(O)c([C@H]2N[C@@H](C(=O)O)CS2)c1 83236677 VYNUXJHDYCYYPJ-PWSUYJOCSA-N 267.350 2.304 10 10 CECE CC(C)[C@@H](O)[C@@H](N)c1c(Br)ccc(F)c1O 95804096 BQLOMHMKDHPSLT-VHSXEESVSA-N 292.148 2.311 10 10 CECE CC(C)N(Cc1ccc(N2CCOCC2)cc1)C[C@H](C)O 93144261 SGCSFQWYWAUUSS-HNNXBMFYSA-N 292.423 2.114 10 10 CECE Cc1cc(C)c(O)c(CN2CCN3CCC[C@H]3C2)c1 246892005 RHRGKFRBBSJEDJ-HNNXBMFYSA-N 260.381 2.289 10 10 CECE CCO[C@@]1(C)C[C@H]1NCc1cccc(OC)c1O 527783820 WGLPZGNROAOGOV-OCCSQVGLSA-N 251.326 2.058 10 10 CECE Oc1cc(F)c(Br)c(C2CCNCC2)c1O 258450621 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AESGTKOYQUWHFU-QGZVFWFLSA-N 265.360 2.222 10 10 CECE CCN1CCc2cc([C@H](O)c3cncc(N)c3)ccc21 2163072820 CXKDLBRHOJPGBC-INIZCTEOSA-N 269.348 2.128 10 10 CECE CN(C)c1ccc([C@H](O)c2cccn3nccc23)cc1 2163076643 PNFHXHOIFDGIJX-INIZCTEOSA-N 267.332 2.482 10 10 CECE C[C@H]([C@H]1CCCCO1)[C@@H](NN)c1ccc(N(C)C)cc1 2163095912 FYNLQIMWXRUROL-DAXOMENPSA-N 277.412 2.462 10 10 CECE Cc1cn(C)nc1[C@@H](N)c1ccc2c(c1)CCCN2C 2163097590 PHDWSJMTAKWTSQ-HNNXBMFYSA-N 270.380 2.159 10 10 CECE CN1CCCc2cc(N3C[C@H]4CNC[C@@H](C4)C3)ccc21 2163109063 WADMTNICYOYODR-ZIAGYGMSSA-N 271.408 2.115 10 10 CECE CN[C@@H](C)c1ccc(N(C)C(COC)COC)c(F)c1 701669172 HETBJTDJTZDVGV-NSHDSACASA-N 284.375 2.204 10 10 CECE CCN1CCc2cc([C@@H](NN)[C@H]3CCCCO3)ccc21 2163139882 CTJXWVLMRNAURI-HZPDHXFCSA-N 275.396 2.143 10 10 CECE CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4ccc(N)cc4)[C@@H]1[C@H]3C2 394319834 CKLWJKFAWWGCKX-FHXAZYNBSA-N 258.365 2.124 10 10 CECE COC[C@H]1C[C@@H](NCc2ccc3c(c2)CCN3C)C1 714465769 RMCJIACOJUIVIB-OTVXOJSOSA-N 260.381 2.194 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](C(N)=O)C2)cc1Cl 723176230 MJELAVLVFFGWIG-GHMZBOCLSA-N 295.814 2.322 10 10 CECE CCOc1ccc(CN[C@H](CC)[C@H](O)C(F)F)c(O)c1 824635310 GPYFTJCSQSHIQL-YPMHNXCESA-N 289.322 2.285 10 10 CECE CNCc1cc(F)c(N2CCCC[C@]2(C)CO)c(F)c1 722968746 IWMOKTWHXQLNOD-OAHLLOKOSA-N 284.350 2.426 10 10 CECE COC[C@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 837172059 PTIBJQQZWOADRF-LBPRGKRZSA-N 293.363 2.295 10 10 CECE COC(=O)[C@@H](C)N(C)C/C=C\c1ccc(N(C)C)cc1 835053172 TXCNFZWMUWPWPR-FMFIFOJESA-N 276.380 2.259 10 10 CECE CC(C)C[C@@H](N)CN(C)c1ccc(OCCN(C)C)cc1 841011242 FTLKXORETCYPBM-OAHLLOKOSA-N 293.455 2.437 10 10 CECE CN(C)c1ccc([C@@H](N)CN[C@@H]2CCCSC2)cc1 841044555 CZILCHZNYSYMBF-HIFRSBDPSA-N 279.453 2.238 10 10 CECE CC(=O)C(=O)COC(=O)[C@H]1CC[C@H](C2CCC2)CC1 849897835 HMVSADCPIHBFFQ-JOCQHMNTSA-N 266.337 2.294 10 10 CECE C[C@H](NCCCc1ncn(C)n1)c1ccc(N(C)C)cc1 842898662 GFGCDWGLPHOCEX-ZDUSSCGKSA-N 287.411 2.165 10 10 CECE CCc1noc(C)c1C(=O)NCc1c(O)cccc1F 928710635 VLBFBNFXXJSETA-UHFFFAOYSA-N 278.283 2.320 10 10 CECE CCOc1ccc(O)c(CNC[C@H](C(=O)O)C2CCC2)c1 854245881 FZYXLYSBKNFWKO-AWEZNQCLSA-N 293.363 2.381 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)NCC[C@@H](N)C(C)C)c1 854230314 MQZSUUKVHZRLFR-BXUZGUMPSA-N 294.395 2.203 10 10 CECE COc1ccc(N2CC[C@@H](N[C@@H]3CCCOC3)C2)cc1 850489935 YGBJYHXMYPOVDD-ZIAGYGMSSA-N 276.380 2.043 10 10 CECE CNC(=O)CN(C)[C@H](C)c1ccc2ccccc2c1O 132117385 XXUODMQXJFUCLW-LLVKDONJSA-N 272.348 2.284 10 10 CECE CO[C@@H]1CCCC[C@@H]1C(=O)N1Cc2cccc(O)c2C1 871205223 RVJKQEFFWSJZIQ-SWLSCSKDSA-N 275.348 2.440 10 10 CECE COCCN(Cc1cc(C)cc(C)c1O)[C@H]1CCOC1 782961140 IYVYVDWMJSXGFW-HNNXBMFYSA-N 279.380 2.246 10 10 CECE CN(C)c1ccc(CN[C@H]2CCC[C@H](CO)C2)cc1 387940227 ILAGWDGJSJTDSP-GJZGRUSLSA-N 262.397 2.393 10 10 CECE Cc1ncsc1[C@@H]1NCCc2cc(O)c(O)cc21 83724362 JRCWXXDTQICGBL-GFCCVEGCSA-N 262.334 2.098 10 10 CECE COc1cc2c(cc1OC)N(C)CC[C@H]2NC1CC1 84143221 UQPLMRMDIINEJG-GFCCVEGCSA-N 262.353 2.337 10 10 CECE CN1CCCC[C@H](CNCc2ccc(F)c(F)c2O)C1 703339925 DXJDMOKWJUOGEV-LLVKDONJSA-N 284.350 2.492 10 10 CECE C[C@]12CCCC[C@H]1CN2c1ccc2c(c1)NC(=O)[C@@H]2N 707136619 VPLYVAJLMQCASQ-JJMVLAAESA-N 271.364 2.407 10 10 CECE C[C@H]1CCC[C@H](CNCc2ccc(O)c(O)c2)O1 688868108 VRTACJKEBLJIKN-CMPLNLGQSA-N 251.326 2.145 10 10 CECE CC1(C)CC[C@@H](CNCc2ccc(O)cc2O)OC1 711250061 MUYYPRWMQKPRSP-ZDUSSCGKSA-N 265.353 2.393 10 10 CECE Nc1ccc(CCCN2C[C@@H]3[C@H](C2)C3(F)F)cc1 715459855 OWUZUFFFDOYRHB-BETUJISGSA-N 252.308 2.398 10 10 CECE CCc1cnc(CNCc2ccc3c(c2)CCN3C)[nH]1 719141170 MDPDVMAJJFTTHO-UHFFFAOYSA-N 270.380 2.254 10 10 CECE O=C(NC[C@]12CCCC[C@H]1C2)c1cccc(O)c1O 693583767 YDGQBUJJLFFYKV-ZUZCIYMTSA-N 261.321 2.408 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1156885974 QSKUSQYHTFTOOT-YBXAARCKSA-N 273.332 2.006 10 10 CECE C[C@H]1CN(Cc2cccc(F)c2O)[C@H](C)CN1C 775985485 LRNNQKJFXGFKBJ-WDEREUQCSA-N 252.333 2.056 10 10 CECE C[C@H](N)c1ccc(N(C)CCc2ccccn2)cc1O 93670223 IUEOSGZFAHBGGH-LBPRGKRZSA-N 271.364 2.486 10 10 CECE COCC1(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)CCCC1 1912205017 ZZGZTCTUGKYNSC-SNVBAGLBSA-N 252.318 2.104 10 10 CECE CCn1ncc(CN(C)c2ccc(CO)cc2Cl)n1 2115769006 VVFRGROHBLSEFQ-UHFFFAOYSA-N 280.759 2.080 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](O)[C@@H]2C)cc1C(F)(F)F 2126119966 PRYCZXNKQBOJKK-UBJUHAIHSA-N 274.286 2.295 10 10 CECE CCCN[C@@H](c1ccc2c(c1)CCN2C)C1COC1 2119973218 IZCWKKPSCSLHIB-INIZCTEOSA-N 260.381 2.366 10 10 CECE Nc1ccc(O)c(CNC(=O)C[C@]23CCC[C@H]2C3)c1 2125588434 WQSAPJYHCRBVAY-XHDPSFHLSA-N 260.337 2.171 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc(CNC)cc1Cl 2131055796 IXROUACKDFVRGM-QWHCGFSZSA-N 279.815 2.342 10 10 CECE CC(C)N1C[C@H]2C[C@H]1CN2c1ccc([C@@H](C)N)cc1 2131042752 YIJDJCMQVLCVAE-UHOFOFEASA-N 259.397 2.378 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2COCC2(F)F)c1 2131099578 DORMMGCLWVMINW-QPUJVOFHSA-N 273.279 2.086 10 10 CECE CN[C@@H]1CCc2cc(N3CC(C)(C)[C@H]3CO)ccc21 2128297930 YNJXITICVSDBGR-HUUCEWRRSA-N 260.381 2.100 10 10 CECE CC(C)C1(O)CN(c2ccc3c(c2)CCC[C@H]3N)C1 2128271688 DASVSPUSWLHFNU-OAHLLOKOSA-N 260.381 2.230 10 10 CECE O[C@@H]1CCc2cc(N3CCOCC4(CC4)C3)ccc21 2128316391 DVJQWGRKIIBXOD-OAHLLOKOSA-N 259.349 2.283 10 10 CECE CCN(c1ccc2c(c1)CC[C@H]2O)[C@@H](C)CN(C)C 2128317588 FTNQEUNYESQBDZ-BLLLJJGKSA-N 262.397 2.443 10 10 CECE Cc1ccc(OCc2ccc3cncn3c2)c(N)n1 2131284644 WJSXZTOXWYLFJO-UHFFFAOYSA-N 254.293 2.199 10 10 CECE COCCNCc1ccc(OC[C@@H]2C[C@H]2F)c(C)c1 2131828169 SVGABWRLRYXNST-UONOGXRCSA-N 267.344 2.468 10 10 CECE Nc1ccc(NC(=O)N2[C@H]3CCC[C@@H]2COC3)cc1 1900653887 SYQFILXUGQJIOS-BETUJISGSA-N 261.325 2.054 10 10 CECE CC(C)([C@@H]1CCCCO1)[C@H](NCCCN=[N+]=[N-])C(=O)O 1912179586 VYMUHIWHHUXDTM-WDEREUQCSA-N 284.360 2.325 10 10 CECE [N-]=[N+]=NC1CN(C(=O)C=Cc2nc3ccccc3o2)C1 1912159625 KGSSVTPOUPFBNY-UHFFFAOYSA-N 269.264 2.362 10 10 CECE CC1(C)CO[C@H](CC(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 1912149137 BPNRBMNOWOSMHK-WDEREUQCSA-N 266.345 2.350 10 10 CECE COC[C@@H](C)c1noc(CCc2ccc(N)cc2)n1 1910265362 XZXNIRLWBKJWCF-SNVBAGLBSA-N 261.325 2.187 10 10 CECE Cc1cccc(CNCc2noc(C(F)F)n2)c1O 1910759532 QJKHWNKJWSBSBV-UHFFFAOYSA-N 269.251 2.311 10 10 CECE C[C@@H]1[C@H](O)CCN1c1c(F)cc(CNC2CC2)cc1F 1914245195 XFUBXYNAWXEZJL-YMTOWFKASA-N 282.334 2.176 10 10 CECE CCN(c1ccc(CNCCOC)cc1Cl)C1COC1 1915670905 CJGSPSGWDIVUBL-UHFFFAOYSA-N 298.814 2.301 10 10 CECE COc1cccc(/N=N/N2CCC(C(=O)O)CC2)c1 1860484456 NKJBOWYXBACZSP-CCEZHUSRSA-N 263.297 2.491 10 10 CECE CC1(C)CCCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 112228473 HHNNPVMUNOIQCR-CYBMUJFWSA-N 259.353 2.265 10 10 CECE COCCC(C)(C)NC(=O)c1ccc(N=NC(N)=O)cc1 1466774910 PCVQHBQODVFVNR-UHFFFAOYSA-N 292.339 2.394 10 10 CECE COc1ccc(N2CC[C@]23C[C@@H](CN)C3)c(F)c1F 2136984850 JLKMHTNYILRCAD-KMHCFJFGSA-N 268.307 2.291 10 10 CECE O=C(/C=C/c1nccs1)N1Cc2cccc(O)c2C1 1636230984 MBCOIMGYMQQGBZ-SNAWJCMRSA-N 272.329 2.404 10 10 CECE CC[C@H]1[C@H](C)CCN1C(=O)Cc1ccc(O)c(O)c1 1639144989 BHGNSCYZVDUFJG-PWSUYJOCSA-N 263.337 2.287 10 10 CECE Cc1cc(F)cc(C)c1S(=O)(=O)NCCCN=[N+]=[N-] 229385666 BHWKUIPVFXRHBE-UHFFFAOYSA-N 286.332 2.421 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@H]3CO)c(Cl)c1 2138373951 PNNNBMPDGSDGIJ-XUJVJEKNSA-N 280.799 2.267 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 1651225608 QEYUFFHDZDCYGU-USXIJHARSA-N 295.338 2.300 10 10 CECE CC(C)c1cc(NC(=O)c2ccc(O)c(O)c2)[nH]n1 231183197 LEJFPTDWYAIPND-UHFFFAOYSA-N 261.281 2.197 10 10 CECE CN(C)c1ccc(CNc2[nH]c(=N)ccc2F)cc1 2139572546 HCWOZRMJSDOWRY-UHFFFAOYSA-N 260.316 2.311 10 10 CECE Cc1cccc(CNc2ccc(C(=O)O)nc2)c1O 2139759343 XGWLUIDNVKWVJC-UHFFFAOYSA-N 258.277 2.406 10 10 CECE COCCNCc1c(O)cc(C)cc1Br 1961929537 JXVIOEOUHYJAPI-UHFFFAOYSA-N 274.158 2.199 10 10 CECE O[C@@H]1CC[C@@H]1CNCc1ccc(N2CCCC2)cc1 2140512966 CNNULDVGLJFBJS-GDBMZVCRSA-N 260.381 2.147 10 10 CECE Nc1ccc(-n2nccc2NC(=O)C2C[C@@H]3C[C@H]3C2)cc1 156300726 KBPMTARHRGODKW-QWRGUYRKSA-N 282.347 2.439 10 10 CECE CN(C)c1ccc(CN[C@@H]2CC[C@@H](O)C2(C)C)cc1 2142137503 QWKTZOLRBCDFMU-HUUCEWRRSA-N 262.397 2.392 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CCN(C)C2)cc1Cl 234403635 KZESFBLGHFUSHQ-GFCCVEGCSA-N 281.831 2.447 10 10 CECE CC[C@H]1C[C@@H](NCc2c(O)cccc2OC)CCO1 817415394 RZPSGRJTMFGDDQ-RYUDHWBXSA-N 265.353 2.448 10 10 CECE OCc1ccc(N2CC[C@]3(CCO3)C2)cc1Cl 1947807344 QFDJWDROXAAVSZ-ZDUSSCGKSA-N 253.729 2.202 10 10 CECE COc1cccc(N(C)Cc2ccc(N)cc2)c1N 1876365961 HDTABNQGBZLSLJ-UHFFFAOYSA-N 257.337 2.496 10 10 CECE NCc1cc(F)c(N2C[C@H]3C(C(F)F)[C@@H]3C2)c(F)c1 1877073669 IXNXPGSMBYQYHF-HTQZYQBOSA-N 274.261 2.371 10 10 CECE CCn1nc(C)c(N)c1N(C)Cc1ccccc1O 1877532789 KOAHZSJNGHHKGP-UHFFFAOYSA-N 260.341 2.136 10 10 CECE CN[C@H]1CCc2cc(N3CCC[C@@H]3[C@@H](C)O)ccc21 1879180422 CNRNVLGBLDKIKS-XFBWCDHKSA-N 260.381 2.243 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)CC2(C)COC2)c(F)c1 1880932783 XLOGKSROVSHILA-SECBINFHSA-N 270.323 2.457 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](O)C2(C)C)c(F)c1 1880930217 ZFALNAPQDGILST-QPUJVOFHSA-N 270.323 2.334 10 10 CECE [N-]=[N+]=NCCNC(=O)c1csc(C(F)(F)F)n1 1963808894 HTUYWOHRKMBBSP-UHFFFAOYSA-N 265.220 2.202 10 10 CECE c1cc2c(cc1CN[C@@H]1CCN3CCC[C@H]13)CCCO2 2143831083 NLLDRNLQPLYLIQ-HZPDHXFCSA-N 272.392 2.338 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@H]2COCC2(F)F)c(F)c1 1888249664 PAIWJIWLASFRPE-PELKAZGASA-N 274.286 2.316 10 10 CECE Nc1ccc(NC(=O)CO[C@H]2CCCC2(F)F)cc1 1888327393 JOKYFLIEXJTQHM-NSHDSACASA-N 270.279 2.412 10 10 CECE O[C@@]1(c2ccc(N3CCCC3)cc2)COCC1(F)F 1888445889 KILUTAJRUZJDIJ-CYBMUJFWSA-N 269.291 2.140 10 10 CECE Cc1ccc2nc(COc3cc(F)cnc3N)cn2c1 2144590740 MCTWOMMUICXOOH-UHFFFAOYSA-N 272.283 2.338 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CCS[C@H](C)C3)ccc21 137199855 CKCNSZOBLQJGCE-QMTHXVAHSA-N 291.420 2.231 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H](CO)C[C@@H]2C)c1O 1966216723 QJTSMYLBKLULJA-GXSJLCMTSA-N 297.782 2.451 10 10 CECE CC(C)C[C@@H](CNCc1cccc(O)c1O)N(C)C 41116703 KTXNRYHWKKFSFC-ZDUSSCGKSA-N 266.385 2.164 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3COCC[C@H]32)cc1O 2145021246 RUALCUPMNVBPSR-LALPHHSUSA-N 276.380 2.288 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCCC[C@H]1CCN 252463765 BJMGMICVGJSVIO-RYUDHWBXSA-N 264.369 2.362 10 10 CECE Oc1cc(F)ccc1CNCCN1C[C@H]2CC[C@H]1C2 1971261425 UZZBXMAZMDYOAZ-FZMZJTMJSA-N 264.344 2.105 10 10 CECE Oc1cccc(F)c1CNCCN1C[C@H]2CC[C@H]1C2 1971260167 CKFKTAHKQUQGMU-RYUDHWBXSA-N 264.344 2.105 10 10 CECE CCc1cccc(CNC[C@H]2C[C@@]23CCOC3)c1O 1974223834 LIPOWQAIWNGHKJ-GDBMZVCRSA-N 261.365 2.471 10 10 CECE Oc1c(F)cccc1CNC[C@@H]1COCCC1(F)F 1974470667 BLYKSGWVMFHKBJ-SNVBAGLBSA-N 275.270 2.293 10 10 CECE CCOc1cccc(CNCc2cnn(C)c2Cl)c1O 2150751403 NMUVSMKGHQOLFE-UHFFFAOYSA-N 295.770 2.468 10 10 CECE COc1ccc([C@H](C)NCC[C@@H](C)[S@](C)=O)c(O)c1 168846393 FWPWGCKPQVSVIK-RMDKCXRXSA-N 285.409 2.209 10 10 CECE CCOC(=O)Cc1ccc(O)c(O)c1C(F)(F)F 261096267 WKZLBSYSOXZCGV-UHFFFAOYSA-N 264.199 2.222 10 10 CECE CCC(CC)NC(=O)[C@H](C)N(C)c1ccc(CN)cc1 34653833 YWMIGDFOWIHQQZ-LBPRGKRZSA-N 277.412 2.275 10 10 CECE CN[C@@H](C1[C@@H](C)[C@@H]1C)[C@H](O)c1ccc2c(c1)CCN2C 2150918033 SFWYRPKFKBQLLR-NXKWAJLKSA-N 274.408 2.202 10 10 CECE NCc1ccc(N2CC[C@@]3(O)CCCC[C@@H]3C2)cc1F 160488899 JZERXSSRSWZICS-CJNGLKHVSA-N 278.371 2.416 10 10 CECE COC[C@]1(O)CCCN(c2ccc(CN)c(Cl)c2)CC1 2151893845 CGVVJUGKFQPMII-HNNXBMFYSA-N 298.814 2.167 10 10 CECE COC[C@]1(O)CCCN(c2ccc([C@@H](C)N)cc2)CC1 2151885806 JKCWQEDQFJIDCQ-CJNGLKHVSA-N 278.396 2.074 10 10 CECE COc1cccc(O)c1CNCc1cscn1 1997941480 RXNAGXZXEFHAKQ-UHFFFAOYSA-N 250.323 2.147 10 10 CECE CN(C)c1ccc([C@]2(N)CCCC3(C2)OCCO3)cc1 1999537114 SZEHSQJKZNIDPN-HNNXBMFYSA-N 276.380 2.224 10 10 CECE CC[C@H]1CCOC[C@H]1OC(=O)COc1ccc(N)cc1 2152514052 OIFGLGHZVPXDLV-SMDDNHRTSA-N 279.336 2.006 10 10 CECE CO[C@@H](C)CN(C)c1cc(Cl)c(CN)cc1F 2008206890 PWIGXGFLYQTJKY-QMMMGPOBSA-N 260.740 2.409 10 10 CECE Cn1ncc(Cl)c1CN1CCC[C@H]1CN=[N+]=[N-] 2009442573 DJIOEDFCSNXZDI-QMMMGPOBSA-N 254.725 2.348 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCOCC(F)(F)F 2009445159 MKSZQBLBIXBRRQ-QMMMGPOBSA-N 252.240 2.340 10 10 CECE COCCN1CCN(c2ccc([C@H](C)O)cc2Cl)CC1 2154750603 OYHRIJZCWUDEJJ-LBPRGKRZSA-N 298.814 2.162 10 10 CECE COCCN1CCCN([C@H](C)c2ccccc2O)CC1 2154736492 WIOIWERRFKYQHU-CQSZACIVSA-N 278.396 2.107 10 10 CECE COCCCCSCC(=O)N(C)c1ccc(N)cc1 2271818339 UHYSXCJUJXZTNB-UHFFFAOYSA-N 282.409 2.391 10 10 CECE CNCc1ccc(OCCCc2cnn(C)c2)c(C)c1 2155010123 CKWBMFKBSOREFA-UHFFFAOYSA-N 273.380 2.460 10 10 CECE CCCNCc1ccc(OCCC(=O)N(C)C)c(C)c1 2155019203 ODJBRBXBQJPPFJ-UHFFFAOYSA-N 278.396 2.352 10 10 CECE CCCCOC[C@@H](O)CN(CC)c1ccc(CN)cc1 2155688656 ZDORJHUPNYVEEU-INIZCTEOSA-N 280.412 2.149 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](O)C2(C)C)c(Br)c1 2023140811 DIVITMUAEFWUNF-QPUJVOFHSA-N 299.212 2.428 10 10 CECE COc1ccc(N(C)C[C@](C)(O)C(F)(F)F)cc1 2026880273 SQBNOEVTWKGSLW-NSHDSACASA-N 263.259 2.445 10 10 CECE C[C@H]1C[C@@H](NC(=O)c2ccc(O)c(O)c2)CCS1 2027207006 BSEJHHRRCUCBGX-WPRPVWTQSA-N 267.350 2.112 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H](F)[C@H](OC)C2)cc1 2029815920 ZAEMYKXHLJPQRK-BFHYXJOUSA-N 253.317 2.303 10 10 CECE COc1ccc([C@@H](C)NCC2CC3(C2)OCCO3)c(O)c1 2030314922 DMXYLOBVKSWGTH-LLVKDONJSA-N 293.363 2.205 10 10 CECE C[C@H](NCCc1nncs1)c1ccc(F)cc1O 2033510812 FCJCZGGVLMBJCE-QMMMGPOBSA-N 267.329 2.276 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](C)CC(N)=O)c(Cl)c1 2033933848 SGBCTVKMVZNYFH-RKDXNWHRSA-N 270.760 2.093 10 10 CECE COCCNCc1cnc(S[C@H]2CCO[C@H]2C)s1 2037795882 YUSFSGGBWCCWNF-ONGXEEELSA-N 288.438 2.149 10 10 CECE O=C(O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1cc(F)ccc1O 300438588 YZUXMWVQZUATDO-WFBYXXMGSA-N 279.311 2.216 10 10 CECE Cc1cc([C@H](O)c2ccc3c(c2)CCN3C)c(C)nn1 2157911701 YVTFENQWIJWXGI-MRXNPFEDSA-N 269.348 2.167 10 10 CECE CC[C@@H](N)Cc1ccc2ccn(CC[S@@](C)=O)c2c1 400564053 NKUZVPBCJYMXPW-AUUYWEPGSA-N 278.421 2.300 10 10 CECE CCNCc1ccc(N2C[C@@H](C)C[C@H](O)C2)c(C)c1 401492387 HOPYOLVRPJGUHZ-WFASDCNBSA-N 262.397 2.312 10 10 CECE Nc1ccc(CNC(=O)c2cccnc2Cl)cc1 700609701 QLNAIAGVRGIZCT-UHFFFAOYSA-N 261.712 2.247 10 10 CECE COC(C)(C)CN(C)[C@H](CN)c1ccc(N(C)C)cc1 404318572 XTTKZRDKTVJGJM-OAHLLOKOSA-N 279.428 2.109 10 10 CECE CN(C(=O)CN(C)c1ccc(CN)cc1)C1=CCCC1 2161264797 BTUROPMBBOVYMN-UHFFFAOYSA-N 273.380 2.108 10 10 CECE CCCN1CCN(c2ccc([C@@H](C)N)c(Cl)c2)CC1=O 2158783589 XCMFDISEGGSOCV-LLVKDONJSA-N 295.814 2.418 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](N(C)C)[C@@H]2C)cc1O 313148190 GNEFBXJLACIGQM-TYNCELHUSA-N 277.412 2.201 10 10 CECE COCC1CC2(CCN2c2ccc([C@@H](C)O)c(O)c2)C1 2160724500 OOYVTJOTWAUAAW-OPGSHWCFSA-N 277.364 2.451 10 10 CECE CC[C@@H]1CN[C@@H](c2nc(-c3ccc(O)c(O)c3)no2)C1 2159265400 VSYAOZNCIRDVMT-WCBMZHEXSA-N 275.308 2.208 10 10 CECE COCc1nn(C)cc1N[C@@H](C)c1c(O)cccc1O 2159303249 ANNLJMOZQJACQL-VIFPVBQESA-N 277.324 2.151 10 10 CECE Cc1cnc([C@@H](NN)c2ccc(N(C)C)cc2)c(C)c1 2161651177 XDALOUGXMXDCDT-INIZCTEOSA-N 270.380 2.317 10 10 CECE COc1cccc(CN[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)c1O 527803577 HAYLNOGZHKUYEA-MIJXAVMKSA-N 265.353 2.302 10 10 CECE CO[C@@H]1CC(F)(F)CC[C@@H]1NCc1ccc(O)c(O)c1 2162088812 CHGLNTZMWWJWKN-GXFFZTMASA-N 287.306 2.390 10 10 CECE COc1ccc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)cn1 701264735 WLGYRSMYXMBOGP-SNVBAGLBSA-N 261.285 2.005 10 10 CECE CN(CCOc1ccc(N)cc1)[C@@H]1CCCCC[C@@H]1O 2172540964 UQBZATMGZXMWLY-CVEARBPZSA-N 278.396 2.273 10 10 CECE Nc1ccc(NC(=O)CCOC[C@H]2CCCOC2)cc1 2172652146 SAQROEDRLGGSFU-LBPRGKRZSA-N 278.352 2.041 10 10 CECE CN(CC1CC(O)C1)c1ccc(CN)c(C(F)(F)F)c1 91450812 SGWTYYONOJANCP-UHFFFAOYSA-N 288.313 2.371 10 10 CECE C[C@@H]1CN([C@@H](CN)c2ccc3c(c2)CCN3C)C[C@@H]1C 92082565 IGWDWXKZIONNNI-AHIWAGSCSA-N 273.424 2.267 10 10 CECE CN(Cc1ccc(F)c(F)c1O)C[C@H]1CCOC1 703519933 WZNOEHXBHITVGX-SECBINFHSA-N 257.280 2.139 10 10 CECE C[C@@H](O)[C@H]1CCCCN1c1ccc(CN)c(F)c1F 688682876 DRHQNFDOQVWJJD-MWLCHTKSSA-N 270.323 2.163 10 10 CECE CCC(O)(CC)CN(C)c1cc(OC)c(OC)cc1N 706426518 RQNVIUMONSEESW-UHFFFAOYSA-N 282.384 2.273 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)C[C@H](C)CO 708443423 GFIZQUOUQRBXNT-LBPRGKRZSA-N 262.397 2.312 10 10 CECE C[C@@H](c1cn(C)cn1)N(C)C(=O)Nc1ccc(N)cc1 710136283 FEZMLCMOYWNCGR-JTQLQIEISA-N 273.340 2.227 10 10 CECE COc1ccc(O)c(CN=c2ccn(C(C)C)[nH]2)c1 388871439 HKQGGLWHBSRLGI-UHFFFAOYSA-N 261.325 2.212 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H]2[C@H]1CCCN2C 720465600 JXACBASGQGUORB-JKSUJKDBSA-N 260.381 2.160 10 10 CECE C[C@@H]1CCN([C@H](C)c2c(O)cccc2O)CCO1 720494740 JALPXSURBWNTIR-GHMZBOCLSA-N 251.326 2.270 10 10 CECE C[C@H](CN(C)c1cc2c(cc1N)OCC(=O)N2)C1CC1 2164454742 ORXMALSFEDYDDF-SECBINFHSA-N 275.352 2.082 10 10 CECE CN(C)c1ccc([C@@H](C[C@@H]2CC2(F)F)NN)cc1 691220969 NGZQDDGRKAZHDW-ZYHUDNBSSA-N 255.312 2.302 10 10 CECE CS[C@@H]1CCN(C(=O)CCOc2ccc(N)cc2)C1 382968327 STCHEDQSBINVBX-CYBMUJFWSA-N 280.393 2.002 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)CC1CC(F)(F)C1 383268115 YQCNKRCSCSADIZ-UHFFFAOYSA-N 283.322 2.184 10 10 CECE CN1CC[C@@H]2CN([C@H]3CCc4cccc(O)c43)C[C@H]2C1 383402547 ZFMPLNIHCOHWAZ-KFWWJZLASA-N 272.392 2.263 10 10 CECE Cc1ccc([C@@H](C)NCC[C@H](O)C(F)F)c(O)c1 716775366 UEOKFEVKLPSOKH-KOLCDFICSA-N 259.296 2.367 10 10 CECE COc1ccc(CN(C)[C@@H]2C[C@H](C)O[C@@H]2C)c(O)c1 384867948 FQDHDQLPBDDRJU-MISXGVKJSA-N 265.353 2.399 10 10 CECE Nc1ccc(CCCN[C@H]2CC23CCOCC3)cc1 387287416 NQDYJESIPNCQLW-HNNXBMFYSA-N 260.381 2.360 10 10 CECE NCc1ccc(N(CC(F)F)CC(F)F)cc1 719419165 QRDRYXLCVQRETI-UHFFFAOYSA-N 250.239 2.482 10 10 CECE CC[C@@H]1CCC[C@@H]1NC(=O)COc1ccc(N)cc1 388584134 GZDBOORBHNZEKD-RISCZKNCSA-N 262.353 2.343 10 10 CECE CC[C@@H](N)c1ccc(N2CCO[C@H](C(C)(C)O)C2)cc1 2174140258 GEZNGRUSUYOKAG-CABCVRRESA-N 278.396 2.073 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H]2[C@H](N(C)C)[C@H]2C1 394956488 LFALTLCNEOVGLU-JWFUOXDNSA-N 264.344 2.084 10 10 CECE COc1ccc(CNCCOC(F)(F)F)c(O)c1 398270741 UOOYDLXOLCWUSB-UHFFFAOYSA-N 265.231 2.027 10 10 CECE CCOC(=O)[C@H](CC)[C@@H](O)c1ccc2c(c1)CCN2C 2166968084 FLBURDSWBRUJOF-HIFRSBDPSA-N 277.364 2.302 10 10 CECE CCCN[C@H](c1ccccc1O)c1ncnn1CCC 2168033552 MSPYUXWGPXXEDR-CQSZACIVSA-N 274.368 2.483 10 10 CECE NCc1ccc(N2CCO[C@]3(CCCOC3)C2)c(Cl)c1 2168205291 OVGRTEQYAJSEQR-OAHLLOKOSA-N 296.798 2.185 10 10 CECE CNCc1ccc(N2C[C@H](C)O[C@@H](CCO)C2)c(Cl)c1 2179387162 MDUJZGFIUOBYFK-AAEUAGOBSA-N 298.814 2.036 10 10 CECE CCNC(=O)c1cc(C)nn1Cc1c(O)cccc1Cl 2070144621 MBDDWWUCLFYBDK-UHFFFAOYSA-N 293.754 2.349 10 10 CECE CCc1cc(CNC)n([C@@H](C)c2cc(OC)ccc2O)n1 2070171219 ZDWJFGFHIXGDOW-NSHDSACASA-N 289.379 2.488 10 10 CECE COc1cnn(Cc2ccc(O)cc2O)c1Br 2070289134 KHUMJKYOCGMTHQ-UHFFFAOYSA-N 299.124 2.114 10 10 CECE NC(=O)c1c(F)cccc1OCCc1ccc(N)cc1 2176331453 NESHVCSYYLIEMZ-UHFFFAOYSA-N 274.295 2.128 10 10 CECE CC(C)CN1CCO[C@@H](CN2CCC[C@H]2CN=[N+]=[N-])C1 2179615089 BNAFHUDLCVKSIK-UONOGXRCSA-N 281.404 2.118 10 10 CECE CN(C(=O)CN1CCC[C@@H]1CN=[N+]=[N-])c1ccccc1 2179616848 QAJDKLUFWPNTDV-CYBMUJFWSA-N 273.340 2.424 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](O)CC2(C)C)cc1O 2169875287 JISQBZRWSMTYGF-AAEUAGOBSA-N 278.396 2.412 10 10 CECE CCC(=O)N1CCN(Cc2cccc(Cl)c2O)CC1 1231909830 QWVCQMCFRIABSF-UHFFFAOYSA-N 282.771 2.100 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N1CCO[C@@H](CN(C)C)C1 2170343435 HIMNVFVIJMQFPF-YPMHNXCESA-N 298.814 2.369 10 10 CECE COc1ccc(CN2CCC[C@H]3COCC[C@H]32)c(O)c1 2170445174 XNWSNCYBHLYVSG-DZGCQCFKSA-N 277.364 2.402 10 10 CECE Nc1ccc(NC(=O)CSc2ncc3n2CCC3)cc1 2176924484 QGORKGIJWKHWRQ-UHFFFAOYSA-N 288.376 2.142 10 10 CECE CN1CCC2(CC1)CCN2CCCc1ccc(N)cc1 2170529179 PJBXGMFQTNFPEX-UHFFFAOYSA-N 273.424 2.372 10 10 CECE C[C@H](O)c1ccc(N2CCC(n3cncn3)CC2)cc1 2170680282 VKZXKYIPLCKVIL-LBPRGKRZSA-N 272.352 2.173 10 10 CECE NCc1ccc(N2CC(=O)N[C@@H]3CCCC[C@@H]32)c(Cl)c1 2171182045 NFOJWSQRZIFCCY-OCCSQVGLSA-N 293.798 2.046 10 10 CECE C[C@H](c1ccccc1O)N1CCO[C@H]([C@H]2CCOC2)C1 2171678937 RZRPYQGYQJULCS-WWGRRREGSA-N 277.364 2.191 10 10 CECE C[C@]1(NC(=O)c2cc(O)c(O)c(O)c2)CCC(F)(F)C1 2188921149 ANGCSUDCQGWDSX-LBPRGKRZSA-N 287.262 2.111 10 10 CECE NCc1ccc(N2CCOC[C@@H]2CF)c(C(F)(F)F)c1 2182596256 BIHCKFJBAGUQBK-JTQLQIEISA-N 292.276 2.339 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C[C@@H]2CCC3(CCOCC3)CO2)C1 2182652263 NGKXGMJAANIREQ-OLZOCXBDSA-N 280.372 2.347 10 10 CECE FC(F)COc1ccc(N2C[C@@H]3CNCC[C@H]3C2)cc1 2194292582 NTNOFEHKVVSMQK-RYUDHWBXSA-N 282.334 2.376 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H]4CC[C@@]4(CO)C3)ccc21 2198875938 GVKYXOFDLDANEC-XKQJLSEDSA-N 272.392 2.102 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@H]3C[C@@H]32)cc1Br 1906998918 DBBHNEFUZYCDPM-AQUOVQTQSA-N 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Cc1ccc(O)c([C@H](C)NOCCCN(C)C)c1 2044581033 MCPLOAZSMDZMHV-LBPRGKRZSA-N 252.358 2.235 10 10 CECE C[C@@H]1C[C@@](O)([C@@H](N)c2ccc(N(C)C)cc2)CS1 2044747771 IDFNTHFOAABXGP-SWHYSGLUSA-N 266.410 2.009 10 10 CECE Nc1ccc(NC(=O)N2C[C@H]3CCCC[C@H]3C2=O)cc1 2191525137 HRBMGBUQMJMFRT-ZWNOBZJWSA-N 273.336 2.449 10 10 CECE CC[C@@]1(C)CC(=O)N(C(=O)CCc2ccc(N)cc2)C1 2191652471 QXSMHZQPOSSZMC-INIZCTEOSA-N 274.364 2.377 10 10 CECE CNCc1ccc(N2CC[S@](=O)C[C@H]2C)c(Cl)c1 2051905334 KRTSZEIWAYDDRS-MGNBDDOMSA-N 286.828 2.017 10 10 CECE CCCOC1(C(=O)NCC2(CN=[N+]=[N-])CC2)CC1 2054033074 UJDLNZIMPKFXNP-UHFFFAOYSA-N 252.318 2.152 10 10 CECE CN(c1ccc(CN)c(F)c1F)[C@@]1(C)CCOC1 2055445587 XRZDOPDWFPCCEQ-ZDUSSCGKSA-N 256.296 2.039 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H](C)c2ccccc2O)nn1 2192597599 HHRPNUQDCJEXRE-QWRGUYRKSA-N 272.352 2.399 10 10 CECE C[C@H](NC(=O)[C@H]1CCCCC[C@@H]1N)c1ccccc1O 2192624986 WATMVTXXUOVHAY-UBHSHLNASA-N 276.380 2.477 10 10 CECE CC[C@@]1(C)C[C@@H](NCc2ccc(O)c(O)c2)CO1 2069117467 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CCn1nccc1CN[C@@H](C)c1ccc(O)cc1O 2094265453 VXSZMJMSTNCFIU-JTQLQIEISA-N 261.325 2.165 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@@H](N)C(F)(F)C1 2095261521 OVEKCHJZXSXYOC-QPUJVOFHSA-N 274.286 2.261 10 10 CECE COc1ccc(N2C3CCC2([C@H](C)O)CC3)c(N)c1 2097059792 JVOVWATXRFSAFM-NLTNOIMHSA-N 262.353 2.160 10 10 CECE COc1ccc(O)c(CN(C)[C@H]2CCC[C@@H](N)C2)c1 2099833954 QAGNYPUHNCENEH-OLZOCXBDSA-N 264.369 2.103 10 10 CECE CC[C@@H](c1ccccc1O)N1C[C@H](OC)C[C@H]1C(=O)O 2201059429 KQXUREBMPYSDIA-WXHSDQCUSA-N 279.336 2.017 10 10 CECE CP(C)(=O)CCC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2213589991 JNGOOUTVTAWJQG-BDAKNGLRSA-N 258.262 2.347 10 10 CECE CCNCc1ccc(N(C)[C@H]2CCO[C@@H]2C)cc1OC 2204550370 RDPJCGZEDLVARD-DOMZBBRYSA-N 278.396 2.418 10 10 CECE COc1cc(N(C)C[C@H]2CC[C@@H](OC)C2)ccc1CO 2204557415 PHGLNONNHJPQEP-SWLSCSKDSA-N 279.380 2.439 10 10 CECE COc1ccc(N2CC3(CC(O)C3)C2)cc1Cl 2214336540 KVPOGZKZFYTWPR-UHFFFAOYSA-N 253.729 2.310 10 10 CECE O=C(O)[C@H]1C[C@@]12CCCN(Cc1ccc(F)cc1O)C2 2204636957 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COC[C@H]1CCCN(c2ccc(OC)cc2C=O)C1 2227695020 FJWUUUABGIHGTI-LBPRGKRZSA-N 263.337 2.371 10 10 CECE CC[C@@H]1COCCN(c2ccc(OC)cc2C=O)C1 2227706949 RUNFFVSRFMQCLG-LBPRGKRZSA-N 263.337 2.371 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1CC([S@](C)=O)C1 2240015181 VEUIIJAMZJSXNC-FQEVSTJZSA-N 292.448 2.204 10 10 CECE CCCOc1ccc(N2CCC(OCCN)CC2)cc1 2281459534 UKOGURQFDPHJOF-UHFFFAOYSA-N 278.396 2.420 10 10 CECE CCN(Cc1cnnn1C)c1ccc([C@H](C)N)cc1C 2240742548 KWWKJCNHPGNJIZ-LBPRGKRZSA-N 273.384 2.170 10 10 CECE CSc1ncc(CNC[C@@]2(CCF)CCNC2)s1 2257126867 LNVDSEPLLMBRMI-LBPRGKRZSA-N 289.445 2.294 10 10 CECE Cc1cc(N(C)CC(F)(F)CO)ccc1[C@H](C)N 2257458653 UGJNIAXHAFSOMV-JTQLQIEISA-N 258.312 2.079 10 10 CECE CSc1ncc(CN2CC[C@H](NC(C)C)C2)s1 2248700596 MHLSKHLFBVIKDJ-JTQLQIEISA-N 271.455 2.437 10 10 CECE COc1cc(OC)c(N2CC(O)(C3CC3)C2)cc1Cl 2270360720 QACGDJHSXVXAGG-UHFFFAOYSA-N 283.755 2.318 10 10 CECE CC(F)(F)c1ncc(C(=O)N2CC(N=[N+]=[N-])C2)s1 2260726889 IFAQOXQSDBIRMU-UHFFFAOYSA-N 273.268 2.390 10 10 CECE C[C@H](CCNCc1cccc(O)c1O)OC(F)F 2261330437 XEGWTOYYCPDVSC-MRVPVSSYSA-N 261.268 2.205 10 10 CECE CN1CCc2cc([C@H](N)C34COCC(C3)C4)ccc21 2273106128 DJMSVXSSZGXDAH-AJQRCPHMSA-N 258.365 2.105 10 10 CECE Cc1ccc(OCc2ccc(N)cc2)c(C(=O)O)n1 2265166724 SGHWAYXEKVWSHI-UHFFFAOYSA-N 258.277 2.249 10 10 CECE CN[C@@H](C)c1ccc(N2CC3(C=CCO3)C2)cc1C 2269658045 DJDOTIOTOBNIKK-ZDUSSCGKSA-N 258.365 2.421 10 10 CECE CS(=O)(=O)[C@H]1C[C@H](Cn2ccc3cc(N)ccc32)C1 2269832519 JQKVFNIIWXOHSV-MJHDQNEOSA-N 278.377 2.047 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(C[S@](C)=O)C2)cc1C 2285138876 MOZSFMAUUGBIBT-RBZFPXEDSA-N 294.464 2.480 10 10 CECE Cc1cc(N(C)C[C@H]2OCCO[C@H]2C)ccc1[C@@H](C)O 2285171041 HGEUAFQAGPKFEH-DVOMOZLQSA-N 279.380 2.288 10 10 CECE Cc1cc(N(C)[C@@H](C)[C@H](C)S(C)(=O)=O)ccc1[C@H](C)O 2285165496 QMOXNIHTAZJAIR-AVGNSLFASA-N 299.436 2.306 10 10 CECE COc1ccc(N2C[C@H]3C[C@H]2CC[C@H]3O)c(OC)c1C 2295378542 QMFBGCINHIPRIR-YRGRVCCFSA-N 277.364 2.362 10 10 CECE Nc1ccc(NC(=O)CC[S@](=O)C2C[C@H]3C[C@@H]3C2)cc1 2285665758 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2.042 10 10 CECE CCOc1ccc(CN[C@H]2C[C@H](OCC)C2)c(O)c1 850360699 NDJJLWKELZCBBN-MQMHXKEQSA-N 265.353 2.448 10 10 CECE C[C@H]1C[C@@H](CNC(=O)NCc2c(O)cccc2F)CCO1 921760348 QEHBIYIYEQVNBK-QWRGUYRKSA-N 296.342 2.146 10 10 CECE C/C=C(/C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855232406 SUYMXCHDETYGPS-VEIWZVCTSA-N 274.364 2.356 10 10 CECE C[C@H](NCCCCN(C)C)c1ccc(O)cc1O 45663444 HVEAUVQFQHOVDQ-NSHDSACASA-N 252.358 2.090 10 10 CECE CCO[C@H](C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1)C(C)C 860697554 ZMBUELYTJBGEGQ-NHYWBVRUSA-N 295.379 2.206 10 10 CECE Cc1cc(C)c([C@@H](C)NC[C@@]2(CCO)CCOC2)c(O)c1 788633825 VADPXSDPMQFCLG-RHSMWYFYSA-N 293.407 2.449 10 10 CECE CC[C@H]1CN(COC)c2cc(OC)c(OC)cc2N1 76929943 UYVJRXLRZWMOKN-JTQLQIEISA-N 266.341 2.318 10 10 CECE COc1cc2c(cc1OC)N(CCCC(=O)O)C[C@H](C)N2 76928153 UKLOSBOWAXBJLN-JTQLQIEISA-N 294.351 2.189 10 10 CECE CS(=O)(=O)[C@H]1CCC[C@@H](Oc2ccc(N)cc2)C1 94634113 PVJGAAJHMLYBDJ-OLZOCXBDSA-N 269.366 2.003 10 10 CECE CC(C)(C)c1ccc([C@@H](NCCN=[N+]=[N-])C(N)=O)s1 166163086 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10 10 CECE CC12CCOC(CNCc3cccc(O)c3O)(C1)C2 1879287030 XQYMEOOZTJEYJG-UHFFFAOYSA-N 263.337 2.147 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H]3CCO[C@@H]3C2)c(F)c1 1880924275 PSPMOUTUYFSGNU-MWODSPESSA-N 268.307 2.210 10 10 CECE [N-]=[N+]=NCCNC(=O)c1ncc(Cl)cc1Cl 1963809354 QDTQAVXBDOHCKM-UHFFFAOYSA-N 260.084 2.429 10 10 CECE C[C@@H](NCc1nncs1)c1cc(F)ccc1O 1945677660 LTUCEJCPJRSIEQ-SSDOTTSWSA-N 253.302 2.234 10 10 CECE NC[C@]12CCC[C@@H]1CCN2Cc1c(O)cccc1F 1889606695 YHHHMCQTNBLYOO-IAQYHMDHSA-N 264.344 2.235 10 10 CECE Oc1cccc(CNCc2cnn3ccccc23)c1O 2144351378 YUDAAHNHTMMRPV-UHFFFAOYSA-N 269.304 2.035 10 10 CECE CCCCS(=O)(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 1949750019 XCUSBJCEGQYOIM-SNVBAGLBSA-N 260.363 2.281 10 10 CECE CC[C@@H](C)[C@H](C(=O)O)N(C)Cc1ccc(F)cc1O 1964727711 LFSZPZHPTKBUQJ-NOZJJQNGSA-N 269.316 2.462 10 10 CECE N[C@@H](c1ccccc1O)[C@@]1(O)CCc2cc(F)ccc21 2148158859 BXTMBBHLWNTXLO-JKSUJKDBSA-N 273.307 2.365 10 10 CECE C[C@@H]1OC2(C)CC1(C(=O)NCCCCN=[N+]=[N-])C2 1964943051 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CCOC(=O)C[C@H]1Cc2cc(OC)ccc2N(C)C1 261064063 MGBKMUUNUSXYSV-LLVKDONJSA-N 263.337 2.257 10 10 CECE COC(=O)CCCN[C@H](C)c1ccc(OC)cc1O 37415820 OFMFKKUPWWKTFI-SNVBAGLBSA-N 267.325 2.005 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CCC[C@@H]3C)ccc21 37911158 TWCTTXUSPVGQJD-IINYFYTJSA-N 259.353 2.278 10 10 CECE C[C@H](CNCc1ccc(O)cc1O)N1CCCCC1 38028623 DRDRXNUYEIOQJW-GFCCVEGCSA-N 264.369 2.062 10 10 CECE COc1cccc(O)c1CN[C@H]1CC[C@H]1SC 1997933992 ZZOCWWOQQQFGIK-GXFFZTMASA-N 253.367 2.384 10 10 CECE CCCNCc1ccc(N(C)CC(=O)NCC)c(Cl)c1 163999788 LZWOXCYJTHRYSY-UHFFFAOYSA-N 297.830 2.412 10 10 CECE COc1ccc(CN2CCC[C@H]3OCC[C@H]3C2)c(O)c1 2151877464 IOIBWQNVXBTXAV-XJKSGUPXSA-N 277.364 2.402 10 10 CECE CCCSC[C@@H](NN)c1ccc(N(C)C)cc1 1999527270 LHSQZPWTGXVDAH-CYBMUJFWSA-N 253.415 2.400 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)c1ccc(=N)[nH]c1 2152588477 NPZRPANUTIZWJX-SNVBAGLBSA-N 271.320 2.033 10 10 CECE C[C@H](O)c1ccc(N2CC=C[C@@H](O)C2)c(Cl)c1 2000825591 UJKNEXWHFMWTDE-GXSJLCMTSA-N 253.729 2.130 10 10 CECE CN(C(=O)C[S@@](=O)c1cccs1)c1ccc(N)cc1 40967969 JKNHMIHLLWRBLI-IBGZPJMESA-N 294.401 2.101 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCN2C)C12CC(CO1)C2 2153221484 CQKLZCUZARRBBE-RFSCMCKOSA-N 272.392 2.336 10 10 CECE Nc1ccc(OCCC(=O)N2CC[C@@H]2CC2CC2)cc1 2154073095 LEEYBKWSWJZEPV-CQSZACIVSA-N 274.364 2.439 10 10 CECE C[C@H](CNCc1cccc(Cl)c1O)c1ncon1 2027377235 IKKIHNLOHYSNPG-MRVPVSSYSA-N 267.716 2.322 10 10 CECE NN[C@H](CC[C@@H]1CCCCO1)c1ccccc1O 2029557173 ZJNZEJMUDIIQHB-WCQYABFASA-N 250.342 2.246 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H](F)[C@@H](OC)C2)cc1 2029819398 XFZBNOPDPBNSMK-IHRRRGAJSA-N 252.333 2.270 10 10 CECE CNCc1ccc(N2C[C@@H](F)[C@H](OC)C2)c(Cl)c1 2029815624 WQGKGJVIIFRNCH-DGCLKSJQSA-N 272.751 2.233 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)C3(CC3)C2)cc1Cl 2032397724 NVBDDUUOKASXEJ-RNCFNFMXSA-N 267.756 2.354 10 10 CECE CNCc1ccc(N2CC[C@H]3[C@H](C2)C3(F)F)cc1 2034644529 RKBLQXVNQIECAJ-STQMWFEESA-N 252.308 2.497 10 10 CECE C[C@@H]1CN(C(=O)CCc2ccc(N)cc2)C[C@@H]1F 2035306456 GDOGZCJIRJZFQC-MFKMUULPSA-N 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CCCC1([C@@H](NCCN=[N+]=[N-])C(=O)OC)CCC1 686124930 DADDQNNJSBHKIN-JTQLQIEISA-N 254.334 2.398 10 10 CECE Cc1ccc(O)c([C@H](C)N(C)C[C@@H]2CCCS2(=O)=O)c1 710646719 TZRXDZIPMWUPEJ-STQMWFEESA-N 297.420 2.271 10 10 CECE C[C@H](NC(=O)Nc1ccc(N)cc1)[C@H]1CCCCO1 379186679 RQEASUPWBKDLTC-GXFFZTMASA-N 263.341 2.348 10 10 CECE NC1(c2ccc(N3CCCC3)cc2)C[C@H]2COC[C@@H]2C1 2163111965 XTHHOKWNNNZOGO-KBPBESRZSA-N 272.392 2.497 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)C[C@H]2CCCC[C@H]21 712412746 CPRMCXNZKPKLDF-CKYFFXLPSA-N 252.318 2.310 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4CCC[C@@H]43)ccc21 381187928 IEBDYHADTFWXLC-IIMNLJJBSA-N 257.337 2.017 10 10 CECE CN(C)c1ccc([C@H](O)CC2CCS(=O)(=O)CC2)cc1 692408906 WCCFBBQHHLTXFZ-OAHLLOKOSA-N 297.420 2.001 10 10 CECE Cc1cc(N(C)CCC(N)=O)ccc1CNCC(C)C 381998390 PITXBNHHXSJERQ-UHFFFAOYSA-N 277.412 2.052 10 10 CECE CNC1CCN(Cc2c(O)cccc2Cl)CC1 383930576 BSFVIJBBEGDUBC-UHFFFAOYSA-N 254.761 2.229 10 10 CECE C[C@@H]1C[C@H](O)CN1c1ccc(CN)cc1C(F)(F)F 384806301 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1626837962 LOCZTCQGNSPDDZ-UHFFFAOYSA-N 275.279 2.475 10 10 CECE CCNCc1ccc(N2CC[C@H](O)[C@@H](C)C2)cc1C 229403872 DKKUHFNWNXKSEM-BBRMVZONSA-N 262.397 2.312 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1cccc2c1OCO2 1632760989 LZLXPKCBQBBLDI-UHFFFAOYSA-N 287.271 2.008 10 10 CECE CCCOc1cc(N(CCO)CC(F)(F)F)ccc1N 231309747 AJGIOLDOHUHTPX-UHFFFAOYSA-N 292.301 2.419 10 10 CECE Cc1nc(CN[C@H](C)c2ccc(F)cc2O)no1 231769398 ZGBHMXVBCIZPPT-SSDOTTSWSA-N 251.261 2.074 10 10 CECE CSc1ncc(CN[C@@H](C)c2cc[nH]n2)s1 2243833033 POHATQKBXJXOLW-ZETCQYMHSA-N 254.384 2.439 10 10 CECE CC[C@H](CO)CN(C)c1c(C)cc(OC)cc1OC 259057843 SRIUJWARVADWTQ-LBPRGKRZSA-N 267.369 2.467 10 10 CECE Nc1ccc(O)c(CNc2ccc3c(n2)CCC3)c1 134310052 OMTXBPUISDENMT-UHFFFAOYSA-N 255.321 2.470 10 10 CECE CC(C)OCCO[C@H](C)C(=O)Nc1ccc(N)cc1 19272751 WSCQOTMOHGMASL-LLVKDONJSA-N 266.341 2.037 10 10 CECE Oc1c(F)cccc1CNc1ccc(-n2cnnn2)cc1 164932819 JPVCLBOWHCUKRU-UHFFFAOYSA-N 285.282 2.119 10 10 CECE Cc1cccc(CNC(=O)CC(C)(C)[C@@H](C)N)c1O 2139760292 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C[C@H](O)c1cc(F)c(N(C)[C@H]2COC[C@H]2C)c(F)c1 1880485743 LOBZRCNCOWQHTQ-ZDMBXUJBSA-N 271.307 2.489 10 10 CECE COC1(CF)CN(c2c(F)cc([C@@H](C)O)cc2F)C1 1880477950 AZINAWFVVQFENP-MRVPVSSYSA-N 275.270 2.193 10 10 CECE COc1sccc1[C@@H](NN)c1ccccc1O 1946715291 KDCASPADGQSVMC-NSHDSACASA-N 250.323 2.015 10 10 CECE CCN[C@H](C)c1cc(F)c(N2C[C@@H](O)[C@@H]2C)c(F)c1 1880925363 BGYJDUNHQDVQIS-VYUIOLGVSA-N 270.323 2.205 10 10 CECE Oc1cc(Cl)ccc1CNC[C@@H]1CN2CCC1CC2 1308965277 CVMYAMDJMCIHIR-CYBMUJFWSA-N 280.799 2.477 10 10 CECE Cc1ccc(O)c([C@@H](C)N2C[C@H]3C[C@]3(C(=O)O)C2)c1 1902395451 KWGLPICJTZWLEE-HFAKWTLXSA-N 261.321 2.168 10 10 CECE CCCN1CC[C@H](NCc2c(O)cccc2F)C1 1964081016 ZIFCFBWRJCGCMX-NSHDSACASA-N 252.333 2.105 10 10 CECE Cc1cccc(O)c1CNCC1CC2(CC[C@H]2O)C1 1882897957 SVYXVMBUIVCWOZ-DSSZZKGTSA-N 261.365 2.341 10 10 CECE CO[C@H]1CCN(c2ccc(CN)cc2F)[C@@H]1C1CC1 1882981277 KRSBNNLXDREEKY-LSDHHAIUSA-N 264.344 2.288 10 10 CECE Nc1ccc(OCC(=O)NC2CCCCCC2)cc1 38055414 GVMFTLGSKLRUIV-UHFFFAOYSA-N 262.353 2.487 10 10 CECE CC(C)(C)OC(=O)NCc1cc([N+](=O)[O-])ccc1O 1887505613 MRMVNARMVWAKOI-UHFFFAOYSA-N 268.269 2.325 10 10 CECE Oc1cc(F)ccc1CNCc1cnn2ccccc12 1964601063 PDAASTJLDVOIMY-UHFFFAOYSA-N 271.295 2.469 10 10 CECE Cc1ccc([C@H](C)NC[C@@H]2C(=O)NCC[C@@H]2C)c(O)c1 1967512277 JZUVRNVYYDNYIK-OBJOEFQTSA-N 276.380 2.123 10 10 CECE COc1ccc(O)c(CNCC23CC(C2)C(C)(C)O3)c1 1967857024 XYRCNUXMYRJJJD-UHFFFAOYSA-N 277.364 2.448 10 10 CECE CO[C@H]1C[C@@H](CC(=O)N(C)Cc2ccccc2O)C1 1968865562 NOIVZLFZMBUCNA-BJHJDKERSA-N 263.337 2.166 10 10 CECE CN[C@@H](CCCCOC)[C@H](O)c1ccc(N(C)C)cc1 2147769391 ONWNJOFGJWXHIW-JKSUJKDBSA-N 280.412 2.191 10 10 CECE CC[C@H](C)N(CCOC)c1cc2c(cc1N)OCCO2 42578367 XDDITVXDGGUKDX-NSHDSACASA-N 280.368 2.291 10 10 CECE CC[C@H](N)c1ccc(N2CCO[C@@H](CCOC)C2)cc1 2148075642 ZLTWKCAGJIYWGK-HOTGVXAUSA-N 278.396 2.338 10 10 CECE C[C@H](NCC12CCN(CC1)CC2)c1cc(O)ccc1O 2145169449 FEICGTPGILDABU-LBPRGKRZSA-N 276.380 2.234 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CC[C@@H]2[C@@H](C1)C2(F)F 2148162947 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KJNXXBGFUSSRRJ-KGLIPLIRSA-N 257.337 2.017 10 10 CECE Oc1c(F)cc(F)cc1CN1CCO[C@H](CCF)C1 708386501 VHDFPJWKQWLCPR-LLVKDONJSA-N 275.270 2.231 10 10 CECE C[C@@H]1CN(c2ccc([C@@H](C)O)cc2Cl)C[C@H]1CO 708639861 GYOBNELOXHDGRP-FOGDFJRCSA-N 269.772 2.458 10 10 CECE CCCOc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 388868378 DZQZEEZUYVWSHP-UHFFFAOYSA-N 266.297 2.220 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H]([C@H]3CCCO3)C2)cc1 2171771420 IRLYPYBHFWYIRD-DAXOMENPSA-N 276.380 2.091 10 10 CECE CN(C)c1ccc([C@H](N)c2ccc(N(C)C)nc2)cc1 383217800 MIFPRTYKXQIULH-INIZCTEOSA-N 270.380 2.262 10 10 CECE Oc1cc2c(cc1CNC1C3(CC3)C13CC3)OCO2 715304909 RQUZHELQAJFIJN-UHFFFAOYSA-N 259.305 2.153 10 10 CECE COCCNCc1ccc(N2C[C@H](O)C[C@@H]2C)c(Cl)c1 384777921 JQKKYDYWHZAWNI-WCQYABFASA-N 298.814 2.036 10 10 CECE COCC(COC)N(c1ccc(CN)cc1)C(C)C 385065638 VIVGTMGAPYDLPL-UHFFFAOYSA-N 266.385 2.022 10 10 CECE C[C@@H](N(C)CC(=O)N(C)c1ccc(N)cc1)C(C)(F)F 2178858851 WBWVUWZAMCSQBW-SNVBAGLBSA-N 285.338 2.207 10 10 CECE CCN1CCC(O)(c2ccc3c(c2)CCCN3C)CC1 2163090850 ALUHDCCWQAVTFV-UHFFFAOYSA-N 274.408 2.372 10 10 CECE C[C@H]1CNC[C@](O)(c2ccc(N3CCCCC3)cc2)C1 2163104890 HCOSVOWSAMNLHK-PBHICJAKSA-N 274.408 2.494 10 10 CECE CC(C)CNCc1ccc(N2CC[S@@](=O)[C@H](C)C2)cc1 2171968488 IVWXCOODNKQHLT-JLTOFOAXSA-N 294.464 2.389 10 10 CECE COc1ccc(O)c(CNC2CCC(CO)CC2)c1 387985881 IMKREGTXEMXGPB-UHFFFAOYSA-N 265.353 2.042 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](C)[C@@H](O)C2)c(F)c1 387985672 RRAYRLNYTGNCQI-RWSFTLGLSA-N 266.360 2.313 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](O)C(C)(C)C2)c(F)c1 388282744 QAESNYNONBHJGY-NOZJJQNGSA-N 252.333 2.053 10 10 CECE C[C@@H]1CC[C@@H](C(=O)O)[C@H](c2ccc3c(c2)CCN3C)N1 2176731804 BRRVGPUNIBYOKH-YVLXSGLVSA-N 274.364 2.193 10 10 CECE C[C@H](NCc1ccc(O)nn1)c1ccc(N(C)C)cc1 391437701 KWTBSGJSUGNKPU-NSHDSACASA-N 272.352 2.099 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@H]2CN(C)CC3)cc1 394246923 XJZZFPILNZEYBI-HOTGVXAUSA-N 259.397 2.079 10 10 CECE CC[C@@]1(C)CCN(c2ccc3c(c2)N(C)C(=O)[C@H]3N)C1 399391147 KGHGRJAYPVNWLV-HOCLYGCPSA-N 273.380 2.289 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2COC3(CCCC3)C2)cc1 2178942395 ONJDTXYDTIZYSL-AWEZNQCLSA-N 274.364 2.029 10 10 CECE COc1cccc(O)c1[C@H](C)NC[C@@H]1CCCO1 2064011966 VGHLYCWIJHYELM-QWRGUYRKSA-N 251.326 2.230 10 10 CECE CNCc1cnn(Cc2cccc(C(F)(F)F)c2O)c1 2069881920 LZLVOFPQVACQRQ-UHFFFAOYSA-N 285.269 2.375 10 10 CECE Cc1cc(CO)n(Cc2cccc(Br)c2O)n1 2070082217 KDMOECFXDZYGRD-UHFFFAOYSA-N 297.152 2.200 10 10 CECE Oc1cc(Br)n(Cc2cccc(F)c2O)n1 2070298257 OZZSHIKKFIXTCW-UHFFFAOYSA-N 287.088 2.244 10 10 CECE Oc1cc(Br)n(Cc2cc(F)ccc2O)n1 2070298903 WDMRPHZDULPFGC-UHFFFAOYSA-N 287.088 2.244 10 10 CECE CNCc1ccc(N2CC(C)(CCN(C)C)C2)c(F)c1 2179884537 UILQTJUCKQLPBC-UHFFFAOYSA-N 279.403 2.323 10 10 CECE COc1cc(N)c(N(C)[C@H]2CC[C@H](OC)C2)cc1OC 2187267229 HTGDNHYQWISJEH-QWRGUYRKSA-N 280.368 2.290 10 10 CECE Oc1ccc(CNCc2ccc3n[nH]cc3c2)c(O)c1 2187363369 JZASGZDZAIMMOY-UHFFFAOYSA-N 269.304 2.264 10 10 CECE Cc1cc(CNC2CC2)ccc1OC[C@H]1COC(=O)C1 2187686114 BMWPSVGKOKDRDF-ZDUSSCGKSA-N 275.348 2.189 10 10 CECE O=[N+]([O-])c1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)cc1CO 2192285547 GKZDVUAMAFRFKQ-IAZYJMLFSA-N 284.262 2.034 10 10 CECE C[C@@H](Nc1cc(C(N)=O)ccc1N)c1ccccc1O 2192623553 CHSHVMPLFVNYQN-SECBINFHSA-N 271.320 2.246 10 10 CECE Oc1ccnc(NCc2ccc(N3CCCC3)cc2)n1 2192637215 NXNXDKLTULFGMP-UHFFFAOYSA-N 270.336 2.395 10 10 CECE CCNCc1ccc(N2C[C@H](O)[C@H]2C)c(C(F)(F)F)c1 2182523897 QCNDEFVMGQZHNK-RNCFNFMXSA-N 288.313 2.384 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C2)O3)cc1Cl 1910356133 VPEDTBXFZQQAGT-IEBDPFPHSA-N 252.745 2.337 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@H]3COC[C@@H](C3)C2)c1 2188989092 MHVPETQSNSMWHJ-STQMWFEESA-N 275.348 2.063 10 10 CECE C[C@@H](N)c1ccc(N2CC(O)(c3cccs3)C2)cc1O 2193351769 XBAHMWGZYSDZTD-SNVBAGLBSA-N 290.388 2.181 10 10 CECE NN[C@@H](c1ccc(N2CCCC2)cc1)C(F)(F)F 2044731304 VAVVMFMVFXKAEQ-NSHDSACASA-N 259.275 2.354 10 10 CECE CCN[C@H]1CCc2cc(N3CC4(CC[C@@H]4O)C3)ccc21 2184726846 MCNGCJHGVIKSDC-HOTGVXAUSA-N 272.392 2.245 10 10 CECE C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2c1ccc2c(c1)CC[C@@H]2N 2184740663 XPJQJKMRSSBLPU-FNVYMHBWSA-N 272.392 2.371 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H](Cn3ccnc3)C2)c1O 2184787753 YVWTUQHHMHMIOH-OTVXOJSOSA-N 271.364 2.466 10 10 CECE Cc1cccc(O)c1CNC[C@H]1C[C@@H](n2cncn2)C1 2184902644 ANBYBMXYACNBSM-BETUJISGSA-N 272.352 2.033 10 10 CECE Cc1ccc([C@H](C)N2CC[S@](=O)[C@H](C)C2)c(O)c1 2051937079 YYLURZHIHXGNIF-SOZUMNATSA-N 267.394 2.214 10 10 CECE NCC(F)(F)[C@H]1CCCCN1Cc1c(O)cccc1F 2185162452 RXTUDWDYTJJBCK-CYBMUJFWSA-N 288.313 2.480 10 10 CECE Nc1ccc(OCC(=O)O[C@@H]2CCC[C@@H]2F)cc1 2055286993 RAIDEGOWJKCHLZ-NWDGAFQWSA-N 253.273 2.081 10 10 CECE CC[C@H]1CN(Cc2c(O)cccc2OC)[C@@H](C)CO1 2104436819 CHJQBEVHEMPZRA-RYUDHWBXSA-N 265.353 2.400 10 10 CECE C[C@H]1CCO[C@@H]1CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2059060935 ZKLXRMCSQAEXLJ-HBNTYKKESA-N 252.318 2.103 10 10 CECE CC[C@](C)(CN(C)Cc1cc2c(cc1O)OCO2)OC 2186323389 RWONKBLBAZETIW-OAHLLOKOSA-N 281.352 2.368 10 10 CECE Cc1nn[nH]c1CNCc1c(C)c2ccccc2n1C 2186475266 LSHHGMGLTQDZMX-UHFFFAOYSA-N 269.352 2.203 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3COC[C@H]32)cc1Cl 2066308470 HRMRZXQTSUSPRR-ISTVAULSSA-N 266.772 2.455 10 10 CECE COCCN(Cc1c(O)cccc1F)[C@H]1CCCOC1 2197185276 FKKIWRZNFDXRHI-LBPRGKRZSA-N 283.343 2.159 10 10 CECE CC[C@H](COC)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2073172108 GCRPHWXVIYDPNQ-MNOVXSKESA-N 254.334 2.350 10 10 CECE C[C@@H]1CCN(Cc2ccc(O)cc2O)[C@H](C)[C@H]1C(=O)O 2200600834 BBJFPMLDBDYBLJ-RULNRJAQSA-N 279.336 2.029 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H]2CC[C@@H]3O2)cc1O 2198715994 FXRWGAGXMDCLMT-QEAVUDMASA-N 274.364 2.311 10 10 CECE CCNCc1ccc(N2C[C@H]3CC[C@@]3(CO)C2)c(C)c1 2198882387 SPAVOLNZUPTJTI-WBVHZDCISA-N 274.408 2.313 10 10 CECE C[C@H](O)c1ccc(N2CCC(F)(CO)CC2)c(F)c1 2101305975 IMKIFLAJEBFGOW-JTQLQIEISA-N 271.307 2.180 10 10 CECE C[C@H](c1ccccc1O)N1CC[C@H]2CCN(C)[C@H]2C1 2102329434 GGHLZFZTDPSALH-NFAWXSAZSA-N 260.381 2.479 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C[C@]12CO[C@](CF)(C1)C2 2082655124 GUQBUEVXCQFUQI-SDDRHHMPSA-N 254.309 2.280 10 10 CECE C[C@@H]1C[C@H](CC(=O)N2CCC[C@H](CN=[N+]=[N-])C2)CO1 2103188421 WVQIYFZDBAJIPJ-IJLUTSLNSA-N 266.345 2.350 10 10 CECE COc1cc(N2CCC(F)(F)[C@@H]2C)ccc1CN 2084017992 XWUNWVRVYAYWBX-VIFPVBQESA-N 256.296 2.388 10 10 CECE C[C@@H]1CCO[C@@H]1CCNCc1ccc(F)cc1O 2084178280 ADFWOYIDUVNDRE-QMTHXVAHSA-N 253.317 2.436 10 10 CECE Cc1cccc(O)c1CN1CCOC[C@H]1C(F)(F)F 2104475480 FDKIDYQQECKVHW-LBPRGKRZSA-N 275.270 2.464 10 10 CECE C[C@@H]1CC[C@H]1N(C)[C@H](C)C(=O)Nc1ccc(N)cc1 2105657165 HEDSSLLURGCJGL-JTNHKYCSSA-N 261.369 2.326 10 10 CECE CCCn1ccnc1NCCOc1ccc(N)cc1 2106181959 CAHNUJGJHQZLBO-UHFFFAOYSA-N 260.341 2.366 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H](N)C2CC(F)(F)C2)cc1 2106793875 RJEIVRIINPWJIY-CHWSQXEVSA-N 270.323 2.159 10 10 CECE Cc1ncn(C[C@H](N)c2ccc(N(C)C)cc2)c1C 2106797418 AOAHKTKFVZKUKO-HNNXBMFYSA-N 258.369 2.266 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3NCC[C@H]3C)ccc21 2106804527 CGCDNXDJPWNCJQ-LYRGGWFBSA-N 260.381 2.100 10 10 CECE CC(C)OC(C)(C)[C@H](NN)c1ccc(N(C)C)cc1 2106855443 OISTUVMXSCJZGI-CQSZACIVSA-N 265.401 2.461 10 10 CECE CN1CCCc2cc([C@@]3(O)CCC[C@H]3CN)ccc21 2106831205 OGSBBMHNKXVWID-HOCLYGCPSA-N 260.381 2.015 10 10 CECE CC1CC([C@@H](O)[C@H](N)c2ccc3c(c2)CCN3C)C1 2106850398 IIEXWUHZKQTPEF-LWXRVASPSA-N 260.381 2.086 10 10 CECE C[C@@](O)(C(F)F)[C@@H](N)c1ccc(N2CCCC2)cc1 2106948072 MAVSPKVYXJUSJX-JSGCOSHPSA-N 270.323 2.303 10 10 CECE CCOc1cccc(CN2CCC[C@](C)(N)C2)c1O 2087762601 BDLCIRMMUOYNAD-HNNXBMFYSA-N 264.369 2.104 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H]2COCC[C@H]21 2088706477 LBXHZCOBKVVKPM-GRYCIOLGSA-N 263.337 2.270 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(CCN2C[C@H]3CC[C@H]2C3)C1 2109593748 FBIUCRGRDJQNBF-IHRRRGAJSA-N 263.389 2.493 10 10 CECE Oc1cccc(CNC[C@H]2CC3(CCC3)CO2)c1O 2110084906 LBAZNRZDLZFZEL-GFCCVEGCSA-N 263.337 2.147 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3CC4(CC4)CO3)ccc21 2110137526 CCCXMIGVVAKAIB-LSDHHAIUSA-N 258.365 2.248 10 10 CECE NN[C@H](C[C@@H]1CC2(CCC2)CO1)c1ccccc1O 2110244395 UJEFWTMUYUCPEJ-DGCLKSJQSA-N 262.353 2.246 10 10 CECE NC(=O)[C@H]1CCC[C@H](NCc2ccc(Cl)cc2O)C1 2090123317 BJSWKTMZBADAGD-CABZTGNLSA-N 282.771 2.179 10 10 CECE Oc1ccc(CNCC2CCC(F)CC2)c(O)c1O 2093052758 CPDMIPIUGHYYQK-UHFFFAOYSA-N 269.316 2.421 10 10 CECE C[C@@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@@H](N)C2 2094908939 JPIQWPDFLSMRMR-FIQHERPVSA-N 262.353 2.113 10 10 CECE COCCCCC[C@@H](NN)c1ccc(N(C)C)cc1 2099284189 ZSKZWUBBTFLJGE-OAHLLOKOSA-N 265.401 2.464 10 10 CECE CC[C@@H]1C[C@@H]1[C@H](O)[C@H](N)c1ccc2c(c1)CCCN2C 2199897481 VRSJIOXIKNTFLR-HWHUXHBOSA-N 274.408 2.476 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1C1CCOCC1 2200161206 QBCJFHBVKADNCB-FRRDWIJNSA-N 278.356 2.350 10 10 CECE O=C(O)C1[C@@H]2CC(NCc3ccc(Cl)cc3O)C[C@@H]12 2112935976 YQMATJKYOLSVCG-QRVCZOOMSA-N 281.739 2.244 10 10 CECE CCCN1CCCN(c2ccc(OC)cc2N)CC1 2113698695 AZNHBZZFKUACMB-UHFFFAOYSA-N 263.385 2.200 10 10 CECE C[C@H]1CN(C)CC[C@H]1N(C)CCc1ccc(N)cc1 2113996868 VTMYJKLIDLCBJN-XJKSGUPXSA-N 261.413 2.083 10 10 CECE CC[C@H](O)[C@@H]1CCCCN1c1ccc(CO)cc1F 2114165080 PBUPLYVHUNKAKL-GJZGRUSLSA-N 267.344 2.448 10 10 CECE CC1(C)C[C@](O)(CNCc2c(O)cccc2Cl)CCO1 2203264406 FMUACONCUPDBKA-HNNXBMFYSA-N 299.798 2.455 10 10 CECE COCCNCc1ccc(N(C)C2(C)CC2)cc1OC 2204550022 PMHIOAHWTJKAEC-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(Br)c(CNc2cn[nH]c2)c1O 2214867137 MPMFXBTVABXVQO-UHFFFAOYSA-N 298.140 2.499 10 10 CECE Nc1ccc(CNc2ccc([N+](=O)[O-])cc2CO)cc1 2205282706 AAMAYTRPTXIROC-UHFFFAOYSA-N 273.292 2.281 10 10 CECE CC1(C)[C@@H]2C[C@@H]2CN1C(=O)CCc1ccc(N)cc1 2269101872 VSONXXAIFHHOLD-TZMCWYRMSA-N 258.365 2.458 10 10 CECE Cc1cc(N2C[C@H](C3CC3)[C@@H](O)C2)ccc1[C@@H](C)N 2269657916 PNOCEAGQMVFNRP-LYRGGWFBSA-N 260.381 2.222 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@](F)(CO)C2)cc1C 2269657206 MVBVWNCVRYUFQI-IUODEOHRSA-N 266.360 2.186 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)[C@@H]1C[C@H]1C 2217022838 LDMKVLIUPKPQEW-RDDDGLTNSA-N 255.339 2.159 10 10 CECE CN(Cc1ccccc1O)[C@H]1[C@H]2CC[C@@H]1C[C@@H](N)C2 2270333137 BPXBGRSDACHYQV-RLLZLOQASA-N 260.381 2.340 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@@H](F)C2)cc1Cl 2219158326 AGKMZUZTIJUKTE-KKZNHRDASA-N 273.735 2.302 10 10 CECE CCC[C@@H]1CN(c2ccc(OC)cc2F)CCN1 2220312101 GVYVKMRJELYPOX-LLVKDONJSA-N 252.333 2.413 10 10 CECE Nc1ccc(NC(=O)CCO[C@H]2C[C@@H]3C[C@@H]3C2)cc1 2230318127 BXVVZEDLRHQMFR-GNXNZQSNSA-N 260.337 2.413 10 10 CECE Cc1sc([C@H](NCCN=[N+]=[N-])C(N)=O)c(C)c1C 2221238501 FBHHKGXYWQSHFU-VIFPVBQESA-N 267.358 2.100 10 10 CECE CN[C@H](C)c1ccc(N2CCSC[C@@H]2CO)c(C)c1 2232093192 CXBLHCSEJIROOS-OCCSQVGLSA-N 280.437 2.190 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C[C@@H]1[C@@H]2CCO[C@H]21 2232093421 GQEJBZOHEZDNFI-YYWXWVFPSA-N 260.381 2.486 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@H](O)[C@H]1C1CC1 2232028176 MVFYHDYRSLBMFU-KNXALSJPSA-N 260.381 2.364 10 10 CECE CN1CCc2cc([C@H](O)[C@@]3(C)CC[C@]3(C)N)ccc21 2274261974 PPCGXLCCYGKIHF-XHSDSOJGSA-N 260.381 2.230 10 10 CECE CCN(C(=O)[C@@H]1OC[C@H]2CCC[C@H]21)c1ccc(N)cc1 2233172077 FXYZQUKKLSZBBI-KCPJHIHWSA-N 274.364 2.437 10 10 CECE COC(=O)N[C@H](C)CN[C@@H](C)c1cc(C)ccc1O 2274584554 UTYFZWZUGRRMMV-MNOVXSKESA-N 266.341 2.096 10 10 CECE COc1ncc([C@H](N)c2ccc(N(C)C)cc2)cc1F 2233885088 HBCPERFCCGLCCM-CQSZACIVSA-N 275.327 2.343 10 10 CECE C[C@]1(C(=O)O)CC[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2234177332 RQVGGHSCISTFLQ-CWSCBRNRSA-N 280.328 2.036 10 10 CECE COc1ccc(S(=O)(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])cc1 2234176754 NBDRALUHOWSVEN-NEPJUHHUSA-N 296.352 2.205 10 10 CECE Cc1cc(C)c(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])c(O)n1 2234177534 TWWYVSYTIMBCPY-UWVGGRQHSA-N 275.312 2.365 10 10 CECE CCOc1ccc(N2C[C@H](F)[C@@H](CO)C2)cc1OCC 2234891919 IXJXIRPVRFFZBZ-YPMHNXCESA-N 283.343 2.251 10 10 CECE CCN1CCc2cc(N3CC[C@H](O)C4(CC4)C3)ccc21 2235039408 VSAFGGSXPQHAOK-INIZCTEOSA-N 272.392 2.420 10 10 CECE O[C@H]1CN(c2ccc3c(c2)OCCO3)CC12CCCC2 2235100197 ZICWREWEQBAYJV-HNNXBMFYSA-N 275.348 2.199 10 10 CECE COc1ccc(N(C)Cc2cocn2)c(C[C@H](C)N)c1 2235968888 XDHWBUOIBSTLQV-NSHDSACASA-N 275.352 2.209 10 10 CECE COc1ccc(N2CCc3ncccc3C2)c(CO)c1 2236001534 GZQVTKKRUUCVTH-UHFFFAOYSA-N 270.332 2.145 10 10 CECE COc1ccc(N2CC[C@@H](CCO)[C@H](C)C2)c(CO)c1 2236001596 HPUSFMIDASCHRT-OLZOCXBDSA-N 279.380 2.032 10 10 CECE Cc1c(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)cnn1C1CC1 2236638894 FIZWTAPYQURTRB-JTQLQIEISA-N 274.328 2.441 10 10 CECE Cc1cccc(CNc2cnc3ncccn23)c1O 2226725449 RGSPVUXSTIEDOM-UHFFFAOYSA-N 254.293 2.355 10 10 CECE CCC(CC)N(CCO)c1ccc(OC)cc1CO 2227707923 CBMSTOPQUGAONR-UHFFFAOYSA-N 267.369 2.175 10 10 CECE C[C@H]1CCC[C@H]1CS(=O)(=O)Nc1ccc(O)c(N)c1 2227870573 SLSGKVBTIXNGLY-UWVGGRQHSA-N 284.381 2.152 10 10 CECE CCOc1cccc(CN(C)C[C@]2(F)CCOC2)c1O 2238273639 XKTWUJSIZFNJRD-OAHLLOKOSA-N 283.343 2.351 10 10 CECE Nc1ccc(O)c(CN2CCC[C@@H]2COC(F)F)c1 2228493676 JTMDEJJTKKPWCH-LLVKDONJSA-N 272.295 2.178 10 10 CECE CNCc1ccc(N2C[C@H]3CC[C@]3(OC)C2)cc1OC 2239094469 WEFLCAXIJXELGE-CJNGLKHVSA-N 276.380 2.030 10 10 CECE OC[C@@]12CCCO[C@H]1CN(c1ccc3c(c1)CCC3)C2 2239156256 IPBGJQMDIXBJCO-IRXDYDNUSA-N 273.376 2.153 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)c1ccc(N)cc1 2239638535 PCDYPBTVANRLNU-UHFFFAOYSA-N 292.360 2.392 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H](O)[C@H]2CC3)c(F)c1 2229862800 KCHFTSAQXSOXNA-KCPJHIHWSA-N 264.344 2.037 10 10 CECE Cc1cc(CO)ccc1N(C)CC1(F)CCOCC1 2229939659 LSOJHULZKZYLQN-UHFFFAOYSA-N 267.344 2.442 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCC(OCCO)CC1 2240830735 PTVJCBGJHUWCBA-CYBMUJFWSA-N 279.380 2.026 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@H](C(N)=O)CC[C@@H]1C 2240833265 MDDCXTUKOOOFNF-SGMGOOAPSA-N 275.396 2.105 10 10 CECE COc1cc(OC)c(N2C[C@H]3CC[C@H]2CN3)cc1Cl 2270382299 JSRRMOUMWSCUFO-ZJUUUORDSA-N 282.771 2.298 10 10 CECE CN(Cc1ccc(Cl)cc1O)CC(F)(F)C(=O)O 2263473862 ANIIOTCSQOFTQT-UHFFFAOYSA-N 279.670 2.197 10 10 CECE OC[C@H]1CC(F)(F)CN1c1ccc(OCF)cc1 2263852374 DETFPOAPHKPMEO-SNVBAGLBSA-N 261.243 2.199 10 10 CECE CC[C@@H]1CN(c2ccc(OCF)cc2)C[C@@H]1CO 2263938330 RGBBMPYQZSJOCZ-VXGBXAGGSA-N 253.317 2.447 10 10 CECE CCC[C@@]1(NCc2ccc(Cl)cc2O)CCNC1=O 2274120392 DQIQSSAIZHZUJZ-CQSZACIVSA-N 282.771 2.194 10 10 CECE Cc1nnccc1CN(C)c1ccc(CN)cc1F 2274303038 DSHBEHHUWHRSEM-UHFFFAOYSA-N 260.316 2.019 10 10 CECE CCNCc1ccc(N2CC[C@@]3(O)C[C@H]3C2)c(C)c1 2265248580 FKVZYHWYIXLBSA-GOEBONIOSA-N 260.381 2.066 10 10 CECE Cc1nscc1CC(=O)N(C)Cc1ccc(N)cc1 2265450881 JSELMFIEXLPSBQ-UHFFFAOYSA-N 275.377 2.235 10 10 CECE COc1ncc(F)cc1C(=O)Cc1ccc(N)cc1 2277984810 UVBIUUWKMUPVNL-UHFFFAOYSA-N 260.268 2.237 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](S(C)(=O)=O)CC[C@@H]2C)cc1 2279335776 BHXSNGYTFRSZKD-HUBLWGQQSA-N 296.436 2.108 10 10 CECE Cc1cc(N2CC[C@]23C[C@@H](CO)C3)ccc1[C@H](C)O 2269673205 JYBOYZYAXMCYHH-XEZPLFJOSA-N 261.365 2.400 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2nncn2C)cc1C 2285142992 CEAOOPBMBJGAPU-GFCCVEGCSA-N 273.384 2.040 10 10 CECE CCN(CC(=O)NC(C)C)c1ccc([C@@H](C)N)c(C)c1 2285129022 NSIFCTDSKAORFS-CYBMUJFWSA-N 277.412 2.366 10 10 CECE Cc1cc(N2CCC(OCCO)CC2)ccc1[C@@H](C)O 2285151992 VUYYJFPZNFCHRU-CYBMUJFWSA-N 279.380 2.026 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)F)C1 2308735009 ICSBFZLCXCEDEO-IWSPIJDZSA-N 258.272 2.437 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@H]1[C@@H]2N 2310483984 JFPCSYPMANYHDN-VILIVFPASA-N 250.317 2.014 10 10 CECE N[C@](CSc1nccs1)(C(=O)O)[C@H]1CC12CCC2 2321748700 YPJSSRQFAZLTRC-UFBFGSQYSA-N 284.406 2.208 10 10 CECE C[C@]1(O)C[C@@H]2C[C@H]1C[C@@H]2NCc1c(O)cccc1F 2330923712 UKUSFXDGIONOKA-MJVIGCOGSA-N 265.328 2.170 10 10 CECE CSc1cc(N(C)CC[C@@H]2CCO2)ccc1CN 2328548784 LHLOZUOGVPLEOL-CYBMUJFWSA-N 266.410 2.482 10 10 CECE CO[C@H]1C[C@@H]2[C@H]1CCN2c1ccc([C@H](C)N)c(O)c1 2330945813 WHCMFIGZRLCLJT-FWHFQCOYSA-N 262.353 2.026 10 10 CECE CN(C)c1ccc([C@H](N)C[C@H]2[C@@H]3CCOC[C@@H]32)cc1 2331291764 LVSANEUWSDHJGB-YHUYYLMFSA-N 260.381 2.425 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@]2(O)CC[C@@]3(C)C[C@H]32)cc1 2331627698 NPWUEGUJSHOQEE-LVQVYYBASA-N 260.381 2.304 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1cccc2[nH]ncc12 2337775666 DISSQNRFMGRGGU-UHFFFAOYSA-N 258.285 2.335 10 10 CECE C[C@@H]1CCC[C@H](CS(=O)(=O)Nc2ccc(O)cc2)O1 2338677793 QMTSSTARMBOBEO-ZWNOBZJWSA-N 285.365 2.092 10 10 CECE CN(C[C@@H]1COCC1(C)C)c1ccc(CO)cc1F 2338944683 OSJWUCGMZMNXTA-GFCCVEGCSA-N 267.344 2.427 10 10 CECE C[C@@H]1C[C@@H](O)CN(c2ccc(CN)c(C3CC3)c2)C1 2339157707 MPBLOKUFHALPHS-IAQYHMDHSA-N 260.381 2.230 10 10 CECE CNCc1ccc(N(C)[C@H]2C[C@@H](O)C2)cc1C1CC1 2339161055 PMLZYSQOGLEQKJ-GASCZTMLSA-N 260.381 2.243 10 10 CECE CN[C@H]1CCCN([C@@H](C)c2c(O)cccc2O)CC1 2340126460 SRVWPTREDFAHHB-RYUDHWBXSA-N 264.369 2.233 10 10 CECE C[C@H]1C[C@@]1(C)C(=O)N1CCc2cc(O)c(O)cc2C1 2341195777 JENDUPPLRQQHCB-BJOHPYRUSA-N 261.321 2.029 10 10 CECE COc1cc(Cl)c(N2C[C@@H]3C[C@H]3[C@@H]2CN)c(OC)c1 2342435930 FURDIQIOCNKVJQ-XRNSZHNASA-N 282.771 2.141 10 10 CECE O[C@H]1CCc2cc(N3C[C@H]4CC[C@H]3[C@H](O)C4)ccc21 2349992688 HXDPMIZCCPEJQC-BLQKSXIESA-N 259.349 2.016 10 10 CECE CN(C)c1ccc(CNC[C@H]2O[C@H]3CC[C@H]2C3)cc1 2352701219 PFWDYXLHVIILQD-CWRNSKLLSA-N 260.381 2.410 10 10 CECE CCCN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](C)C2)cc1O 2353966067 YUCKYVVKLOTLBQ-BFQNTYOBSA-N 278.396 2.270 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2C[C@@H](CO)[C@@H]3C[C@H]23)c1 2354930453 KEWRUCYPBLOQKK-ZOBYWKAUSA-N 277.364 2.068 10 10 CECE COc1ccc(N(C)C[C@@H]2CC[C@H](CNC3CC3)O2)cc1 52541869 BYCNAYSHQWLDBY-SJORKVTESA-N 290.407 2.431 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)Nc2cn[nH]c2)c1 171720643 HZLOLMCVILXUMZ-MRVPVSSYSA-N 276.296 2.007 10 10 CECE COc1ccc(N2CCN(C(=O)[C@@H](C)C3CC3)CC2)cc1 62106559 CLRWFUJOBIBZTG-ZDUSSCGKSA-N 288.391 2.390 10 10 CECE O=C(O)[C@@H]1CC[C@H](c2cc(Br)ccc2O)N1 309415294 AGZTWXPAQLVTKS-BDAKNGLRSA-N 286.125 2.032 10 10 CECE CN1CCC[C@H](N(C)c2ccc(CN)c(Cl)c2)C1 61846399 BILGLDHPGBBONY-ZDUSSCGKSA-N 267.804 2.329 10 10 CECE COCCNCc1ccc(N2CCCO[C@@H](C)C2)c(F)c1 62738334 QXLVEODZXYMNEJ-ZDUSSCGKSA-N 296.386 2.177 10 10 CECE COc1cc(N(C)C[C@@H]2CCCO2)c([N+](=O)[O-])cc1OC 302359986 FLOKFOGGPNFGCT-JTQLQIEISA-N 296.323 2.227 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H]3COCC[C@@H]32)cc1O 2357224991 SYFQJVDBZGFMLB-ZOWXZIJZSA-N 276.380 2.288 10 10 CECE CCNCc1cc(F)c(N2C[C@H]3[C@@H](O)CC[C@H]3C2)c(F)c1 124017664 XKNDBZVCAMCOAP-ZOWXZIJZSA-N 296.361 2.281 10 10 CECE CC(C)(C)OC(=O)C[C@](C)(N)c1cccc(F)c1O 1951854615 KLJZXBFYLGEVLV-AWEZNQCLSA-N 269.316 2.437 10 10 CECE c1cc(COc2ccc(N3CCCNCC3)cc2)ccn1 43461573 CNXHCQICHFTEEO-UHFFFAOYSA-N 283.375 2.460 10 10 CECE CC[C@H](C(=O)O)N(Cc1ccc(N)cc1)C(C)C 84104309 VUHMFDFWRFMESW-CYBMUJFWSA-N 250.342 2.342 10 10 CECE COC[C@H]1CCN(c2ccc([C@H](C)N)cc2F)C1 81067899 CXGHFCGIPXNXTF-QWRGUYRKSA-N 252.333 2.318 10 10 CECE CN(C)c1ccc(CNC(=O)Cc2cccc(N)c2)cc1 87845938 VSOWLJQUJBOKAK-UHFFFAOYSA-N 283.375 2.194 10 10 CECE CC(C)COCCN[C@@H](C)c1c(O)cccc1O 232727779 CUKSUWZJEHWAPL-NSHDSACASA-N 253.342 2.421 10 10 CECE Cc1ccc(Br)c([C@@H](N)C(C)(C)CO)c1O 95706339 RHTPWHHLLDFQGE-LLVKDONJSA-N 288.185 2.481 10 10 CECE COc1cccc(CNC(=O)C2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)c1O 246885602 IJZUCBCNYCLPPC-NUZBWSBOSA-N 287.359 2.309 10 10 CECE CCNCc1ccc(N2C[C@H](C(N)=O)CC[C@H]2C)c(C)c1 250215143 WPADKLKVIPLWGD-UKRRQHHQSA-N 289.423 2.195 10 10 CECE Oc1cccc2c1[C@@H](N[C@H]1CCNC13CCC3)CC2 530217565 UAVNJYAOGDBZSK-JSGCOSHPSA-N 258.365 2.254 10 10 CECE COc1cccc(CN(C(C)C)[C@H]2CCOC2)c1O 291241886 LHNRZCKBKRKRPA-ZDUSSCGKSA-N 265.353 2.400 10 10 CECE Nc1ccc(NC(=O)CCNCc2ccccc2)cc1 381967792 IZEQSUQSWBUWSN-UHFFFAOYSA-N 269.348 2.387 10 10 CECE FC1(F)Oc2ccc(N3CC[C@@H](C4CNC4)C3)cc2O1 2162665323 ZYMULHBJDVNMKS-SECBINFHSA-N 282.290 2.054 10 10 CECE C[C@@H](NC[C@H]1COCCC1(F)F)c1c(O)cccc1O 2166661130 UHTARPZIIQIPBU-ZJUUUORDSA-N 287.306 2.420 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1NCc1ccc(N2CCOCC2)cc1 296476815 PTWWVQHUXKNQIE-JKIFEVAISA-N 290.407 2.179 10 10 CECE CN1CCc2cc([C@@H](O)c3cccc(N)c3F)ccc21 2163060407 BMMYPHHIZWZQAU-MRXNPFEDSA-N 272.323 2.482 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CCNC[C@H]3C)ccc21 2163071851 SAVATMYLVLUDOJ-VMGRFDJRSA-N 274.408 2.348 10 10 CECE Nc1ccc(C[C@H](O)Cc2ccc(Cl)cn2)cc1 707328773 PDZHYXFWAGORHV-AWEZNQCLSA-N 262.740 2.463 10 10 CECE CC[C@H]1CCOCC[C@@H]1NCc1ccc(O)c(O)c1O 2165393277 MKBNDGKKMULGOO-JQWIXIFHSA-N 281.352 2.098 10 10 CECE Oc1cc(F)c(Cl)cc1CN1CC[C@@]2(O)C[C@H]2C1 827292725 RZFKJSZKDOIPKT-TVQRCGJNSA-N 271.719 2.141 10 10 CECE COc1cccc(O)c1CNCC1(O)Cc2ccccc2C1 738440223 POOIDBFKLPUILF-UHFFFAOYSA-N 299.370 2.020 10 10 CECE CC(C)(C)OC(=O)Nc1cccc(O)c1C1(N)CC(O)C1 1952970388 LPXQIOXJFSJGSN-UHFFFAOYSA-N 294.351 2.048 10 10 CECE O=C(C=C1CCNCC1)N1CCc2c(F)cccc21 852886144 YCGBRYDQHBTWPP-UHFFFAOYSA-N 260.312 2.025 10 10 CECE C[C@H](NCc1ccc2c(c1)CCO2)c1ccnnc1 924901258 RGTSUFHWIOLLQQ-NSHDSACASA-N 255.321 2.262 10 10 CECE O=C(NC[C@@H]1CC[C@@H](C(F)(F)F)O1)c1cc(O)cs1 927572312 KTMKNQMQGJTBAF-CBAPKCEASA-N 295.282 2.293 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)C(C)(F)F)C2)cc1 853817697 KSFUBGXCYRDNMY-JTQLQIEISA-N 284.306 2.045 10 10 CECE Cc1cc(O)c(CN[C@@H]2C[C@@H](O)C23CCC3)cc1C 850387939 DCONVJTWNQYZBJ-HUUCEWRRSA-N 261.365 2.402 10 10 CECE CC[C@H](NCCOCCNC)c1ccc(N(C)C)cc1 863542014 DGHQQDCWXHLFCW-INIZCTEOSA-N 279.428 2.029 10 10 CECE Nc1cccc(Br)c1N[C@H]1CCOC1 697513413 SEEMMGJKIQWRHX-ZETCQYMHSA-N 257.131 2.232 10 10 CECE O=C([C@@H]1CCCN(Cc2ccccc2O)C1)N1CCCC1 770509544 DHUWPYVMJRMIGE-OAHLLOKOSA-N 288.391 2.227 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2c1cccc(Cl)n1 75793694 VQEFMXQLURQXJR-ZDUSSCGKSA-N 276.723 2.381 10 10 CECE COC[C@@H](C)[C@H](C)Nc1c(N)cccc1C(=O)O 386333688 KKSDPFFMEVWEDI-BDAKNGLRSA-N 252.314 2.050 10 10 CECE C[C@@H](CC(=O)N(C)C)NCc1cccc(Cl)c1O 386426895 OBHZSINBSQBOCY-VIFPVBQESA-N 270.760 2.002 10 10 CECE CC(C)N[C@H](c1nnco1)c1cccc(F)c1O 83384577 FQSOXRSDHHDGDS-JTQLQIEISA-N 251.261 2.002 10 10 CECE N[C@H](c1nnc(C2CCC2)o1)c1cc(F)ccc1O 83458393 ASEIFLREDPHMDP-NSHDSACASA-N 263.272 2.230 10 10 CECE COc1cccc2c1CCN[C@@H]2c1cc(O)ccc1O 83597477 UVCXCFXZFVOHBI-INIZCTEOSA-N 271.316 2.342 10 10 CECE CN(C)c1ccc(CN2CC[C@H](N)CC2(C)C)cc1 84625397 BUGTWQDBWUBLHV-AWEZNQCLSA-N 261.413 2.454 10 10 CECE Cc1ccc(CNC[C@H](O)C(F)(F)C(F)(F)F)c(O)c1 895677328 LKTKDLCFWHJXFH-JTQLQIEISA-N 299.239 2.349 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@]3(C)CN(C)C[C@]3(C)C2)cc1 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10 10 CECE CCN[C@@H](C)CC(=O)N(C)[C@H](C)c1ccccc1O 61272809 CQZZANXMBOXPBW-NWDGAFQWSA-N 264.369 2.300 10 10 CECE CC[C@@H]1COC[C@H]1N(C)c1ccc(CN)c(F)c1 711158872 RUPZWYITKHEVLW-QMTHXVAHSA-N 252.333 2.146 10 10 CECE COc1cccc(O)c1CN1CC[C@@]2(CCCOC2)C1 793619143 FVFZYCZWMOKDMH-INIZCTEOSA-N 277.364 2.403 10 10 CECE CO[C@H]1CCC[C@@H]1N(C)c1ccc(CN)c(F)c1 687427562 XXNKENRIXYCITR-KBPBESRZSA-N 252.333 2.288 10 10 CECE Oc1ccc(Br)cc1CN[C@]12COC[C@H]1C2 717971603 ZWZSLELABPDXNB-BXKDBHETSA-N 284.153 2.033 10 10 CECE Cc1ccc(O)c([C@H](C)NC2CC(CC(N)=O)C2)c1 718397726 JMKGCFMBQGDRBQ-UNXYVOJBSA-N 262.353 2.005 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CCN(C)C2=O)c(Cl)c1 690144280 DJONBIPHCBBLIW-TVQRCGJNSA-N 282.771 2.060 10 10 CECE CC[C@H](N)c1ccc(N(C)C[C@@H]2CCCS2(=O)=O)cc1 694123227 LWRMTOMBMHBWAW-GJZGRUSLSA-N 296.436 2.110 10 10 CECE CCCN(Cc1ccc(N)cc1)C[C@H](COC)OC 694676544 SBQNOKSXWVOXII-OAHLLOKOSA-N 266.385 2.142 10 10 CECE CC[C@H](C(=O)OC)N(Cc1ccc(N)cc1)C(C)C 695048089 IEJZBVLWZCUHOL-CQSZACIVSA-N 264.369 2.431 10 10 CECE CC[C@@H]1[C@H]2CNC[C@@H]2CN1Cc1cc(Cl)ccc1O 90329040 GOSDWVFUBHWJTD-KWCYVHTRSA-N 280.799 2.475 10 10 CECE CC(C)N(Cc1ccc(O)cc1O)CC1CCNCC1 94012280 CYKNIPRUCBXUAP-UHFFFAOYSA-N 278.396 2.308 10 10 CECE NCc1ccc(N2CCC23COC3)c2ccccc12 2115156808 VHDFPLRTWRRRQG-UHFFFAOYSA-N 254.333 2.278 10 10 CECE C[C@H](NC(=O)COc1ccc(N)cc1)C1(C)CCC1 2115792309 DKVRILODBGMJCF-NSHDSACASA-N 262.353 2.343 10 10 CECE Nc1ccc(CCCN2CCC[C@@H]2CC(=O)O)cc1 2123060364 TWOXZFDRIHZYHP-CQSZACIVSA-N 262.353 2.141 10 10 CECE Oc1ccc(CNC2(C(F)F)CCOCC2)c(O)c1 2123348305 FOJXAAUAQDAPMA-UHFFFAOYSA-N 273.279 2.002 10 10 CECE CN1CCCc2cc([C@@H](N)[C@]3(O)C=CCC3)ccc21 2119177336 DPHSTKMMAWQCRD-CVEARBPZSA-N 258.365 2.150 10 10 CECE CO[C@H]1COC[C@H]1N(C)c1ccc([C@H](C)O)cc1Cl 2120753357 CCELWUVIDPACRJ-FZZIBODNSA-N 285.771 2.243 10 10 CECE CC=CC[C@@H](N)[C@H](O)c1ccc2c(c1)CCN2CC 2120773036 NNPZHACXPXOPRL-GDBMZVCRSA-N 260.381 2.396 10 10 CECE C[C@H](O)c1ccc(N2CCN(C3(C)CC3)CC2)cc1 2122668899 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O=C(O)C=Cc1ccc(N2CC[C@H]3COC[C@H]3C2)cc1 1911996991 LETRIYAJEXVJSC-UONOGXRCSA-N 273.332 2.257 10 10 CECE CN1CCC(CCN2CCC(N=[N+]=[N-])CC2)CC1 1912185174 MQLBONUANZIGKV-UHFFFAOYSA-N 251.378 2.493 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(Cc2nnc3n2CCC3)C1 1912173907 SCDMDSUQOWXIAH-NSHDSACASA-N 275.360 2.137 10 10 CECE Cn1nnc(CN2CCC(CN=[N+]=[N-])CC2)c1C(F)F 1912162265 UFZDMDTZPPNRRX-UHFFFAOYSA-N 285.302 2.275 10 10 CECE COC(=O)[C@@](C)(NCCCN=[N+]=[N-])c1csnc1C 1912199153 PCRVXIMGAFQISP-NSHDSACASA-N 283.357 2.130 10 10 CECE CCCN(C(=O)N1CCC(O)CC1)c1ccc(N)cc1 1914095248 ZQSRMFKMJYDXET-UHFFFAOYSA-N 277.368 2.062 10 10 CECE COCC1CN(c2ccc([C@@H](C)O)cc2Cl)C1 1916830501 JOBAHWRBZCMADR-SECBINFHSA-N 255.745 2.476 10 10 CECE CNCc1ccc(N2CC[C@]3(CCC[C@@H]3O)C2)c(F)c1 1918918672 BBPAPYFZVGIIBF-JKSUJKDBSA-N 278.371 2.286 10 10 CECE COc1ccc(/N=N/N2CCC(=O)CC2)c(OC)c1 1860483404 RBNLQLUVWLKUKN-CCEZHUSRSA-N 263.297 2.367 10 10 CECE CC(=O)Nc1ccc(/N=N/N2CCC(=O)CC2)cc1 1860488359 PBSKJIWYXIWFKY-FOCLMDBBSA-N 260.297 2.309 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1Cc2ncsc2C1 2136728101 NJZAQIGZZHCZHD-UHFFFAOYSA-N 277.305 2.064 10 10 CECE C[C@H](NC[C@H]1CCC[C@@H](O)C1)c1c(O)cccc1O 227610838 VJBCWUTYWGRSKM-SDDRHHMPSA-N 265.353 2.300 10 10 CECE C[C@@H](NC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1O 1557966636 LHJVIRPJCZODFS-BZNIZROVSA-N 299.326 2.409 10 10 CECE COc1ccc(O)c([C@@H](C)N2C[C@@H](N)CC2(C)C)c1 1925260496 BDGZFXYHPAMMDB-MNOVXSKESA-N 264.369 2.273 10 10 CECE C[C@@H]1CC[C@@H](CNC(=O)COc2ccc(N)cc2)C1 230395806 GASVMOSFZKWCTQ-VXGBXAGGSA-N 262.353 2.200 10 10 CECE O=C(/C=C\COc1ccccc1)NCc1c(O)cccc1O 1652625739 KRKSNWXESATPCI-YHYXMXQVSA-N 299.326 2.349 10 10 CECE CNCc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1OC 2139696064 BQQJAPQEOGEMEJ-RYUDHWBXSA-N 264.369 2.028 10 10 CECE C[C@H](NCc1c(O)cccc1Cl)C(=O)N1CCCC1 134653479 XTFQPPXLUJVGJE-JTQLQIEISA-N 282.771 2.146 10 10 CECE Oc1cc(F)ccc1CN1CC[C@H]2CCOC[C@@H]2C1 2139796432 OWCZGWWWIKVAQW-AAEUAGOBSA-N 265.328 2.390 10 10 CECE CC[S@](=O)CCN[C@H](C)c1ccc(C)cc1O 168766119 QPJAIIJCWRGOGF-PIGZYNQJSA-N 255.383 2.120 10 10 CECE COC(=O)C1CCN(/N=N/c2cccc([N+](=O)[O-])c2)CC1 1860487394 XDPYGMVGBPFWNE-CCEZHUSRSA-N 292.295 2.479 10 10 CECE C[C@H](NC(=O)CC[C@H]1CCOC1)c1ccccc1O 827973622 VFBYWEXBZXICTM-RYUDHWBXSA-N 263.337 2.386 10 10 CECE COc1cccc(O)c1CN[C@H]1CO[C@@H](C2CC2)C1 858295512 DYHNYQFTKFQIAB-IAQYHMDHSA-N 263.337 2.058 10 10 CECE C[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CNc2ccccc2N1 235127975 QAKCQWRZLJPWOO-KWQFWETISA-N 287.285 2.350 10 10 CECE CN[C@@H](c1ccccc1O)c1nn(C)cc1Br 1942390317 ILXRIBYAEGSGTP-NSHDSACASA-N 296.168 2.197 10 10 CECE CNCc1ccc(N2C[C@H](C)N(C)[C@@H](C)C2)c(C)c1 127935014 ADVZMOIMESKOKK-KBPBESRZSA-N 261.413 2.243 10 10 CECE Cc1cccc(O)c1CNC[C@H]1C[C@H](O)C12CCC2 1875437681 IEOXSCQWYUPCCF-DOMZBBRYSA-N 261.365 2.341 10 10 CECE COC[C@H]1C[C@@H]1NCc1c(O)cccc1Br 1875850629 QGQDLZVYWCCOBX-KCJUWKMLSA-N 286.169 2.279 10 10 CECE CC[C@@H](N)C(C)(C)C(=O)N[C@H](C)c1ccccc1O 1877589865 PAKVTZVOBLZLBG-ZWNOBZJWSA-N 264.369 2.333 10 10 CECE Nc1ccc(CCNC(=O)CC(F)(F)C(F)F)cc1 884028669 NTXBWQZDYUBEPE-UHFFFAOYSA-N 278.249 2.218 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@H]2[C@@H](C)O)cc1O 1879187893 NZORJCLGMSJWKQ-WDMOLILDSA-N 264.369 2.022 10 10 CECE CN(CCN=[N+]=[N-])CC1(NC(=O)OC(C)(C)C)CC1 1880727681 YELMDOUFZFJFQL-UHFFFAOYSA-N 269.349 2.286 10 10 CECE CC1(C)CCN(Cc2cc(F)ccc2O)[C@@H]1C(=O)O 1962965838 JVRIGJAKLXEEHM-GFCCVEGCSA-N 267.300 2.216 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H]2CN(C)C)c(F)c1 1880929722 WKCIXNCLNRAMRE-GXSJLCMTSA-N 269.339 2.125 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC(C)(O)CC2)c(F)c1 1880930095 ZYMAOVIILSKRJL-VIFPVBQESA-N 270.323 2.336 10 10 CECE Cc1ccc([C@@H](C)Nn2nnc3c2CCCC3)c(O)c1 2143848078 QUOBNYKDNQDDAJ-LLVKDONJSA-N 272.352 2.476 10 10 CECE COc1ccc(CNCC[C@@H]2CCN(C)C2)cc1C 1963438236 DPIJBKKTVHINPI-CQSZACIVSA-N 262.397 2.435 10 10 CECE Nc1ccc(CN2CCCC[C@H]2CCC(=O)O)cc1 1891312804 SXPKFRTVTOXVDJ-AWEZNQCLSA-N 262.353 2.488 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@@H]3C[C@H]32)cc1Cl 2004411228 GAWOEFQJKJGWHF-ZEGGKSINSA-N 252.745 2.337 10 10 CECE CO[C@@H](CNCc1cc(F)ccc1O)[C@@H]1CCCOC1 1967749018 XFDIUJOKQJXDAN-ABAIWWIYSA-N 283.343 2.063 10 10 CECE COC[C@@H]1CC[C@@H](NCc2ccc(F)cc2O)C1 1967714190 XTKISMRZLVRDJZ-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE Oc1cc(Cl)ccc1CNC[C@@H]1[C@H]2CCOC[C@H]21 1972272365 TXRAVNPEUHYTAV-JHJVBQTASA-N 267.756 2.418 10 10 CECE C[C@@H](F)[C@H]1CCCN1Cc1cc2c(cc1O)OCO2 1972795973 GZVZJUJVGARXPH-MWLCHTKSSA-N 267.300 2.443 10 10 CECE O=C(O)[C@H]1CCCCN(Cc2cc(F)cc(F)c2O)C1 1972908957 MHRMIAXOYBMKRL-VIFPVBQESA-N 285.290 2.357 10 10 CECE Cc1c(C)n(C)c2ccc(CN3CCNCC3)cc12 258509867 YEWNFSKPSPMFDY-UHFFFAOYSA-N 257.381 2.200 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@H](O)[C@H]3C2)c(F)c1 2151397246 NSHGEEIDKFTMRI-LESCFKLSSA-N 278.371 2.313 10 10 CECE COc1ccc(CNCC[C@H](C(C)C)N(C)C)c(O)c1 2149234312 PDCWQHLHSJTIFE-OAHLLOKOSA-N 280.412 2.467 10 10 CECE C[C@@H](O)c1ccc(N2C[C@]34CC[C@]3(COC4)C2)cc1O 2146562439 MRNRVYCWLPZIFH-LYRGGWFBSA-N 275.348 2.062 10 10 CECE CCC[C@]1(O)CCN(CCCOc2ccc(N)cc2)C1 2150769625 URRPMTKJPLZCOG-INIZCTEOSA-N 278.396 2.275 10 10 CECE C[C@H](CNCc1ccc(N2CCCC2)cc1)[S@](C)=O 159658561 NTFYIJKZYQMEFF-BFUOFWGJSA-N 280.437 2.143 10 10 CECE CCSCC[C@H](C)NC(=O)COc1ccc(N)cc1 159841311 ZMTBYJBMQIIJFD-NSHDSACASA-N 282.409 2.296 10 10 CECE CCC[C@H]1CCN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)C1 160406319 KXUMMFLQVGUEDY-XHDPSFHLSA-N 273.380 2.289 10 10 CECE COC(=O)c1cccc(N)c1N[C@H](CN(C)C)C(C)C 161053239 QXXWAUURGZAVFI-CYBMUJFWSA-N 279.384 2.054 10 10 CECE CN(Cc1cc(N)ccc1O)CC1(Br)CC1 1991494236 VLEQWGAEVJXOJQ-UHFFFAOYSA-N 285.185 2.334 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC[C@@H](C2CNC2)C1 2149893511 CRMHNNMNFYDVEI-UKRRQHHQSA-N 273.424 2.355 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H](N)CC(F)(F)C(F)F)cc1 2147514130 FEANUDHLOFBHAL-GHMZBOCLSA-N 294.292 2.404 10 10 CECE CC(C)NCCC(=O)N(C)[C@H](C)c1ccccc1O 37826570 BFEAFTFJAVYMLA-GFCCVEGCSA-N 264.369 2.300 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](CO)OC(C)(C)C2)c(Cl)c1 163202731 XEXDEWNKIZISPJ-CMPLNLGQSA-N 298.814 2.336 10 10 CECE CC(C)OC1CN(c2ccc(CN)c(Cl)c2)C1 1996707146 GIGIFKUJHZWUPN-UHFFFAOYSA-N 254.761 2.412 10 10 CECE Cc1cc(N2CC(N3CCC3)C2)ccc1CNC1CC1 2152253085 KYIIEGGSMFETAG-UHFFFAOYSA-N 271.408 2.141 10 10 CECE C[C@@H](NCc1cnn(C2CC2)c1)c1cc(O)ccc1O 2153076058 XRWUKUNHIMWGHT-SNVBAGLBSA-N 273.336 2.480 10 10 CECE Oc1ccc(CNCCN2CCCCCC2)c(O)c1 40767489 YCHPNQOIRKRYLF-UHFFFAOYSA-N 264.369 2.063 10 10 CECE Cn1c(Cl)cnc1C=C1[C@H]2CCN[C@@H]2C1(C)C 2007079380 WDRSXKWYMWXAAM-PELKAZGASA-N 251.761 2.475 10 10 CECE CCNCc1ccc(N2CC[C@@H](N(C)CC)C2)c(F)c1 2153986638 FZQKOKBPGNRXAI-CQSZACIVSA-N 279.403 2.466 10 10 CECE O=C1Nc2cc(N3CC[C@H]3CC3CCC3)ccc2[C@H]1O 2154075549 ZBRPHZYTMCAZMN-SWLSCSKDSA-N 272.348 2.441 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CC[C@@H]3CC3CC3)cc21 2154067055 JPUPYQOJUUMZPV-DOMZBBRYSA-N 271.364 2.042 10 10 CECE CN1CCCC[C@@H]1CNCc1ccc2c(c1)CCO2 44561025 OMWMIOXJJMEWBC-OAHLLOKOSA-N 260.381 2.195 10 10 CECE CCc1nnc(CN2CCC[C@H]2CN=[N+]=[N-])s1 2009447309 VIAREYCZOHOYPQ-QMMMGPOBSA-N 252.347 2.375 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCn1cc(Cl)cn1 2009447156 SNHCBNHTWBUGHJ-JTQLQIEISA-N 254.725 2.311 10 10 CECE COc1cccc(O)c1CN(C)CP(C)(C)=O 2021432779 UZVCBHJXWXHYHA-UHFFFAOYSA-N 257.270 2.413 10 10 CECE COc1cccc(O)c1CN1CCC[C@H]2CC[C@]21CN 2160729958 YIDSJDLNGPJVJT-LRDDRELGSA-N 276.380 2.104 10 10 CECE CC[C@H]1CCN1c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 2028292840 AIZUFGBXAYZFSK-JVXZTZIISA-N 265.744 2.281 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CC[C@@H](C(=O)O)C1(C)C 2160046438 RFPZOLDZVPIFMD-CABZTGNLSA-N 279.336 2.344 10 10 CECE COc1ccc(N(C)C[C@H]2CNCCSC2)cc1 2036068161 RJNVTTFXUAHKHB-GFCCVEGCSA-N 266.410 2.084 10 10 CECE CN(c1c(F)cc(CO)cc1F)[C@@H]1CCN(C2CC2)C1 2160029758 FVGGIPNFJFKRLT-GFCCVEGCSA-N 282.334 2.130 10 10 CECE COc1cccc(CN(C)c2ccc(CN)cc2)n1 70093067 OPJUGVQRZUJCEN-UHFFFAOYSA-N 257.337 2.185 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)CC[C@@H]1CCOC1 401566250 PTUCZXHUQYQPAH-CYBMUJFWSA-N 262.353 2.044 10 10 CECE C[C@@H](N)c1ccc(N2CCN(CCF)CC2)c(Cl)c1 402594649 MMKFUBLMVYOXLT-LLVKDONJSA-N 285.794 2.451 10 10 CECE Nc1ccc(OCCN2CCC=C(Cl)C2)cc1 404363691 FOBNKMMBOBCLPI-UHFFFAOYSA-N 252.745 2.476 10 10 CECE CNCc1ccc(N2CCCC[C@@H]2CN(C)C)cc1 404955329 YADNWHOUAYIHFR-MRXNPFEDSA-N 261.413 2.327 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H]2CCN(C)C[C@@H]2C1 312755239 XQOVDJWZEVFTNL-JHJVBQTASA-N 278.371 2.476 10 10 CECE COc1ccc(O)c([C@@H](C)N(C)C2(C(=O)O)CCC2)c1 312937825 OZZGXAOFXMQQLT-SNVBAGLBSA-N 279.336 2.401 10 10 CECE N[C@]1(CNCc2ccc3c(c2)CCO3)CCC[C@@H]2C[C@H]21 2160556601 KMMKDMOGYDCUDP-UNEWFSDZSA-N 272.392 2.229 10 10 CECE Oc1c(CNCCC2(O)CCCC2)ccc(F)c1F 703286218 NPEKXWJCCWYLHF-UHFFFAOYSA-N 271.307 2.455 10 10 CECE CNCc1cc(F)c(N2CCN(C)C[C@@H](C)C2)c(F)c1 707548869 WMZUNZMYCBXOSP-LLVKDONJSA-N 283.366 2.072 10 10 CECE CCN(CC)c1ccc([C@]2(O)CC[C@@H]3CNC[C@H]32)cc1 2163098051 APDXJTFILYNAKC-KBRIMQKVSA-N 274.408 2.350 10 10 CECE CN(C)c1ccc([C@H](N)[C@](C)(O)c2ccncc2)cc1 2163133166 KCTGZCPUMFLYAY-JKSUJKDBSA-N 271.364 2.055 10 10 CECE COc1ccc(N2CCC[C@@](O)(C(C)C)C2)c(N)c1 710214687 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CCCN(Cc1ccc(N)cc1)C(=O)[C@H]1CCOC1 40941406 GCTARNKITMXMOY-ZDUSSCGKSA-N 262.353 2.044 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@H]3CC3CC3)ccc21 2154064741 CQKUBWWRSFFPMT-SWLSCSKDSA-N 271.364 2.278 10 10 CECE COc1cc(CN2CCC[C@@H]2CN=[N+]=[N-])sn1 2009447554 YGMNMVKPKOAWJO-MRVPVSSYSA-N 253.331 2.426 10 10 CECE O=C(O)[C@H]1CCC[C@H](NCc2ccc(O)cc2O)CC1 2154448872 ACMPVQDIJJZLDS-JQWIXIFHSA-N 279.336 2.221 10 10 CECE CCNCc1ccc(OCC(=O)N[C@@H](C)CC)c(C)c1 2155014015 RZIHETFTGHFRJV-ZDUSSCGKSA-N 278.396 2.398 10 10 CECE CCOc1cccc(CN2CC[C@H](N)CC23CC3)c1O 2155062511 IGSSYZLRCHNLIZ-ZDUSSCGKSA-N 276.380 2.247 10 10 CECE CCNCc1ccc(N(C)Cc2cnnn2C)cc1Cl 2156477972 IWUQVCAXQCCBNP-UHFFFAOYSA-N 293.802 2.214 10 10 CECE CC[C@H](c1ccccc1O)N(CCN)CC(F)F 2028623358 YPKXQHKUMCPPBL-LLVKDONJSA-N 258.312 2.369 10 10 CECE CCNCc1ccc(N(C)C2CN(C)C2)c(Cl)c1 2028809393 ANCDNXXYZKNCOF-UHFFFAOYSA-N 267.804 2.200 10 10 CECE CO[C@H]1CN(CCOc2ccc(N)cc2)CC[C@H]1C 299957454 SMGRMKNAIDCNOI-DOMZBBRYSA-N 264.369 2.004 10 10 CECE CC(C)SC1CN(C(=O)c2ccc(O)c(O)c2)C1 2036371619 BOQDTIAXUJQJIB-UHFFFAOYSA-N 267.350 2.064 10 10 CECE CCOC(=O)C[C@@H](C)N1CCC[C@@H](N=[N+]=[N-])CC1 2038005249 QYRNRGHLFMEWPI-GHMZBOCLSA-N 254.334 2.493 10 10 CECE C[C@@H]1NC[C@H](C)N([C@H](C)c2cc(O)ccc2O)[C@@H]1C 401375912 JKSBWQGRPVZZAZ-NNYUYHANSA-N 264.369 2.230 10 10 CECE CC[C@@H](NC)c1ccc(N2CCN(CCF)CC2)cc1 402735461 HYAUBVQRGHSMJH-MRXNPFEDSA-N 279.403 2.449 10 10 CECE NCCCCCCCC(=O)NCc1ccccc1O 403701034 TXPIQBFWGCGVMQ-UHFFFAOYSA-N 264.369 2.308 10 10 CECE C[C@@H]1CCC[C@H](S(=O)(=O)NCCCN=[N+]=[N-])C1 407394940 QILGVKQETQXTPV-ZJUUUORDSA-N 260.363 2.185 10 10 CECE CN(CCCc1cncn1C)Cc1ccc(N)cc1 314555963 LGZQTXCGIIVHPS-UHFFFAOYSA-N 258.369 2.067 10 10 CECE COc1cccc(O)c1CN1CCC[C@H](CN(C)C)C1 2160727459 AIQXTOIWQJIFCK-CYBMUJFWSA-N 278.396 2.174 10 10 CECE CN1CCCc2cc(CN[C@@H]3CC(C)(C)[C@@H]3O)ccc21 2161385588 QPUUFENOWFBCDV-GDBMZVCRSA-N 274.408 2.318 10 10 CECE CC(C)C[C@@H](CO)CNCc1ccc2c(c1)CCN2C 2177254207 UJTDBIBDUUPEOG-OAHLLOKOSA-N 276.424 2.423 10 10 CECE Cc1ncoc1CN(C)c1ccc([N+](=O)[O-])c(CO)c1 2161909915 JDNQQVPCLLGSRV-UHFFFAOYSA-N 277.280 2.020 10 10 CECE CN1C[C@@H]2CN(CCCc3ccc(N)cc3)C[C@@]2(C)C1 702346017 GLZKUUBYVMMUTC-NVXWUHKLSA-N 273.424 2.085 10 10 CECE CC(C)N(C[C@@H](C)O)c1ccc([C@H](C)O)c(O)c1 709473077 WFWTWPQUARRTFW-MNOVXSKESA-N 253.342 2.041 10 10 CECE C[C@H]1[C@H](C)CN1c1cc2c(cc1Cl)[C@@H](O)C(=O)N2 706802467 QNJZDLUYULQPLW-KEHGIVTQSA-N 266.728 2.170 10 10 CECE CNCc1ccc(N(C)[C@@H]2C[C@H](OC)[C@H](OC)C2)cc1 2172565570 WJSNRFBRHYSBDY-MUJYYYPQSA-N 278.396 2.035 10 10 CECE CCC[C@@H]1COC[C@H]1N(C)C(=O)Cc1ccc(N)cc1 688185549 DSFIYOSKODUIIL-UKRRQHHQSA-N 276.380 2.085 10 10 CECE CCN(c1ccc(CO)cc1Cl)C(C)(C)CO 688343698 NQXYORKCZWJBBY-UHFFFAOYSA-N 257.761 2.430 10 10 CECE CN(Cc1cc(F)cc(F)c1O)[C@H]1CCCOC1 708434862 VWORBJJNRUCJOA-NSHDSACASA-N 257.280 2.281 10 10 CECE C[C@@H]1CSCCN(c2ccc(CN)cc2F)C1 379516153 WNKOMXQQZZCLFF-JTQLQIEISA-N 254.374 2.474 10 10 CECE CCCN[C@@H]1CCN(CC(F)(F)F)[C@H]1CN=[N+]=[N-] 712182489 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10 10 CECE FC(F)COc1ccc(N2CC[C@@H]3CNC[C@@H]32)cc1 1879908912 XPXDCMDICBPOSW-MFKMUULPSA-N 268.307 2.129 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](O)[C@@H](C)C2)c(F)c1 1880928786 SLKJCZCCIFDOJZ-RVBZMBCESA-N 270.323 2.192 10 10 CECE C[C@H](N)c1cc(F)c(N2CCCN(C)CC2)c(F)c1 1880924703 ATUNFZREAYVDCM-JTQLQIEISA-N 269.339 2.126 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)C[C@@H]2CCN2C)c(F)c1 1880923946 MJDYLSOYAUQKFM-KOLCDFICSA-N 269.339 2.125 10 10 CECE Oc1cc(Cl)ccc1CNCC[C@H](O)C(F)(F)F 1181497045 DGACHXBNHYWIIP-JTQLQIEISA-N 283.677 2.449 10 10 CECE COc1cc(C)c(N2CC([C@@H]3CCNC3)C2)cc1C 1886867890 OKFWUDOVVJPNHU-CYBMUJFWSA-N 260.381 2.358 10 10 CECE C[C@@H]1CCN(CCNCc2ccc(Cl)cc2O)C1 1964052786 WSKMTCALOCJDQO-LLVKDONJSA-N 268.788 2.477 10 10 CECE COc1cc(Br)c(C(=O)C(C)=O)cc1OC 1951483102 BQGPSLDHFUIZTP-UHFFFAOYSA-N 287.109 2.238 10 10 CECE Cc1c(C[C@@]2(O)CCCNC2)c2ccccc2n1C 1951494714 VAJCTOXHASMVHA-INIZCTEOSA-N 258.365 2.144 10 10 CECE C[C@H]1CN(c2cc3c(cc2Cl)[C@H](N)C(=O)N3)CCS1 137203568 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2.268 10 10 CECE CC[C@H](NC)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1 300505760 HBZJWYNXDNGRGD-ZFWWWQNUSA-N 275.396 2.059 10 10 CECE CC(C)OC1CN(c2ccc([C@H](C)O)c(O)c2)C1 2040861099 CYCMFEXWSFPSAV-JTQLQIEISA-N 251.326 2.059 10 10 CECE CN[C@@H](C)c1ccc(N2CCC3(CCO3)CC2)cc1O 2157180937 ULOZWDLEWCDRDJ-LBPRGKRZSA-N 276.380 2.432 10 10 CECE CCCN1CCC[C@@H](NCc2cccc(OC)c2O)C1 2158773730 YVHFHVDBPRKYHM-CQSZACIVSA-N 278.396 2.365 10 10 CECE CCN1CCCN(c2ccc([C@H](C)N)cc2F)CC1 307789512 JLZPIQPRZUBEBY-LBPRGKRZSA-N 265.376 2.377 10 10 CECE COc1ccc(O)c(CN2CCCC[C@H]2CN(C)C)c1 405199622 RJGYNDXJOVXPIF-AWEZNQCLSA-N 278.396 2.317 10 10 CECE COCCO[C@@H]1CCCN(c2ccc(CO)cc2Cl)C1 2158833773 YYVUIJJGMFJRPX-CYBMUJFWSA-N 299.798 2.464 10 10 CECE COCCN([C@@H](C)COC)[C@@H]1CCc2cccc(O)c21 312856360 RCEOQVBLVCSUTG-GXTWGEPZSA-N 279.380 2.363 10 10 CECE CN(C)c1ccc(CN2C[C@@H]3CCC[C@@]3(CN)C2)cc1 313002065 NJASTLJGQKPRAP-DOTOQJQBSA-N 273.424 2.313 10 10 CECE COc1ccc([C@@H](C)NC[C@H](O)C2CCC2)c(O)c1 315867058 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CC[C@H](N)c1ccc(N2CC(F)(F)C[C@@H]2CO)cc1 2271892060 NAVMGKPUZQSROB-OLZOCXBDSA-N 270.323 2.303 10 10 CECE Oc1ccccc1CNCC12CC(C(F)F)(CO1)C2 2266278776 JEUIMSCJXMGQCV-UHFFFAOYSA-N 269.291 2.296 10 10 CECE COc1ccc(N2CCCC[C@H]2CN)c(OC)c1C 2278015867 FURLVDGJOCZMMF-LBPRGKRZSA-N 264.369 2.330 10 10 CECE CSc1ncc(CNCc2cncc(C(=O)O)c2)s1 2269121656 PVTKSMMEIGNMAB-UHFFFAOYSA-N 295.389 2.248 10 10 CECE CNc1ccc(C(=O)NCc2cnc(SC)s2)nc1 2269300961 GCLUDWOTZBCHPV-UHFFFAOYSA-N 294.405 2.232 10 10 CECE Nc1ccc(NC(=O)CCCSC[C@@H]2CCCN2)cc1 2279790769 ALOZPRHPOVKRLQ-AWEZNQCLSA-N 293.436 2.473 10 10 CECE COc1cccc([C@@H](NCCCN=[N+]=[N-])C(N)=O)c1Cl 2283303458 FDCRRGKSKRRNKF-LLVKDONJSA-N 297.746 2.165 10 10 CECE COc1ccc(N2CCC[C@](F)(CO)C2)c2c1CCC2 2284587735 MTXYRGUOTYQWHS-MRXNPFEDSA-N 279.355 2.485 10 10 CECE COC[C@]1(C)[C@@H]2C[C@H]2CN1c1ccc2c(c1)CC[C@@H]2N 2284552373 OJJNSGYTHQKOCK-NKKGCODLSA-N 272.392 2.494 10 10 CECE O[C@]1(c2ccc(N3CCCCC3)cc2)[C@@H]2CNC[C@H]1C2 2286201926 JCIGVVMIRHVCJU-QLPKVWCKSA-N 272.392 2.104 10 10 CECE CN1C(=O)C(=Cc2ccc3c(c2)CCO3)SC1=S 2297356379 GALHQJNYQAVEBW-UHFFFAOYSA-N 277.370 2.453 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@]1(O)CCCSC1 2320587905 ORXXUOBGKCNBKI-ZDUSSCGKSA-N 287.812 2.393 10 10 CECE CCN1N=C(C)C(=Cc2ccccc2C(=O)O)C1=O 2332131953 XUPANEMVWTVBKM-UHFFFAOYSA-N 258.277 2.006 10 10 CECE COCCN(c1ccc(CN)c(SC)c1)C1CC1 2328545931 BONIFIWHUMLMDR-UHFFFAOYSA-N 266.410 2.482 10 10 CECE CCO[C@H]1C[C@@H]2CN(c3ccc(CNC)cc3)C[C@@H]21 2333624961 VOAPZDZQQLNZKQ-KBMXLJTQSA-N 260.381 2.267 10 10 CECE CCOc1cccc(CN[C@H]2C[C@@H]3CO[C@H]2C3)c1O 2334548418 RMUPXKQRCXUICA-JKOKRWQUSA-N 263.337 2.058 10 10 CECE Cc1c(CNCCSCCO)n(C)c2ccccc12 2335614095 RHRUTIKYYWRJJP-UHFFFAOYSA-N 278.421 2.302 10 10 CECE Nc1ccc(CCNCc2snnc2C2CC2)cc1 2335832701 ROEIDTUAVQFKHD-UHFFFAOYSA-N 274.393 2.330 10 10 CECE Cc1nnsc1Cn1ccc2ccc(CCN)cc21 2335920289 FWSLFCGRTDYTIZ-UHFFFAOYSA-N 272.377 2.351 10 10 CECE COC[C@H](C)CCN1CCc2cc(O)c(O)cc2C1 2341208083 CLYWWUUFPINATP-LLVKDONJSA-N 265.353 2.129 10 10 CECE C[C@@H]1C[C@H]2C[C@](C(=O)N3CCC(N=[N+]=[N-])CC3)(C2)O1 2342819260 SITNKSFHDWHPLW-BREBYQMCSA-N 264.329 2.245 10 10 CECE O=C1NCCC[C@@H]1NCc1ccc(N2CCCCC2)cc1 50394747 CUHILOQUFBUNAC-INIZCTEOSA-N 287.407 2.045 10 10 CECE CCCNCc1ccc(OC)c(CN2CCO[C@H](C)C2)c1 50124296 LTMODXXCDPCORV-CQSZACIVSA-N 292.423 2.416 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@]1(C)C(=O)O 300439905 GHQALCDKFXERIU-YMTOWFKASA-N 265.309 2.098 10 10 CECE Oc1ccc(CN[C@H]2C[C@H]3[C@H]4CC[C@@H](C4)[C@@H]23)c(O)c1O 2357253446 NAOABKLXJTWIEB-SLWWCASWSA-N 275.348 2.328 10 10 CECE NCc1ccc(N2CCn3ccnc3C2)cc1C(F)(F)F 62245218 DTSBREDNJIAHGR-UHFFFAOYSA-N 296.296 2.381 10 10 CECE CN1CCc2cc(CNC[C@@](C)(O)c3ccco3)ccc21 123692646 RSQCYDJBJQGREY-QGZVFWFLSA-N 286.375 2.269 10 10 CECE CC[C@@](C)(COCC(=O)N(C)c1ccc(N)cc1)OC 319406294 GBJAHLRLCAZKIK-HNNXBMFYSA-N 280.368 2.063 10 10 CECE NCc1ccc(N2CCC[C@@H](CO)C2)c(Br)c1 212901175 HYAXDKNLKBMPHX-LLVKDONJSA-N 299.212 2.117 10 10 CECE CCc1cc(Br)cc([C@@H](N)CCO)c1O 218863543 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124849055 WQJAUNNIOAANEU-CABZTGNLSA-N 255.745 2.296 10 10 CECE COc1ccc(CN[C@@H](CCO)c2ccco2)c(O)c1 184506613 HDMBXLRJOPLKPM-ZDUSSCGKSA-N 277.320 2.207 10 10 CECE COc1ccc([C@@H](NCCCN)c2ccccc2)c(O)c1 37713300 BWWGOCGCRRBGNY-KRWDZBQOSA-N 286.375 2.429 10 10 CECE Cc1c(F)cc(C(N)=O)cc1NCc1ccc(O)c(O)c1 37120160 LFMQJNIZOQBTPR-UHFFFAOYSA-N 290.294 2.256 10 10 CECE Cc1cc(N(C)Cc2nccn2C)ccc1/C=C\C(=O)O 213717763 FMDGCGJHNMTQFQ-ALCCZGGFSA-N 285.347 2.463 10 10 CECE CCNC[C@H]1CCN(C)[C@@H]1c1ccc(N(C)C)cc1 70281334 SLZOOXCEIKAODW-GDBMZVCRSA-N 261.413 2.355 10 10 CECE COC[C@@H](C)CN1CCN(c2ccc(OC)c(F)c2)CC1 187459231 GADRYTIBJLESGS-ZDUSSCGKSA-N 296.386 2.239 10 10 CECE CC[C@H](NCc1ccc(OC)c(C)c1)C(=O)OC 83384974 VTBPDYGWFSFRLB-LBPRGKRZSA-N 251.326 2.045 10 10 CECE Nc1ccc(OCC[S@](=O)c2ccccc2)cc1 40961239 JQBKHEKWWZMRDO-GOSISDBHSA-N 261.346 2.455 10 10 CECE CC[C@@H](C)N(CCOC)[C@@H](C)C(=O)Nc1ccc(N)cc1 42562018 YTBQXCSUSDGUIE-OLZOCXBDSA-N 293.411 2.343 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N1CC(C(=O)O)C1 86811235 GTJGKULYNJUHBG-ONGXEEELSA-N 261.321 2.265 10 10 CECE CC(C)(C(=O)O)[C@H]1CCCN(Cc2ccc(O)cc2O)C1 135051179 OAHXTLPMBSSZAZ-LBPRGKRZSA-N 293.363 2.421 10 10 CECE CS[C@@H]1CC[C@@H](Nc2c(N)cccc2C(N)=O)C1 235099563 RXFWXUWMQCTUFN-RKDXNWHRSA-N 265.382 2.064 10 10 CECE CCCC1CCC(NCCN=[N+]=[N-])(C(N)=O)CC1 90258144 LLESUTPKBRXFFO-UHFFFAOYSA-N 253.350 2.101 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CCOC)cc1O 93670793 PHBPCOXXNQVJFA-NSHDSACASA-N 252.358 2.145 10 10 CECE O=C(Nc1cccc(Cl)n1)c1ccc(O)c(O)c1 236572490 LXSHKEYFZIWXKA-UHFFFAOYSA-N 264.668 2.399 10 10 CECE CCC[C@H]1CCC[C@@](NCCN=[N+]=[N-])(C(N)=O)CC1 90258113 KOOWNGDFCYYZMR-AAEUAGOBSA-N 267.377 2.491 10 10 CECE CCc1cc(C[C@H](N)c2ccc(N(C)C)cc2)n(C)n1 97277050 GGPZFIUGSDVWBP-INIZCTEOSA-N 272.396 2.291 10 10 CECE C[C@@H](CC[S@](C)=O)Nc1c(N)cccc1Cl 230085378 LARSKHXQXKMCJO-PWJLMRLQSA-N 260.790 2.491 10 10 CECE Cc1cc(Br)cc([C@@H]2COCCN2)c1O 95719079 JZMYQAHVLMOQBO-JTQLQIEISA-N 272.142 2.124 10 10 CECE COc1cc(O)c(CN(C)C[C@H]2CCC[C@H]2O)cc1OC 245645431 FRMZVGRFCXCLKT-DGCLKSJQSA-N 295.379 2.002 10 10 CECE CN[C@@H](C)c1cc(Br)c(F)c([N+](=O)[O-])c1O 380476441 MXSOYQHJSLSAFA-BYPYZUCNSA-N 293.092 2.482 10 10 CECE CN1CCc2cc([C@H](O)c3cc(F)ccc3N)ccc21 2163064922 ZFYIBSANELQNAM-INIZCTEOSA-N 272.323 2.482 10 10 CECE CCN1CCc2cc([C@@H](O)C[C@@H](CN)C3CC3)ccc21 2163077180 UHSXUYAWOQPLLS-RDJZCZTQSA-N 274.408 2.477 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)C1[C@H]2COC[C@H]12 2163101720 DNOLCONBXWKAEN-GRDNDAEWSA-N 272.392 2.222 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@@](N)(CC)COC)cc1 2163109923 DKORLNMINPMIEE-HZPDHXFCSA-N 280.412 2.320 10 10 CECE CCOC(=O)/C=C/CN1CCCc2cc(CN)ccc21 700925168 TUDPNWNZYGKCSX-GQCTYLIASA-N 274.364 2.017 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCC[C@@H](N)[C@H]2C)c1 394645884 IVRJTACKOVLQEY-JTNHKYCSSA-N 264.369 2.273 10 10 CECE COCC[C@H](COC)N(C)c1ccc([C@H](C)N)cc1F 2165980319 XAWYPWJWPMIUJA-WCQYABFASA-N 284.375 2.333 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1ccc(C(=O)O)o1 2164152069 RFQINHJQCWZVGG-CQSZACIVSA-N 274.320 2.353 10 10 CECE NC[C@H]1CN(c2ccc(OC(F)(F)F)cc2)CCCO1 2162649552 NDCGBEIKFGGAEI-LBPRGKRZSA-N 290.285 2.139 10 10 CECE CC1(C)OCCC[C@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 2130460528 JOLOQCPYJDLCQN-NSHDSACASA-N 266.345 2.493 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@@H]2C2CC2)c(Cl)c1 2130608720 VLMSULWTQXNNMW-GJZGRUSLSA-N 280.799 2.409 10 10 CECE CC(=O)C[C@@H](C)NC(=O)c1cc2cc(O)c(O)cc2s1 901170988 FUMQEOXYIGFLSA-SSDOTTSWSA-N 293.344 2.410 10 10 CECE CN(C/C=C/c1ccc(N(C)C)cc1)C[C@@H]1COCCO1 827140354 KWLSCFYHBPSQJJ-LAQIPUCWSA-N 290.407 2.113 10 10 CECE CN1CCc2cc(CNC3(C)CCOCC3)ccc21 131187224 OPIPPGBEYSXJLM-UHFFFAOYSA-N 260.381 2.338 10 10 CECE CC[C@@H](C)C[C@H](NC(=O)c1cc(O)cs1)C(=O)OC 844146651 IAGWRJTWBRLLRP-SCZZXKLOSA-N 285.365 2.161 10 10 CECE C[C@H]1CCNC[C@H]1NCc1cc(Br)ccc1O 841059576 UUTXMQQXLMKTCB-JOYOIKCWSA-N 299.212 2.242 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCCN2C)[C@@H]1[C@H]2CN[C@H]1C2 925530102 BPEBOTFCLOQZJE-GMLZMKKNSA-N 285.435 2.155 10 10 CECE C[C@H]1CCn2ncc(C(=O)Nc3ccc(N)cc3)c2C1 843291968 GRXMLLXJOHLUPE-JTQLQIEISA-N 270.336 2.300 10 10 CECE CCOc1ccc(CNc2cncc(OC)n2)c(O)c1 843303124 IQCIPQUTKDYOOH-UHFFFAOYSA-N 275.308 2.202 10 10 CECE O=C(N[C@H](CO)CCc1ccccc1)c1cc(O)cs1 928256600 ZCJIHFPWACFXJI-LBPRGKRZSA-N 291.372 2.177 10 10 CECE CSc1ncc(CN[C@@H](C)c2cn[nH]c2)s1 2243832071 HKSBTXUKSRLAML-ZETCQYMHSA-N 254.384 2.439 10 10 CECE O=C(O)/C=C\c1ccc(N2CC[C@@]3(CCOC3)C2)cc1 687919979 AJHUXVZQNLAVIL-QQNRWZHASA-N 273.332 2.401 10 10 CECE Nc1ccc(O)c(CNc2cc(C(F)(F)F)ncn2)c1 697478960 GRSRDWJNUSYQFB-UHFFFAOYSA-N 284.241 2.395 10 10 CECE CCO[C@H](CN[C@@H](C)c1cc(OC)ccc1O)CN(C)C 926958931 IPKLUTDXCPWPNN-GXTWGEPZSA-N 296.411 2.018 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)CC1(C)COC1 929527314 KRHWXBYNNMYNSR-UHFFFAOYSA-N 276.380 2.138 10 10 CECE CC(C)C[C@@H](N)CC(=O)N[C@H](C)c1ccccc1O 1340915395 FCZXUFOJCJEBTP-VXGBXAGGSA-N 264.369 2.333 10 10 CECE CC[C@H](NC[C@@H](O)c1ccnn1C)c1ccc(C)cc1O 927125574 AEFLQSGFOYWOGQ-XJKSGUPXSA-N 289.379 2.208 10 10 CECE C[C@H](N[C@@H](CO)C1CCC1)c1cc([N+](=O)[O-])ccc1O 850490070 VJFRVHXVKZOUNB-ZANVPECISA-N 280.324 2.112 10 10 CECE Cn1ncc(Br)c1C(=O)Cc1ccc(N)cc1 164082053 YJLDYMXRHYPGQA-UHFFFAOYSA-N 294.152 2.190 10 10 CECE O=C(Nc1cc2n(n1)CCCC2)N1Cc2cccc(O)c2C1 931399364 CZCMSZUHIMWWJO-UHFFFAOYSA-N 298.346 2.473 10 10 CECE C[C@H]1C[C@H]1NC(=N)NCc1ccc(N2CC=CC2)cc1 864462689 WQGZIGXCEMFWGH-SWLSCSKDSA-N 270.380 2.085 10 10 CECE Cc1cc(NS(=O)(=O)N2CCC[C@H]2C)c(C)c(C)c1O 775289929 WNPFUHFRCIEIOD-SNVBAGLBSA-N 298.408 2.458 10 10 CECE O=C(N[C@H]1c2ccccc2CC[C@H]1O)c1cc(O)cs1 886712160 VBHKSYFKWGFQHV-OCCSQVGLSA-N 289.356 2.232 10 10 CECE CC[C@H]1CN(CCN2CCCC2)c2ccc(CN)cc2O1 74337912 INESBVWORPOQSJ-HNNXBMFYSA-N 289.423 2.219 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])c1cccc(F)c1 90257159 DXQVBVPKAWBLAW-LBPRGKRZSA-N 266.276 2.114 10 10 CECE Nc1ccc(-n2cc(-c3ccc4c(c3)OCCO4)nn2)cc1 75495463 IJEFCNIUGAIVQH-UHFFFAOYSA-N 294.314 2.288 10 10 CECE CC[C@@H]1CN(CCC(=O)O)c2cc(OC)c(OC)cc2N1 76929946 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C[C@H](Cc1cccs1)NC(=O)COc1ccc(N)cc1 70143120 FIAZDTKJHLSFIZ-LLVKDONJSA-N 290.388 2.457 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])c1nccs1 131865041 UBIWKXKNMMOPQT-MRVPVSSYSA-N 269.330 2.037 10 10 CECE CO[C@H](C)CN(C)Cc1cc(C(C)=O)ccc1O 380658870 GUSWMLXEPBUHRG-SNVBAGLBSA-N 251.326 2.062 10 10 CECE CCCCN(CC(N)=O)c1ccc(CNC2CC2)cc1F 42691754 VCIHDXGIDXPGIM-UHFFFAOYSA-N 293.386 2.170 10 10 CECE C[C@H](NCCc1nccs1)c1c(O)cccc1O 235522103 SBIZGAGVLSUDKK-VIFPVBQESA-N 264.350 2.448 10 10 CECE CNCc1ccc(OC)c(CS[C@H](C)[C@H](C)O)c1 234416347 SESFJTPMNGRUKT-WDEREUQCSA-N 269.410 2.417 10 10 CECE CC(C)COCCOCCOc1ccc(N)cc1 232627649 XRXRNAZQGPHCTH-UHFFFAOYSA-N 253.342 2.337 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1O 251617598 HJMBCNXCZJWMLZ-MXWKQRLJSA-N 250.342 2.026 10 10 CECE CN1CCc2cc([C@H](CN)N3C[C@H]4CCC[C@@H]4C3)ccc21 252706445 UCSSJEQMVBMARM-NUJGCVRESA-N 285.435 2.411 10 10 CECE C[C@@H]1C[C@](N)(c2ccc3c(c2)CCN3C)c2nccn21 2163065937 GGZNCNJCCNTWTQ-BZNIZROVSA-N 268.364 2.042 10 10 CECE C[C@@H]1C[C@@](N)(c2ccc3c(c2)CCN3C)CN1C1CC1 2163071177 MGNUSJKOQPATKS-PXAZEXFGSA-N 271.408 2.090 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3[C@H]4COCC[C@@H]43)ccc21 2163078021 YWOCCEXZCALAAQ-DIECFANBSA-N 272.392 2.351 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCCN3C)C[C@@H]1CCN 2163111295 QFSHRQDDRXHZGF-ZFWWWQNUSA-N 273.424 2.490 10 10 CECE Cc1nn(C)cc1[C@@H](N)c1ccc(N2CCCC2)cc1 2163136319 RWGZZWPXFKEOMS-INIZCTEOSA-N 270.380 2.377 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@](C)(O)COCC 2163136628 VOYKROGTBRWSQJ-HZPDHXFCSA-N 280.412 2.191 10 10 CECE CN1CCc2cc([C@@H](CC[C@@H]3CCCO3)NN)ccc21 2163142499 GDIZXODNHKVRIB-LSDHHAIUSA-N 275.396 2.143 10 10 CECE CCO[C@@H]1C[C@H](OC)CN(c2ccc([C@H](C)N)cc2)C1 2165448820 IVQMGVSDWRSQFF-VBNZEHGJSA-N 278.396 2.337 10 10 CECE CC(C)NCc1ccc(N2C[C@]3(CO)C[C@@]3(C)C2)cc1 2165465856 XNTCLAWLHCWSOS-IRXDYDNUSA-N 274.408 2.393 10 10 CECE NCc1ccc(N2CC([C@@H](F)CO)C2)c2ccccc12 2166898324 FVSBXQZBGRLMSK-HNNXBMFYSA-N 274.339 2.065 10 10 CECE CN(Cc1cc(Cl)c(F)cc1O)[C@@H]1CCOC1 295228527 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Oc1c(Cl)cccc1CNC[C@]1(O)C[C@H]2C=C[C@H]1C2 827196504 KTSVAOYBZYXYDR-ITDIGPHOSA-N 279.767 2.462 10 10 CECE CCCN(Cc1ccccc1O)C(=O)N[C@H](C)[C@@H](C)N 842009208 ZZNPWXAJSPIGBB-VXGBXAGGSA-N 279.384 2.050 10 10 CECE CCO[C@@H]1CCC[C@H]1NC(=O)NCc1c(O)cccc1F 922793724 HPGXOKMDXFFEFM-TZMCWYRMSA-N 296.342 2.288 10 10 CECE O=C(NCC1=CCCC1)NCc1c(O)cccc1F 923324677 YXOWPRWSZSZNQD-UHFFFAOYSA-N 264.300 2.441 10 10 CECE CC(=O)N1CC[C@@H](NCc2c(O)cc(C)cc2Cl)C1 856811316 GIQHONYHHFQUPS-LLVKDONJSA-N 282.771 2.064 10 10 CECE CCN(C[C@@H]1C[C@@H]1C)c1ccc2c(c1)NC(=O)[C@H]2NC 698390783 HSDKRWIYQIBWDG-PGUXBMHVSA-N 273.380 2.382 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 866769282 JORHNDVNFYIDDC-NAWOPXAZSA-N 273.332 2.006 10 10 CECE C[C@H](NCCOCC(=O)OC(C)(C)C)c1ccccc1O 866437577 KBNAUYRRHCBDKD-LBPRGKRZSA-N 295.379 2.401 10 10 CECE COc1ccc(NCc2cc(OC)ccc2O)nc1 776251290 UXIQEMLTYGOINT-UHFFFAOYSA-N 260.293 2.417 10 10 CECE CCCCN(CCO)c1ccc(CN)c(Cl)c1 61846064 QZVRLJKLJSSWEZ-UHFFFAOYSA-N 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2338777683 DYNZTPLHSRDYTO-VZAMPYOESA-N 262.397 2.420 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc(CN)c(C2CC2)c1 2339144592 ZKNBUSDFJGBJJE-NWDGAFQWSA-N 260.381 2.230 10 10 CECE O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2O)C12CCC2 2339430911 FZLQIEYXAVGDPF-NSHDSACASA-N 281.739 2.485 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCN[C@@H]2CCC[C@H]21 2341932492 ARVRHKXUOKQSRT-LERXQTSPSA-N 264.344 2.419 10 10 CECE COc1cc(Cl)c(N2C[C@H]3C[C@H]2C[C@@H]3O)c(OC)c1 2342305852 GIOPQUUHRGYJJK-PTRXPTGYSA-N 283.755 2.317 10 10 CECE CCN1CCCN(CCCc2ccc(N)cc2)C1=O 2353512071 ZMOLGNDKHNIDQR-UHFFFAOYSA-N 261.369 2.349 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CCN1[C@H](C)c1c(O)cccc1O 2353890842 OGZSPWSWLSDRPL-AXFHLTTASA-N 279.336 2.344 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c(F)c1 2355619738 IJJHFZZENNUKNG-APHBMKBZSA-N 278.371 2.283 10 10 CECE CCc1c(C)nn(C[C@@H](O)COc2ccc(N)cc2)c1C 51327359 PZANBKXPHNQZHY-CQSZACIVSA-N 289.379 2.084 10 10 CECE C[C@@H]1CN(Cc2cccc(Br)c2O)CCN1C 133892091 PUFCCCSUYTUMFR-SNVBAGLBSA-N 299.212 2.291 10 10 CECE C[C@H]1Cc2ccccc2N1C(=O)c1cc(O)nc(O)c1 170223488 WDYIXDKFFOPANA-VIFPVBQESA-N 270.288 2.084 10 10 CECE [N-]=[N+]=NCCCNC(=O)/C=C\c1cccc([N+](=O)[O-])c1 104473475 KWAAWULBSCVNFQ-WAYWQWQTSA-N 275.268 2.425 10 10 CECE COCCNCc1ccc(N2C[C@H](C)OC[C@@H]2C)c(C)c1 62735859 SVRAGFCUOOZBRJ-GJZGRUSLSA-N 292.423 2.345 10 10 CECE CCCCOCCOCCOc1ccc(N)cc1 36985971 AIDMZGYKPIWDRM-UHFFFAOYSA-N 253.342 2.481 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](C)C[C@H](O)C2)c(F)c1 401729160 BYOWZLOSRPNPRI-JQWIXIFHSA-N 284.350 2.281 10 10 CECE CCCN1C(=O)CC[C@H](N)[C@@H]1c1ccc2c(c1)CCN2C 70986294 XWUMMYXDKZJKNL-YOEHRIQHSA-N 287.407 2.080 10 10 CECE COc1ccc(CN(C)[C@H](C)c2cnn(C)c2)c(O)c1 180978749 XGDARFCEEMALOJ-LLVKDONJSA-N 275.352 2.327 10 10 CECE Oc1c(F)cccc1CNCCN1CCCCC1 158739896 WSZVLDMBJKSBPI-UHFFFAOYSA-N 252.333 2.107 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccccc1 186401731 HAZBULHPUCHODK-GFCCVEGCSA-N 285.343 2.388 10 10 CECE CCNCc1ccc(N(C)CC[C@H](C)O)cc1C 135586906 WSTCIMAVTSJJGR-ZDUSSCGKSA-N 250.386 2.312 10 10 CECE Fc1cc(OC[C@H]2CCCCO2)ccc1N1CCNCC1 87439201 TYMCLYXEMOMXLG-CQSZACIVSA-N 294.370 2.183 10 10 CECE FCCCOc1ccc(N2CCCNCC2)cc1 161071728 XFBDALJHCZPCQG-UHFFFAOYSA-N 252.333 2.225 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@](C)(O)C2)c(Cl)c1 235220832 JXMCJWGVBAVNJE-NOZJJQNGSA-N 254.761 2.321 10 10 CECE CCNCc1ccc(N2CCC[C@@H]2CO)cc1Cl 233524678 ULPQVJQLAIPZJL-CYBMUJFWSA-N 268.788 2.411 10 10 CECE CO[C@@H]1CN(c2ccc(CN)cc2F)CC[C@@H]1C 230221707 NJIQNDCWKAFBQI-IINYFYTJSA-N 252.333 2.146 10 10 CECE CCOc1cccc(CN[C@@H]2CC[C@](C)(O)C2)c1O 2130304051 UWSCGSYDFKRSOR-DOMZBBRYSA-N 265.353 2.184 10 10 CECE COc1ccc(N2CCN3CCC[C@@H]3C2)cc1F 94448123 ZGIWEFUWCJXGNY-GFCCVEGCSA-N 250.317 2.119 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H](O)C2)cc1Br 235509376 NWXVOMQRPISPGM-ONGXEEELSA-N 299.212 2.430 10 10 CECE C[C@@H](O)c1c(O)c(O)cc(Br)c1F 258466448 WRNKMDXLCWPMNS-GSVOUGTGSA-N 251.051 2.053 10 10 CECE C[C@H]1COCC[C@H]1NCc1ccc(N2CCOCC2)cc1 277981245 TYYDGQJTNROULE-WMLDXEAASA-N 290.407 2.038 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCO[C@]2(CCOC2)C1 371514270 LPVDWWQIARPLJJ-SWLSCSKDSA-N 297.782 2.473 10 10 CECE CC[C@@H](NCCCN1CCOC1=O)c1ccc(F)cc1O 285916422 DMUSYVNCNXBLCB-CYBMUJFWSA-N 296.342 2.414 10 10 CECE CN(C)c1ccc(CNC(=O)N[C@@H]2CSC2(C)C)cc1 283657313 RAPKQWFOHJDSSC-CYBMUJFWSA-N 293.436 2.446 10 10 CECE CC(=O)C(=O)COC(=O)C1(c2cccc(Cl)c2)CC1 808505262 WMPAVYVKNUXZMT-UHFFFAOYSA-N 280.707 2.073 10 10 CECE CN1CCc2cc([C@@H](O)C(C)(C)[C@@H]3CCCN3)ccc21 2163073549 KDKYSRCCFYZERQ-JKSUJKDBSA-N 274.408 2.491 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@]23CCC[C@H]2OCC3)cc1 2163097028 KOGUKLMRSGVUMD-OWCLPIDISA-N 275.396 2.216 10 10 CECE COc1cccc(O)c1CNC[C@@H](O)Cc1ccccc1 808422327 IZANQGHVIKDFNK-AWEZNQCLSA-N 287.359 2.094 10 10 CECE CN1CCCc2cc(N3CC[C@H]4CC[C@@H](C3)N4)ccc21 2163102376 KBMGJXIZRWLJSB-CABCVRRESA-N 271.408 2.400 10 10 CECE CN(C)c1ccc([C@@H](CN2CCCCCC2)NN)cc1 2163131534 RZLVQBKRTFXSTE-MRXNPFEDSA-N 276.428 2.133 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@@H]2C[C@@H]3OCC[C@H]3O2)C1 2163198635 MOPUTZUSYOEPPM-FQUUOJAGSA-N 280.372 2.345 10 10 CECE Cc1cc(CN)ccc1N1C[C@@H](C(F)(F)F)[C@@H](CO)C1 2163291594 GMYMBEURYATUAH-VXGBXAGGSA-N 288.313 2.061 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](CO)OCC2(C)C)cc1Cl 2167526738 KKDKQGCQDGCTQA-JQWIXIFHSA-N 298.814 2.336 10 10 CECE C[C@@H](c1ccc(Br)cc1O)N1CCNCC1 396682907 MKTXGGOJYLICPT-VIFPVBQESA-N 285.185 2.121 10 10 CECE CC(F)(F)[C@@H]1C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 2164451933 FNFMAVUFWXWPDM-VHSXEESVSA-N 285.290 2.048 10 10 CECE [N-]=[N+]=NCCC[S@](=O)c1ccccc1[N+](=O)[O-] 42416671 MFMWWNBDTLQPEJ-QGZVFWFLSA-N 254.271 2.403 10 10 CECE C[C@@H]1CCCN(c2ccc3c(c2)OCCO3)[C@@H]1CCN 2162655307 IVUDFYJPXIFOEA-TZMCWYRMSA-N 276.380 2.412 10 10 CECE COC(C)(CCNCc1ccc(N(C)C)cc1)OC 711024326 JHBDGVPEZCJTIE-UHFFFAOYSA-N 266.385 2.241 10 10 CECE COc1cccc(CNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)c1O 817548580 BRPPRCNGWUNUPH-NQBHXWOUSA-N 275.348 2.453 10 10 CECE CN(Cc1ccccc1O)c1nc(N)nc2c1CCCC2 825881486 VCJOEGRQFPPEJT-UHFFFAOYSA-N 284.363 2.280 10 10 CECE F[C@@H]1CCN[C@H](c2ccc(N3CCOCC3)cc2)C1 1952700754 UFJFVISNPYEGKV-HIFRSBDPSA-N 264.344 2.286 10 10 CECE O=C(/C=C\[C@@H]1CCCO1)NCc1cc(Cl)ccc1O 846475637 DJGIDELRCMIHSX-RNZFLTOJSA-N 281.739 2.397 10 10 CECE CCOc1ccc(O)c(CN[C@@H](CN)C2CCCC2)c1 841085615 AACMKWOTOASZAK-HNNXBMFYSA-N 278.396 2.398 10 10 CECE O=C(NCCOC1CCCC1)NCc1c(O)cccc1F 914258528 XXRJGWZQMGLJOK-UHFFFAOYSA-N 296.342 2.290 10 10 CECE Nc1ccoc1C(=O)NCc1c(O)ccc2c1CCCC2 1331831534 FWOZIEPEKFAFBP-UHFFFAOYSA-N 286.331 2.376 10 10 CECE COCC1(CN[C@@H](C)c2cc(C(=O)OC)ccc2O)CC1 848560223 AUDGMJXFSBDGHQ-NSHDSACASA-N 293.363 2.256 10 10 CECE CCCCO[C@@H](C)C(=O)NCc1c(O)cccc1F 928712636 UYQUCFGUMGMVAK-JTQLQIEISA-N 269.316 2.353 10 10 CECE CO[C@@H]1CCCC[C@H]1C(=O)NCc1c(O)cccc1F 928706972 YTCUBTUQVFLYBA-QMTHXVAHSA-N 281.327 2.353 10 10 CECE O=C(NC[C@@H]1CCC[C@@H]2C[C@H]12)c1c(F)ccc(O)c1O 857321764 RPWLTGGJTWFZFL-UTLUCORTSA-N 279.311 2.403 10 10 CECE CCC(C)(C)CC(=O)NCc1cc(N)ccc1O 696659717 PANNGUYCAFHTEK-UHFFFAOYSA-N 250.342 2.417 10 10 CECE CCC1(N)CC(NCc2cnc(SC)s2)C1 2243833045 PQKOPEBRODYYRT-UHFFFAOYSA-N 257.428 2.225 10 10 CECE CCNC[C@@H]1CCN(c2ccc(OC)cc2OC)C1 53011731 FAKLAPDERWUJKM-LBPRGKRZSA-N 264.369 2.140 10 10 CECE Cc1ccc(O)c(CNC(=O)[C@H]2C[C@]2(C)Br)c1 862753487 DLFYTJNZNAIIBO-MFKMUULPSA-N 298.180 2.490 10 10 CECE COC(=O)c1cc(OCc2cc(C)on2)ccc1N(C)C 865395544 VJEFYYBLUNDOQQ-UHFFFAOYSA-N 290.319 2.415 10 10 CECE Nc1nc(C2CCCC2)nc(N2Cc3cccc(O)c3C2)n1 866116859 CSSZYFDKFKQFBD-UHFFFAOYSA-N 297.362 2.337 10 10 CECE CNC(=O)[C@H]1CCCCN1[C@H](C)c1ccc(C)cc1O 133041069 WKVCVMQAFBMSGT-TZMCWYRMSA-N 276.380 2.362 10 10 CECE Oc1c(F)cc(Cl)cc1CNC[C@@H]1CCCO1 775791381 HCYCYUQDAGZZCF-JTQLQIEISA-N 259.708 2.453 10 10 CECE C[C@H]1CN(c2c(F)cc(CN)cc2F)C[C@H](C)O1 62709100 YSPONTRENDUKFL-IUCAKERBSA-N 256.296 2.037 10 10 CECE Cc1cn2c(n1)CN(Cc1cc3c(cc1O)CCC3)CC2 782276312 KGXJYTSPXMNYQX-UHFFFAOYSA-N 283.375 2.402 10 10 CECE CC[C@@]1(C)CN(CCCO)c2ccc(OC)cc2N1 76931124 XSMDIVVNFJSEDW-HNNXBMFYSA-N 264.369 2.478 10 10 CECE 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CCNCc1cc(OC)ccc1N1CCC[C@@]1(C)CO 2235969025 YNTVQSIOLRRULR-INIZCTEOSA-N 278.396 2.156 10 10 CECE COc1ccc(N2CCOCC[C@@H]2C)c(C[C@H](C)N)c1 2235981257 MNRQUXZRGXUXFI-STQMWFEESA-N 278.396 2.200 10 10 CECE C[C@@H]1C[C@@H]1CC[C@@H](N)[C@@H](O)c1ccc2c(c1)CCN2C 2236445959 BLKOISPATLDWKM-LRHZJYQRSA-N 274.408 2.476 10 10 CECE OC[C@H]1[C@H]2CC[C@@H](C2)N1c1ccc2c(c1)CCCO2 2226661962 KFCXLXKYPLQCKQ-WHOFXGATSA-N 259.349 2.361 10 10 CECE COc1cc(C)c(N2C[C@@H]3C[C@@H](CO)[C@@H]3C2)cc1C 2226756156 AEPQZZBXWPMAJJ-MELADBBJSA-N 261.365 2.377 10 10 CECE OCC[C@H]1CN(c2ccc3c(c2)CCCC3)CCO1 2226765097 KNTADROTRVAKHA-INIZCTEOSA-N 261.365 2.153 10 10 CECE CN(c1ccc2c(c1)COCC2)[C@@H](CO)CC1CC1 2226711155 PRLKTFXBMLXZFX-MRXNPFEDSA-N 261.365 2.357 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)CCN3C)C[C@@H]1CO 2226811258 YDKQMEUAZWWJJI-GXTWGEPZSA-N 260.381 2.134 10 10 CECE CN(C)c1ccc(CNc2cnn3c2OCCC3)cc1 2237191196 CIOMORISSMLFJX-UHFFFAOYSA-N 272.352 2.344 10 10 CECE CNCc1cc(OC)ccc1N1C[C@H](F)C[C@@H](F)C1 2227675490 IJFRSYGNFVUPRK-VXGBXAGGSA-N 270.323 2.301 10 10 CECE CN1CCCc2cc([C@@H](N)c3ncncc3F)ccc21 2238047938 LVXSBVZDJRUNMJ-CQSZACIVSA-N 272.327 2.046 10 10 CECE CC1=CC[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)CC1 2229084486 XYDDFPFMHZLZSL-SNVBAGLBSA-N 263.293 2.032 10 10 CECE CC[C@@H](C)NCc1cc(OC)ccc1N1CC[C@H]1CO 2240026315 MPDCCRFJXFAHFG-OCCSQVGLSA-N 278.396 2.154 10 10 CECE Nc1ccc(OC[C@@H]2Cc3ccccc3CN2)cc1 2278978071 NWONBCHVYWBQCA-HNNXBMFYSA-N 254.333 2.362 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)[C@H]1CCN(C)C(=O)C1 2240827989 CYILYRDDLNDSNS-JSGCOSHPSA-N 276.380 2.105 10 10 CECE COc1cc(C(=O)O)cc(Sc2nccs2)n1 2252950541 HXNJHWOTZSZIRG-UHFFFAOYSA-N 268.319 2.396 10 10 CECE CSc1ncc(CNC[C@@]23CCOC[C@@H]2C3)s1 2248594286 VOCWFSOFACVABJ-CABZTGNLSA-N 270.423 2.381 10 10 CECE O=C(O)[C@@H]1C[C@@H]2[C@@H]1CCN2Cc1c(O)cccc1Cl 2270879326 JYXKKSYZPHNKGU-KBVBSXBZSA-N 281.739 2.341 10 10 CECE COC[C@@]1(C)C[C@H]1CN(C)c1ccc(OC)cc1N 2269264996 HVPOJHYWVNKTHS-XHDPSFHLSA-N 264.369 2.386 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](S(C)(=O)=O)CC[C@H]2C)cc1 2279402714 SLSWMMLLYMQILO-LALPHHSUSA-N 297.420 2.142 10 10 CECE Cc1cc(N2C[C@H]3C[C@H](O)C[C@H]3C2)ccc1[C@@H](C)O 2269691099 RTPREBGEGVIVLR-CXTNEJHOSA-N 261.365 2.255 10 10 CECE CC[C@@H](NCCN(C)C(=O)C1CC1)c1ccccc1O 2280524009 QNLSSEUDDSOZBG-CQSZACIVSA-N 276.380 2.301 10 10 CECE C[C@H]1COC(C)(C)CN1C(=O)CCc1ccc(N)cc1 2284151202 OZIQNHWNJSAZHR-LBPRGKRZSA-N 276.380 2.227 10 10 CECE Cc1cc(N2CCc3ncn(C)c3C2)ccc1[C@H](C)N 2285132178 UHBPJMXSZOYYAN-LBPRGKRZSA-N 270.380 2.311 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)ccc1[C@H](C)N 2285128170 MKLLHTYQOGCCGN-NVKYKHFLSA-N 272.392 2.220 10 10 CECE CC1(C)OCCN(c2ccc(OC(F)F)cc2)[C@@H]1CO 2295990833 CONJZTQGDJCHJA-GFCCVEGCSA-N 287.306 2.264 10 10 CECE CN1CCc2cc(CN[C@H]3C[C@@]4(C)CO[C@H]3C4)ccc21 2286254426 HCUZMPFUMUSKNH-BHYGNILZSA-N 272.392 2.336 10 10 CECE Nc1ccc(OCC(=O)N2CCC3(CC=CC3)C2)cc1 2287019983 FOPJQOCVALSYSK-UHFFFAOYSA-N 272.348 2.216 10 10 CECE CP(C)(=O)[C@@H]1CN(CCCc2ccc(N)cc2)CCO1 2289226176 UZMQTYGPMOLIHZ-OAHLLOKOSA-N 296.351 2.482 10 10 CECE CC1(C)COC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2314641706 BBKBFKARHVNBST-UTLUCORTSA-N 252.318 2.007 10 10 CECE CC(C)[C@@H](CO)N(C)CCCc1ccc(N)cc1 2318852288 LVYPOWKFSZGIOR-OAHLLOKOSA-N 250.386 2.150 10 10 CECE COc1ccc(N2CC(F)(F)[C@](C)(CN)C2)cc1 2326708966 BFCINMKJSDGTTJ-GFCCVEGCSA-N 256.296 2.116 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H](C(=O)O)[C@@H](F)C1 2329588833 TVJHABNWDSFCQS-DLOVCJGASA-N 267.300 2.198 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3CCOC[C@@H]32)ccc1CO 2331284060 UDRJONXDWOMCRH-JYJNAYRXSA-N 261.365 2.206 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1 2333105180 QQSCAAVFMOZKDT-XZDPQHSOSA-N 260.381 2.174 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1c1ccc2c(c1)CC[C@@H]2O 2336808294 GNQNHHXBHDLLRA-HRCADAONSA-N 261.365 2.406 10 10 CECE CCN(CCN=[N+]=[N-])C[C@@H]1CC2(CCOCC2)CO1 2337776581 GCHXWKCEWXOZLQ-LBPRGKRZSA-N 268.361 2.204 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1cccc2nc[nH]c12 2337777782 WEOMXPGVNQUFEE-UHFFFAOYSA-N 258.285 2.335 10 10 CECE Oc1cccc(CN[C@H]2CCc3cccnc32)c1O 2337868552 OEAWEEAJIJGHOY-LBPRGKRZSA-N 256.305 2.270 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H]3C[C@H](O)[C@H]3C2)c1C 2340859252 INXFOLKLDNKIIX-DUPGQFARSA-N 260.381 2.140 10 10 CECE CC(C)[C@@H]1C[C@@H](O)CN1c1ccc2c(c1)COCC2 2344593730 BMAUUYPEKZNHLE-CVEARBPZSA-N 261.365 2.355 10 10 CECE C[C@H]1CC[C@@H](C(=O)N(C)[C@@H](C)c2ccccc2O)CN1 2354101819 AMVKNKCXSZLJDF-RWMBFGLXSA-N 276.380 2.300 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@]2(C)C[C@@]2(C(=O)O)C1 2354741764 MQXWWJIWSFIPIH-AMFBXLIHSA-N 279.311 2.389 10 10 CECE COc1ccc([C@@H](C)NC[C@@H]2[C@@H]3CCOC[C@@H]32)c(O)c1 2355950333 QDWTTWABPAPRPS-KAOXEZKKSA-N 277.364 2.334 10 10 CECE Cc1cc(N(C)C[C@@H](C)O)ccc1CNC(C)C 51839129 IRERGLIZELMERV-CYBMUJFWSA-N 250.386 2.310 10 10 CECE COc1ccc(N2CCN([C@H](CN)C(C)(C)C)CC2)cc1 58492368 PYICCHHAZRUQTJ-MRXNPFEDSA-N 291.439 2.191 10 10 CECE CCCCNC(=O)[C@H](C)OCc1ccc(N)cc1 20390997 KQGRUOPHPKOJJH-NSHDSACASA-N 250.342 2.090 10 10 CECE Cc1cc(NC(=O)N(C)Cc2ccccc2O)on1 171146372 MAPPYFIUPKZGST-UHFFFAOYSA-N 261.281 2.353 10 10 CECE CCN(CC)C(=O)[C@H](C)N(c1ccc(CN)cc1)C1CC1 34655501 URXAWOHCVZRBIS-ZDUSSCGKSA-N 289.423 2.371 10 10 CECE C[C@@H](NC(=O)[C@]12CC[C@H](C[C@@H]1N)C2)c1ccccc1O 2357204258 IHMGZOAQPRWTPA-XYJYNPGVSA-N 274.364 2.087 10 10 CECE COc1ccc(N2CCN(CCC[C@H](C)CN)CC2)cc1 123596211 COJNRQZDOCGTDL-HNNXBMFYSA-N 291.439 2.192 10 10 CECE Nc1ccc(CCN2C(=O)Cc3ccccc3C2=O)cc1 35677265 PPCCBDYRPYEUOQ-UHFFFAOYSA-N 280.327 2.036 10 10 CECE CNCc1ccc(N2CC[C@@H](CCO)C2)c(Cl)c1 123792321 DVFGFTZPTJLBBN-NSHDSACASA-N 268.788 2.268 10 10 CECE CN(C)c1ccc2c(c1)OCCN2Cc1nc(C2CC2)n[nH]1 182586367 FYYLMZAUNGMKKL-UHFFFAOYSA-N 299.378 2.147 10 10 CECE CCCNCc1ccc(N(C)C(C)(C)CO)cc1 126842287 VUUOOSZWRSTNRI-UHFFFAOYSA-N 250.386 2.393 10 10 CECE Oc1ccc(Cl)cc1CN1C[C@@H]2CC[C@H](C1)O2 211694877 IWWPYCCXSYCWFH-TXEJJXNPSA-N 253.729 2.409 10 10 CECE O=C(NCc1ccccc1O)C(F)(F)C(F)(F)F 236561034 XOHBLALFJPAVBW-UHFFFAOYSA-N 269.169 2.206 10 10 CECE CN(C)c1ccc([C@H]2[C@H](CN)CCCCN2C)cc1 70278160 HSMWTRYFXABODK-HOCLYGCPSA-N 261.413 2.484 10 10 CECE CCN1CCC(CNC(=O)CCc2ccc(N)cc2)CC1 44515062 BUKJUROCYYBGRA-UHFFFAOYSA-N 289.423 2.050 10 10 CECE CCCCNC(=O)NC(=O)[C@H](C)Sc1nccs1 48876105 AYHRRKLWZQMRCL-QMMMGPOBSA-N 287.410 2.250 10 10 CECE CS[C@@H](C)CCNCc1ccc(O)c(O)c1O 226753378 ARJPVMOLTRDBHM-QMMMGPOBSA-N 257.355 2.035 10 10 CECE COC[C@H](C)[C@H](C)N[C@H](C)c1ccc(O)cc1O 381275392 STVHQGDOLIYDMR-GARJFASQSA-N 253.342 2.419 10 10 CECE C[C@@H]1O[C@H](C)[C@@H](NCc2cc3c(cc2O)OCO3)[C@@H]1C 527805203 URIIXPUBTOFKPQ-VGAUDOQQSA-N 279.336 2.022 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)cc2F)CC[C@H]1O 229389436 UPWHTYNDXBXYLT-IMSIIYSGSA-N 252.333 2.053 10 10 CECE CS[C@@H]1CC[C@H](Nc2c(N)cccc2C(N)=O)C1 235167126 RXFWXUWMQCTUFN-DTWKUNHWSA-N 265.382 2.064 10 10 CECE CN[C@@H](C)c1ccc(N2CCCC[C@@H]2CO)cc1O 93670665 ZNRDXQCGYDJGKJ-WCQYABFASA-N 264.369 2.024 10 10 CECE C[C@H]1CN(CCC(=O)Nc2ccc(N)cc2)C[C@@H]1C 92081483 KDXUZZBXLTXTFT-RYUDHWBXSA-N 261.369 2.185 10 10 CECE C[C@H](NC[C@@H]1COCCC1(F)F)c1cc(O)ccc1O 2166659452 GLBREPBMKBIIBN-VHSXEESVSA-N 287.306 2.420 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@H]2CN1c1ccc(OC)cc1OC 2162634212 ATVMFKRJCDQMDY-IACUBPJLSA-N 276.380 2.138 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H]3CC(F)(F)CN3)ccc21 2163060714 CPEVUPUCOHISDP-TZMCWYRMSA-N 282.334 2.100 10 10 CECE CN1CCc2cc([C@@H](O)C3(N)CC(C(F)F)C3)ccc21 2163067616 YPPDNAKVYWVMGU-GLWUULTISA-N 282.334 2.085 10 10 CECE CN1CCc2cc([C@@]3(O)CCC[C@@]34CCNC4)ccc21 2163078210 ZVJQONLPMOUNRG-IRXDYDNUSA-N 272.392 2.030 10 10 CECE CN1CCCc2cc([C@@H](Cc3cncs3)NN)ccc21 2163097337 NEHZOHYGPSZGLU-CQSZACIVSA-N 288.420 2.273 10 10 CECE CC[C@@H]1CN[C@@H]([C@@H](O)c2ccc3c(c2)CCCN3C)C1 2163100404 QXHFGNPTEZOGOI-MJEQTWJJSA-N 274.408 2.491 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H]1CCC=CO1 2163126344 IIHZNAIKMMTERM-BZUAXINKSA-N 276.380 2.067 10 10 CECE CN(C)c1ccc([C@H](N)[C@](C)(O)C[C@H]2CCCO2)cc1 2163131919 WGOVSCYCVRFKBB-OWCLPIDISA-N 278.396 2.073 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)C3CC(F)(F)C3)ccc21 2163141419 ULOLSEUMMGRTRL-KBPBESRZSA-N 282.334 2.085 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)[C@H]3CC=CCC3)ccc21 2163144972 OONLBAIBJYQGIL-ZLIFDBKOSA-N 272.392 2.396 10 10 CECE N[C@]1([C@H](O)c2ccc(N3CCCC3)cc2)CC[C@@H]2C[C@@H]21 2165538896 FNOOTGOZMHUQSP-XLNGHYISSA-N 272.392 2.448 10 10 CECE Cc1cc(NCCc2ccc(N)cc2)nc(C(=O)O)c1 2162267426 FNBXOQDTJKIGTQ-UHFFFAOYSA-N 271.320 2.325 10 10 CECE O[C@H](CNCCCSc1nccs1)C(F)(F)F 819064040 SUBQNQQKBJXXAK-SSDOTTSWSA-N 286.344 2.138 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](C(=O)O)CC[C@@H]2C)c1 817880797 GWDRGXOCPBHRGU-RYUDHWBXSA-N 293.363 2.476 10 10 CECE Cc1cnn(C)c1NC(=O)N(C)Cc1ccccc1O 824380211 NSCUBIYDRZLOJQ-UHFFFAOYSA-N 274.324 2.098 10 10 CECE C[C@H]1CN(C(=O)/C=C\c2cnccn2)c2ccc(F)cc2O1 491933666 UGNXLDLQHMVAAI-MZBZXASESA-N 299.305 2.443 10 10 CECE Cc1cccc(CN2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c1O 824653942 JSDVBNNLCRPBMJ-BZUAXINKSA-N 291.391 2.062 10 10 CECE CCN(Cc1cnnn1CC)c1ccc(OC)cc1 838884687 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281.743 2.128 10 10 CECE CCOCCCN(C)C(=O)CCc1ccc(N)cc1 383446717 LIGCQXQKNYTFKA-UHFFFAOYSA-N 264.369 2.086 10 10 CECE Nc1cc2c(cc1N1CCC=C(F)C1)CCC(=O)N2 384594204 OWEVOCGPKQYTHR-UHFFFAOYSA-N 261.300 2.217 10 10 CECE C[C@H](N[C@H]1C[C@@H](C)O[C@H]1C)c1ccc(O)cc1O 384608703 ORCKOIXZWOKACA-QYTUQVAYSA-N 251.326 2.314 10 10 CECE CCNCc1ccc(N2CC([C@@H](C)O)C2)cc1Cl 719844351 BOPPZXHGBPPEMV-SNVBAGLBSA-N 268.788 2.267 10 10 CECE C[C@H](c1ccc(F)cc1O)N1[C@H]2CC[C@H]1CNC2 723858749 QYOBSVOQJPLOMX-USWWRNFRSA-N 250.317 2.029 10 10 CECE C[C@H]1CC(C(=O)NCCCCN=[N+]=[N-])C[C@H](C)O1 724377135 UPKSPXGGPSMDLO-UWVGGRQHSA-N 254.334 2.397 10 10 CECE CCOC1(C)CN(c2ccc([C@@H](C)N)c(O)c2)C1 399280609 XGXYIIWPVVFRMV-SNVBAGLBSA-N 250.342 2.027 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@]12C[C@H]1CC[C@@H]2N 2177832830 NYLKZAVTCNWVGT-TWINXVHLSA-N 274.364 2.039 10 10 CECE Nc1ccc(O)c(CN2CCC[C@@H]3CC[C@H](O)C[C@@H]32)c1 2167007782 FTQUCOWXRZFKHS-UGFHNGPFSA-N 276.380 2.100 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2ccc3c(c2)OCO3)CC1 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CCOc1cc(CNCCOC)ccc1N1CCCC1 211893809 UDQQYNALFHAIKS-UHFFFAOYSA-N 278.396 2.422 10 10 CECE COc1ccc(N(C)C[C@@H]2CCCNC2)c(F)c1F 2136984883 JVXJHVVGOFWJPB-SNVBAGLBSA-N 270.323 2.409 10 10 CECE C[C@@H](NCC1CCC(O)CC1)c1ccc(O)cc1O 227639760 XUHUAPUJBMYBLD-VOMCLLRMSA-N 265.353 2.300 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)NC2CC2)c1 228961704 OWVDILMWSWWYHJ-MNOVXSKESA-N 262.353 2.018 10 10 CECE CN[C@@H]1CCN(c2ccc(OC)c(OC)c2)C1(C)C 259360111 KGMRDKKWEPPMQH-CQSZACIVSA-N 264.369 2.281 10 10 CECE CC(C)(C)CC[C@H](CO)NC(=O)c1cccc(O)c1O 1639499035 JFOKTVHQFDRMLW-SNVBAGLBSA-N 281.352 2.015 10 10 CECE Cc1ccc(C(=O)N[C@H](C)c2ccccc2O)c(O)n1 1642824161 JZZDZAOXBOCXBB-SNVBAGLBSA-N 272.304 2.292 10 10 CECE CNCc1ccc(N2CCC[C@](C)(O)CC2)c(F)c1 230360078 APIIHLPNIRNEIE-HNNXBMFYSA-N 266.360 2.286 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@H]2CF)c([N+](=O)[O-])c1 2138267095 IOYBBKZZKMOZEX-KOLCDFICSA-N 266.272 2.362 10 10 CECE CC(C)NCc1ccc(N2CCOC[C@H]2CO)cc1Cl 232714084 SYRFHRCFSRSDEQ-CQSZACIVSA-N 298.814 2.036 10 10 CECE Cc1ccc(CN[C@H](CN(C)C)C(F)(F)F)c(O)c1 2139762822 VHNPITDCSIBHRY-GFCCVEGCSA-N 276.302 2.283 10 10 CECE Cc1ccc(CN2CCC[C@@]23CC[S@@](=O)C3)c(O)c1 2139793572 CHJNLKOEDHMGEK-HNAYVOBHSA-N 279.405 2.188 10 10 CECE CCC[C@H]1CN(c2ccc(CO)c(C)c2)C[C@@H]1CO 2140772901 YSRVGIRIBZZGSV-DZGCQCFKSA-N 263.381 2.332 10 10 CECE C[C@H](NCC[C@H](C)[S@](C)=O)c1ccc(F)cc1O 168845958 SCTZHYHSXNTKEN-LXIMFEHMSA-N 273.373 2.339 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)C[C@H]1CO 2140764426 HCGVBOLJMVNXNA-PVXIVEMSSA-N 261.365 2.121 10 10 CECE CC(=O)N[C@@H](C)CN=NNc1ccc([N+](=O)[O-])c(C)c1 1860494246 WZGMRKCCOWTBTI-VIFPVBQESA-N 279.300 2.207 10 10 CECE COC(=O)CN(C)c1c(C)cc(OC)c(C)c1C 258955868 SFRFJTGFYMODIP-UHFFFAOYSA-N 251.326 2.230 10 10 CECE CN(CC1(N(C)C)CCC1)c1ccc(CN)c(F)c1F 234240605 IZHSPZHFIXGGIZ-UHFFFAOYSA-N 283.366 2.344 10 10 CECE CN1CCC[C@H](NCc2ccc(Cl)cc2O)C1 1942495409 TXAHWRPYBXFMOU-LBPRGKRZSA-N 254.761 2.229 10 10 CECE C[C@H](NC(=O)CCc1ccc(N)cc1)C1CCOCC1 235515994 WEILFIOQXRFDCX-LBPRGKRZSA-N 276.380 2.133 10 10 CECE Oc1c(Br)cccc1CN[C@@H]1C[C@@H]2OCC[C@@H]21 1946509284 GHFKSZKERXTYNJ-JLLWLGSASA-N 298.180 2.422 10 10 CECE CN(Cc1ccccc1O)c1ccnc(O)c1[N+](=O)[O-] 1162837571 DGRRYCCZJUTSQL-UHFFFAOYSA-N 275.264 2.037 10 10 CECE C[C@]1(CCNCc2c(O)cccc2Cl)COCCO1 1875564120 MTNJIFSNPNXMLS-AWEZNQCLSA-N 285.771 2.331 10 10 CECE CCc1cccc(CN[C@@H]2CCS(=O)(=O)[C@H](C)C2)c1O 2143954541 BWHXFAJQKRLOLZ-BXUZGUMPSA-N 297.420 2.010 10 10 CECE Cc1cc(CO)ccc1N1CC(N(C)CC(C)C)C1 1877423991 ACOXDVWELTVZSG-UHFFFAOYSA-N 262.397 2.264 10 10 CECE Cc1ccnnc1[C@@](C)(N)c1ccc(N(C)C)cc1 1877732491 PLEWFKXEISQMFG-HNNXBMFYSA-N 256.353 2.073 10 10 CECE CCn1ncc(Br)c1[C@@H](N)c1ccccc1O 1945459170 DZWIWVOQYFUAJG-NSHDSACASA-N 296.168 2.419 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H]2CN(C)C)c(F)c1 1880929723 WKCIXNCLNRAMRE-KOLCDFICSA-N 269.339 2.125 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@H](C(=O)N(C)C)C1 2143695668 VFGLZHRBTAKOKK-MNOVXSKESA-N 280.343 2.002 10 10 CECE COC1(OC)CC(CN[C@@H]2CCc3cccc(O)c32)C1 1963414195 FKRVQCJTRPGYOJ-CYBMUJFWSA-N 277.364 2.368 10 10 CECE CN(C)[C@@H]1CCC[C@@H](NCc2c(O)cccc2F)C1 1964041235 YYVSABIRFQRLQQ-VXGBXAGGSA-N 266.360 2.494 10 10 CECE Nc1ccc(O)c(CN2CC[C@@]3(O)CCCC[C@H]3C2)c1 249907533 MUCPMSWDSJAHKB-BBRMVZONSA-N 276.380 2.101 10 10 CECE CO[C@@H]1CCCCC[C@@H]1NCc1ccc(O)c(O)c1O 2144525651 GCKQBMTYVMIOIR-WCQYABFASA-N 281.352 2.241 10 10 CECE CC1(C)[C@@H](CNCc2cc(F)cc(F)c2O)C[C@H]1O 1966070932 HRLCHIUELPECMN-BXKDBHETSA-N 271.307 2.167 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H]3COCC[C@H]3O2)cc1 1966142670 CKJTUFODEBRBJN-UHOFOFEASA-N 277.364 2.325 10 10 CECE CCN[C@H](C)c1ccc(N2CC(N(C)OC)C2)c(F)c1 2144645232 RKLGPKHZMJIEQY-LLVKDONJSA-N 281.375 2.178 10 10 CECE CO[C@H]1CN(C(=O)CCc2ccc(N)cc2)CC1(C)C 2149736724 NQAKEBQEUICQFJ-AWEZNQCLSA-N 276.380 2.085 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1CC2(CC2)CO1 1967809307 RNNKIZFPMSLWCS-GFCCVEGCSA-N 251.301 2.190 10 10 CECE CCOc1cccc(CN2CC[C@@H]3COCC[C@@H]32)c1O 2144958446 XFRRPFPUWUQQTO-KGLIPLIRSA-N 277.364 2.402 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H]([C@H](C)O)C2)cc1O 252761592 DFXABRIUXKNLSO-FRRDWIJNSA-N 278.396 2.270 10 10 CECE N[C@@H](CCC(=O)O)c1cccc(C(F)(F)F)c1O 258511465 SKJWYCMCRCWYSB-QMMMGPOBSA-N 263.215 2.276 10 10 CECE COCC1CCN(Cc2ccc(OC)cc2O)CC1 156035432 FJAHUTDIDFIQAO-UHFFFAOYSA-N 265.353 2.259 10 10 CECE CCOC(=O)CC[C@H](N)c1ccc(F)c(F)c1O 261102146 YQNHHMQFGOGMSK-VIFPVBQESA-N 259.252 2.014 10 10 CECE COCCOCCCCN[C@@H](C)c1ccc(O)cc1O 158972886 QFRIWLMHIKXAMT-LBPRGKRZSA-N 283.368 2.192 10 10 CECE C[C@@H](NCCc1cccnc1)c1ccc(O)cc1O 37717743 WEWYJZMPZAHPQT-LLVKDONJSA-N 258.321 2.386 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H](N)c3cscn3)ccc21 2147876082 QQTRURYREGEDBX-HUUCEWRRSA-N 289.404 2.259 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CC[C@@](CN)(C2CC2)C1 2149600479 HPEUDIUJPOKADI-BZNIZROVSA-N 276.380 2.220 10 10 CECE C[C@H](NCC[C@H]1CCCN(C)C1)c1cc(O)ccc1O 2151291160 CEGIKBSZUDOKJK-QWHCGFSZSA-N 278.396 2.480 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3C[C@@H]4C[C@@]4(C)C3)ccc21 2152469885 RLIDEBGAABHWNZ-FSBGKCOPSA-N 271.364 2.136 10 10 CECE CNCc1ccc(N2CCOC[C@@H](C3CC3)C2)c(F)c1 2152873446 AVTLWIXFBQCXBD-AWEZNQCLSA-N 278.371 2.408 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2CC[C@H](C1)N2C)c1cc(O)ccc1O 2154912831 FNVVNXHRVIKCQN-RVMXOQNASA-N 276.380 2.374 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@H](N)CC23CC3)c1 2155061951 GYBAXTLKNURVJU-RYUDHWBXSA-N 276.380 2.418 10 10 CECE Nc1ccc(CCC(=O)OCCOCC(F)(F)F)cc1 49311895 LAJZTVQADZWOCR-UHFFFAOYSA-N 291.269 2.324 10 10 CECE C[C@@H](c1cncn1C)N(C)c1c(F)cc(CN)cc1F 2155714185 BCXZJCLIWSUWAU-VIFPVBQESA-N 280.322 2.354 10 10 CECE CNCc1ccc(N(C)[C@H]2CCCN(C)C2)cc1C 53246452 NZICZULLUUWMRL-INIZCTEOSA-N 261.413 2.245 10 10 CECE CNCc1ccc(N2C[C@H](O)C2(C)C)cc1Br 2023149051 KKBVNHIGWQHQLQ-LBPRGKRZSA-N 299.212 2.128 10 10 CECE CN1CCC[C@@H](CN(C)Cc2ccc(F)cc2O)C1 295346031 MYDDUJDCGOGCFZ-GFCCVEGCSA-N 266.360 2.305 10 10 CECE Oc1ccc(CNC[C@@H]2CCCOCC2)c(O)c1 2028633849 MCHKYKWPMIUIRZ-LLVKDONJSA-N 251.326 2.004 10 10 CECE CCCn1nncc1CNCc1cccc(CC)c1O 2156486405 RVZPPBCTTTUQEK-UHFFFAOYSA-N 274.368 2.246 10 10 CECE Oc1ccccc1CN=c1ccc(C(F)F)n[nH]1 2033039061 SZXBHANUARQYMI-UHFFFAOYSA-N 251.236 2.154 10 10 CECE CC[C@@H](CCCO)N[C@@H](C)c1cc(O)ccc1O 2036510127 JPYHJAXRQSWVJU-QWRGUYRKSA-N 253.342 2.300 10 10 CECE COC[C@H](CNCc1c(C)c2ccccc2n1C)OC 300575642 OVURRCMSKYXDMH-ZDUSSCGKSA-N 276.380 2.238 10 10 CECE OCc1ccc(N2CCC[C@](F)(CO)C2)c(Cl)c1 2039793925 CDQQFSPYCNJJIB-CYBMUJFWSA-N 273.735 2.133 10 10 CECE CCNCc1ccc(N2CC[C@H](N(C)C)[C@@H]2C)c(F)c1 313387959 RWFGSTIXCAPJLQ-WFASDCNBSA-N 279.403 2.464 10 10 CECE CC[C@H](O)c1ccc(N2CCC[C@H](OCCO)C2)cc1 2170214346 TWXPOTNMUAWNDI-HOTGVXAUSA-N 279.380 2.108 10 10 CECE C[C@H]1CN(C)CC[C@H]1N(C)CCCc1ccc(N)cc1 2170373863 CHPDJJGJLJCKNG-WMLDXEAASA-N 275.440 2.473 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H]3CC[C@@]2(CO)C3)cc1 2161032060 MCNWTGONRRROBF-OIISXLGYSA-N 274.408 2.393 10 10 CECE O=C(O)CC[C@@H]1CCCN(Cc2ccc(O)c(O)c2)C1 86810151 QJJPQWJIKKDERL-NSHDSACASA-N 279.336 2.175 10 10 CECE Nc1ccc(OCc2nc([C@@H]3CCCOC3)no2)cc1 87813173 DPGSLJKMIQSCPP-SNVBAGLBSA-N 275.308 2.125 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@]23COC[C@H]2C3(F)F)cc1 2161870414 JTMAYTDOZISTOA-LERXQTSPSA-N 282.334 2.424 10 10 CECE COCCNCc1ccc(N(C)Cc2cnco2)cc1 2161907089 AVADEKOBEGJNHQ-UHFFFAOYSA-N 275.352 2.047 10 10 CECE [N-]=[N+]=NCCCNC(=O)COc1ccc(F)cc1F 701271435 XGBWKIYWTQYTEG-UHFFFAOYSA-N 270.239 2.160 10 10 CECE Cc1ncncc1C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2178807071 YFDHZHNDCQPCHU-LLVKDONJSA-N 274.328 2.338 10 10 CECE COc1cc(C=C2SC(=S)NC2=O)cc(OC)c1 2053528303 DGXJIOAPRQOTFP-UHFFFAOYSA-N 281.358 2.193 10 10 CECE Nc1ccc(CNC(=O)c2cc(O)ccc2F)cc1 703782148 GGMDQISCJZKNPM-UHFFFAOYSA-N 260.268 2.044 10 10 CECE CNCc1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)cc1Cl 706979957 AYQUESHQRGWHBO-BETUJISGSA-N 279.815 2.057 10 10 CECE CCOC[C@@H]1CCN(c2cc(OC)c(OC)cc2N)C1 708271577 URKOZHKYQVOULU-LLVKDONJSA-N 280.368 2.149 10 10 CECE COc1ccc(CN[C@@H]2CO[C@]3(CCOC3)C2)cc1C 2178983263 RDUIKCIOQUPKQW-GOEBONIOSA-N 277.364 2.041 10 10 CECE CO[C@H]1CC[C@H](C)N(c2cc3c(cc2N)OCCO3)C1 687213168 GMTWFQISSCHJAW-QWRGUYRKSA-N 278.352 2.044 10 10 CECE C[C@@H]1CCN(c2ccc(CN)c(Cl)c2)CCO1 720483997 QKWJTZAVRMXMET-SNVBAGLBSA-N 254.761 2.414 10 10 CECE COc1cc(Cl)cc(CNC[C@@H](C)CN(C)C)c1O 388905781 MAYJFJDGZXLTOG-SNVBAGLBSA-N 286.803 2.342 10 10 CECE Cc1cc(N2CC[C@H]3[C@H]2CCCN3C)ccc1CN 720502914 GAQJASQYSVQFOW-JKSUJKDBSA-N 259.397 2.127 10 10 CECE C[C@H](N[C@H](C)c1cc(F)ccc1O)c1cn(C)nn1 720545334 LWPWPEJTJWYNDJ-BDAKNGLRSA-N 264.304 2.072 10 10 CECE CN(C)c1ccc([C@]2(N)COCc3ccccc32)cc1 2163061631 IUSLOMWFLBVCMV-QGZVFWFLSA-N 268.360 2.485 10 10 CECE CC(C)(C)N1CC[C@@H](NCc2ccc(O)cc2O)C1 693890294 OEZCXIIVSNDZBH-GFCCVEGCSA-N 264.369 2.060 10 10 CECE CO[C@@H]1CCC[C@](NCCCN=[N+]=[N-])(C(=O)O)CC1 718841259 ABLFHHXCUWIHBM-ZYHUDNBSSA-N 270.333 2.079 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC(C2CNC2)CC1 2176939115 ORYUSCNJDNIXTH-NSHDSACASA-N 276.380 2.090 10 10 CECE C[C@H](C(=O)NCc1ccccc1O)c1ccc(N)cc1 396403133 XZDJSSPLHZVVFV-NSHDSACASA-N 270.332 2.394 10 10 CECE C[C@H](C1CCC1)[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2164336171 ODVVJQWEDHAZJU-ZTFRIQLXSA-N 274.408 2.476 10 10 CECE C[C@@H](N[C@H](C(=O)O)C1CCC1)c1ccc(O)cc1O 399243529 DFTMMJFLUOMVOR-OQPBUACISA-N 265.309 2.002 10 10 CECE O=C(O)c1cnn(Cc2c(O)cccc2Br)c1 2069957525 OIHYBOMUEHBQGT-UHFFFAOYSA-N 297.108 2.098 10 10 CECE NCc1cc(C2CC2)nn1Cc1cc(F)ccc1O 2070071575 YPKCNNRHSFHYQI-UHFFFAOYSA-N 261.300 2.112 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)ccc1C[C@@H](C)N 2174662820 WBDUFQFJNXMSFA-YYQUZTFQSA-N 274.408 2.213 10 10 CECE CC1(C)[C@H](O)[C@H]2CCN(c3c(F)cc(CN)cc3F)[C@H]21 2178164357 LPYWXBGJYCFJOW-CUOATXAZSA-N 282.334 2.019 10 10 CECE COC(=O)c1cncc(CN2CCC[C@@H]2CN=[N+]=[N-])c1 2179616038 LOKSFGYHDLKYHD-GFCCVEGCSA-N 275.312 2.143 10 10 CECE CCOc1cccc(CNC2CN([C@H](C)CC)C2)c1O 2169304665 MTHYKXNTAUEDIV-GFCCVEGCSA-N 278.396 2.363 10 10 CECE O=C(O)C[C@H]1CCC[C@@H](NCc2ccc(O)cc2O)C1 2169400171 QDJSWOHFLOVHOD-CMPLNLGQSA-N 279.336 2.221 10 10 CECE C[C@@H]1CN(CCCc2ccc(N)cc2)C[C@@H]1CC(=O)O 2179671837 XBJYRSMXPHCPLZ-OCCSQVGLSA-N 276.380 2.244 10 10 CECE CCCN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@@H]1CCSC1 2170138229 HVEQZISSSODISP-RISCZKNCSA-N 292.404 2.394 10 10 CECE COC(=O)c1cncnc1N[C@@H](C)c1ccccc1O 2192612460 BGFLTXCOLTVISF-VIFPVBQESA-N 273.292 2.142 10 10 CECE CN(C)c1ccc2c(c1)CCN2C[C@@H](O)CC(F)(F)F 2195997545 VQDMECGQCDKCTI-LBPRGKRZSA-N 288.313 2.428 10 10 CECE COc1ccc(N(C)Cc2ncnn2C(C)C)c(N)c1 2196263119 BJCPVOFYBSJAGL-UHFFFAOYSA-N 275.356 2.086 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@H](O)CC2(C)C)cc1Cl 2188677102 HVTFCZUBOBRTOX-OWYVNGRQSA-N 299.798 2.104 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@]12CCCNC2 2182062008 TWPCYGNBCGLGCF-WBMJQRKESA-N 276.380 2.377 10 10 CECE CCOc1cccc(CN2C[C@H](N)CCC2(C)C)c1O 2193508290 UYKMPAOYKLKDGK-CYBMUJFWSA-N 278.396 2.493 10 10 CECE N[C@H]1CCCc2cc(N3CCN4CCC[C@H]4C3)ccc21 2184687630 TZSVPKKGGKYVBW-RDJZCZTQSA-N 271.408 2.307 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CC[C@H]3NC)CCN1C 2184711648 UVRIELHMWLYJLU-RHSMWYFYSA-N 273.424 2.424 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H]4C[C@]4(COC)C3)ccc21 2184727759 RKZQUUJFUYAIBK-KBRIMQKVSA-N 272.392 2.366 10 10 CECE CN[C@@H]1CCc2cc(N(C)CCn3cccn3)ccc21 2184721533 NCLCDCFMZGBJLS-MRXNPFEDSA-N 270.380 2.226 10 10 CECE CCCN[C@H](C)c1cnc(Sc2ncnn2C)s1 2041815314 SONRJSHKSYHBJE-MRVPVSSYSA-N 283.426 2.483 10 10 CECE CN[C@@H]1CCc2cc(N(C)[C@H]3CN4CC[C@H]3C4)ccc21 2184719833 SOPMGSWINKAPEL-XKQJLSEDSA-N 271.408 2.034 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)C1[C@@H]2CCCC[C@@H]12 2048526735 BLYDUSNIBNTNLB-KKZNHRDASA-N 252.318 2.166 10 10 CECE CCC[C@H]1COCCN1c1ccc(OC)cc1N 2050853406 LRMZSVMFTJQJFG-NSHDSACASA-N 250.342 2.283 10 10 CECE C[C@@H]1C[C@]1(C)C[C@@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2190956956 YOHWUJUTICLZFS-MDNXKNQGSA-N 274.408 2.476 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)CCn2cccn2)c(F)c1 2194518255 OEUWGZNYPXLYED-SNVBAGLBSA-N 281.306 2.351 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H]3COC[C@@H](C3)C2)c(F)c1 2194515299 GEEGVYSBFMDNHG-VWYCJHECSA-N 283.318 2.491 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H](CO)C(C)(C)C2)c(F)c1 2194518883 PXATYHFUBKMFSP-GXSJLCMTSA-N 285.334 2.473 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@](C)(O)[C@@](C)(O)C2)cc1Cl 2194627217 XJPKTTWPEKEEFZ-VQISRLSMSA-N 299.798 2.105 10 10 CECE C[C@H](N)c1cc(F)c(N2CCN(C)[C@H]3CC[C@H]32)c(F)c1 2194693190 YNNKAQIGYLRPRP-QCZZGDTMSA-N 281.350 2.267 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@@H](CO)[C@@H](C)C2)c(F)c1 2194695510 UXVAOEUGIZUQQK-AXFHLTTASA-N 284.350 2.439 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H](CCO)C(F)F)cc1 2058237923 VEKSGAGCBLQXNR-JOYOIKCWSA-N 259.296 2.192 10 10 CECE C[C@H]1C[C@@H](CCN)CCN1C(=O)Nc1ccc(N)cc1 2191537750 YHMPCWDJNSREPI-RYUDHWBXSA-N 276.384 2.250 10 10 CECE CN(CCCN=[N+]=[N-])Cc1nc(C(F)(F)F)no1 2066606607 PYWBBMQGLUZZGI-UHFFFAOYSA-N 264.211 2.221 10 10 CECE Nc1ccc(NC(=O)Nc2cnc(Cl)nc2)cc1 2071558578 OUOIEMUMRJJSQW-UHFFFAOYSA-N 263.688 2.356 10 10 CECE C[C@@H](OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 2072111611 LVVWAWOMLPYAEO-ZJUUUORDSA-N 254.334 2.491 10 10 CECE CNCc1ccc(N2CCC[C@H]2[C@H](C)O)cc1Cl 2073317179 IHTUUBDKIBNIPL-HZMBPMFUSA-N 268.788 2.409 10 10 CECE CO[C@@H]1C[C@H](N(C)Cc2cc(N)ccc2O)C1(C)C 2100156143 KSMRWJGNKYFPRK-UONOGXRCSA-N 264.369 2.220 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2[C@H]3CO)cc1Cl 2082969838 KGYQKGXWBYDIJK-NVVZYBJKSA-N 266.772 2.177 10 10 CECE Cc1ccc(CN(C)[C@H]2CCOC[C@H]2F)c(O)c1 2084090657 XLYCANZPTYPPHL-OLZOCXBDSA-N 253.317 2.259 10 10 CECE NC[C@H]1C[C@@H](F)CN1c1ccc(OC2CCC2)cc1 2106354618 UNPNBZNCMJWUIG-DGCLKSJQSA-N 264.344 2.493 10 10 CECE CN[C@](CSc1nccs1)(C(=O)OC)C1CCC1 2086613929 XXVJUISPUOIDGM-LBPRGKRZSA-N 286.422 2.167 10 10 CECE CCCOC1(C(=O)N(C)Cc2ccccc2O)CC1 2110253382 MSKNXFIJVSPRDH-UHFFFAOYSA-N 263.337 2.310 10 10 CECE Nc1ccc(CCCN2CCCC[C@H](CO)C2)cc1 2090609735 KORZRNCFFQLZHY-HNNXBMFYSA-N 262.397 2.296 10 10 CECE CN[C@@H](C1CCC1)[C@H](O)c1ccc2c(c1)CCN2C 2091308586 DKIJRFNWTPCBGA-JKSUJKDBSA-N 260.381 2.100 10 10 CECE CN1CCc2cc([C@](C)(N)[C@@H]3CCCOC3)ccc21 2112053287 AKFYBTVGIIMTDC-ZBFHGGJFSA-N 260.381 2.279 10 10 CECE CC[C@@H](N)c1ccc(N2Cc3cnn(C)c3C2)cc1 2112199585 JQYBFBCMZNWCPG-CQSZACIVSA-N 256.353 2.350 10 10 CECE N[C@@H](c1ccccc1O)[C@H](O)c1nc(C2CC2)cs1 2093270052 DXHPHSRELZKBAC-STQMWFEESA-N 276.361 2.460 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N1CCN[C@H]2C[C@@H]21 2095824893 FCAHOLHCSGJERK-VOAKCMCISA-N 258.365 2.295 10 10 CECE CC[C@H]1CCOC[C@H]1NC(=O)Nc1ccc(N)cc1 2096240950 ZCNRITFEWKRXSG-GXFFZTMASA-N 263.341 2.205 10 10 CECE CC1(C)CN(c2ccc3c(c2)COCC3)CCCN1 2096489051 YPUMXPXERXVJAJ-UHFFFAOYSA-N 260.381 2.338 10 10 CECE CNCc1cc(F)c(N2CC[C@H]3C[C@H]2CO3)c(F)c1 2096761722 WJAZYKUHDKNDEV-QWRGUYRKSA-N 268.307 2.052 10 10 CECE N[S@@](=O)(=NCc1ccccc1O)N1CCCCCC1 2097976038 XIMARUMEFHXUQI-LJQANCHMSA-N 283.397 2.025 10 10 CECE C[C@H](CCCN1CCC[C@@H](CN=[N+]=[N-])C1)S(=O)(=O)O 2099270512 ZQCDYNKXYZUFSP-MNOVXSKESA-N 290.389 2.065 10 10 CECE COc1ccc(N(C)[C@@H]2CCCCNC2)c(OC)c1 2112839154 VFSBOZCLSBMDBN-GFCCVEGCSA-N 264.369 2.282 10 10 CECE CC[C@@H](C)N1CC(N[C@@H](C)c2c(O)cccc2O)C1 2113005759 MCHJUEQAIREIGC-MNOVXSKESA-N 264.369 2.231 10 10 CECE Cc1cc(N2CCC[C@]3(CCOC3)C2)ccc1CN 2114692143 HUWNBOPMGOFUER-INIZCTEOSA-N 260.381 2.461 10 10 CECE COc1ccc(N2CCC[C@@]3(CCOC3)C2)c(N)c1 2114700870 RGACPZDIRQZXLY-OAHLLOKOSA-N 262.353 2.284 10 10 CECE CCN1CCCN(c2ccc(CN)c(OC)c2)[C@H](C)C1 2204552995 BWPIHRIANLMCSY-CYBMUJFWSA-N 277.412 2.074 10 10 CECE COc1cc(N2C[C@@H](O)C[C@H]2C)ccc1CNC(C)C 2204555207 RQXJYCVQFCKUSV-DOMZBBRYSA-N 278.396 2.153 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H]2CF)cc1C 2269650417 BUJOAHMHSBIXAZ-OCCSQVGLSA-N 266.360 2.450 10 10 CECE CC(C)(C)C1CC(S(=O)(=O)NCCN=[N+]=[N-])C1 2208634425 AWBUEZGCAVCWNU-UHFFFAOYSA-N 260.363 2.041 10 10 CECE COc1ccc(N2C[C@H](O)CC(C)(C)C2)c(F)c1 2219617427 PJVLGENEDVTVTP-SNVBAGLBSA-N 253.317 2.432 10 10 CECE CC[C@@H]1CCN(c2ccc(OC)cc2F)CCN1 2220314748 APJIPJPZUGLVHJ-LLVKDONJSA-N 252.333 2.413 10 10 CECE Nc1ccc(OCCCN2CC[C@H]3C[C@@]3(F)C2)cc1 2230336191 XQLXVLJNCJAMAJ-SWLSCSKDSA-N 264.344 2.472 10 10 CECE CC[C@@H](N)c1ccc(N2CC=C[C@@H]2CN(C)C)cc1 2230472091 OULWWMHJTTZEAF-HZPDHXFCSA-N 259.397 2.403 10 10 CECE CN[C@H](C)c1ccc(N2CC(O)(C3CC3)C2)c(C)c1 2232091304 FGXROJWOJCJYDC-GFCCVEGCSA-N 260.381 2.237 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3[C@H]2C[C@@]3(C)O)cc1O 2233787060 ORABXXYLOKLGHK-DSPGLSBSSA-N 276.380 2.022 10 10 CECE Cc1cc(C)c(CNC(=O)c2cc(O)c(O)c(O)c2)s1 2234288111 UWVLFJXLNVDVHC-UHFFFAOYSA-N 293.344 2.412 10 10 CECE CC(C)Oc1ccc(N2CC3(C2)OCCC[C@H]3O)cc1 2235097240 SUUFWHIYLGZOMT-OAHLLOKOSA-N 277.364 2.204 10 10 CECE CCCOc1ccc(N2C[C@H](CO)OC(C)(C)C2)cc1 2235108832 OFZPHPSZENHTRA-OAHLLOKOSA-N 279.380 2.452 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1CCC[C@@H](C(=O)O)C1 2225796611 YRCLMJIVTPXPIT-VHSXEESVSA-N 268.317 2.084 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@H](C)CO2)c(C(=O)O)c1 2235958824 UPHCZGSSJSYBRR-CMPLNLGQSA-N 279.336 2.255 10 10 CECE COc1ccc(N2CCC(C)(C)[C@@H](CO)C2)c(CO)c1 2236000137 RDCZEYCCPYSWML-CYBMUJFWSA-N 279.380 2.032 10 10 CECE CN(c1c(F)cc(CO)cc1F)[C@H](CO)CC1CC1 2226151055 JRGVJQVJTKPZRU-NSHDSACASA-N 271.307 2.054 10 10 CECE CN1CCc2cc([C@@H](N)C[C@]34COC[C@H](C3)C4)ccc21 2236294869 XLBPVDZBAAAWIQ-YLQAJVPDSA-N 272.392 2.495 10 10 CECE C[C@@H]1Cc2cc(N3C[C@@H]4C[C@@H](CO)[C@@H]4C3)ccc2O1 2226697007 QZQIJFXLBKRFGF-GVUJHPQVSA-N 259.349 2.075 10 10 CECE CC(C)(C)CN(CCO)c1ccc2c(c1)OCCO2 2226779101 FOKPXYGIIXWIEH-UHFFFAOYSA-N 265.353 2.303 10 10 CECE O[C@@H]1CC[C@]12CCCN(c1ccc3c(c1)CCO3)C2 2226753137 SHMQTXHJRBXDRN-CVEARBPZSA-N 259.349 2.363 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCN3C)C[C@H](C)C1O 2226806377 BFSYKRLQWMXWFN-RYUDHWBXSA-N 260.381 2.132 10 10 CECE Nc1ccc(O)c(CN2CCC[C@H](OC(F)F)C2)c1 2227422961 XHAIOXKIQUPUSG-NSHDSACASA-N 272.295 2.178 10 10 CECE CCN(c1ccc(OC)cc1CN)C1CCOCC1 2227676048 PWACZDFPTBSSQB-UHFFFAOYSA-N 264.369 2.159 10 10 CECE CC[C@@H]1C[C@H](N(C)c2ccc(OC)cc2CN)CO1 2227679636 MBIUVHCKSNAVTF-QWHCGFSZSA-N 264.369 2.158 10 10 CECE CCNCc1cc(OC)ccc1N1CC(C)(OC)C1 2227671971 DDTGTWGQLLTIAD-UHFFFAOYSA-N 264.369 2.030 10 10 CECE C[C@H](N)c1ccc(N2CC(OC(F)(F)CF)C2)cc1 2229327414 KREJKUUUKMRMOU-VIFPVBQESA-N 274.286 2.474 10 10 CECE CC1CC(S(=O)(=O)CCCOc2ccc(N)cc2)C1 2229860166 HVASYYVVHAMSAZ-UHFFFAOYSA-N 283.393 2.251 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1 2240053623 SGPKMGJUTPJENB-UNEWFSDZSA-N 274.408 2.393 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@H]3C[C@]3(CO)C2)c(C)c1 2240734506 DDOYVANQACBGJV-YSVLISHTSA-N 274.408 2.484 10 10 CECE COCCO[C@H]1CCN(c2ccc([C@@H](C)O)cc2C)C1 2240838332 SXCFVBUWRKCWQS-HIFRSBDPSA-N 279.380 2.290 10 10 CECE Nc1ccc(OCCN2C[C@@H](O)CC23CCCC3)cc1 2241037383 PTUJMRXSAHKSRT-AWEZNQCLSA-N 276.380 2.027 10 10 CECE CSc1ncc(CNC[C@@H](N)C(C)(C)F)s1 2243857472 TVRQADDPFWGCPD-MRVPVSSYSA-N 263.407 2.030 10 10 CECE CCNc1cn[nH]c(=NCc2cnc(SC)s2)c1 2257134209 JTTPLYHXGLQVBL-UHFFFAOYSA-N 281.410 2.121 10 10 CECE CSc1ncc(CNC[C@H](C)CNC2CC2)s1 2248746277 ZQRINZLKUMQJTC-VIFPVBQESA-N 271.455 2.343 10 10 CECE COc1ncc(C(=O)NCCCN=[N+]=[N-])cc1Cl 2259094287 LASJUHYCAJHVRW-UHFFFAOYSA-N 269.692 2.174 10 10 CECE CN(C)c1ccc(CNC[C@@]2(C)CCC[C@H]2O)cc1 2271303050 WGWKWDAUBWYTPY-HZPDHXFCSA-N 262.397 2.393 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)ccc1[C@H](C)N 2269656907 LAPKLZNULPWJTE-VCOSZWKGSA-N 260.381 2.343 10 10 CECE Cc1cc(F)cnc1C(=O)NCc1cccc(C)c1O 2281136429 RZGNQCBLFSCXEI-UHFFFAOYSA-N 274.295 2.473 10 10 CECE CN[C@@H](C)c1ccc(N(CCOC)CCOC)cc1C 2285141590 UUJFWJCDOIPVHG-AWEZNQCLSA-N 280.412 2.375 10 10 CECE CN(Cc1ccc(N2CCNCC2)cc1)[C@@H]1CC1(C)C 2286074020 UEHXGPAHBMVRQG-MRXNPFEDSA-N 273.424 2.327 10 10 CECE Cc1cc(NS(=O)(=O)c2cncs2)cc(C)c1O 2318383139 PNCHZECUDSWCPT-UHFFFAOYSA-N 284.362 2.266 10 10 CECE CCN(CC)[C@H]1CCN(CCOc2ccc(N)cc2)C1 62977016 CYKHWRMNSHXTKA-HNNXBMFYSA-N 277.412 2.064 10 10 CECE CN(C)c1ccc([C@@H](C[C@H]2C[C@@H](F)C2)NN)cc1 2327214638 XASXXWUQVWJTMG-SCDSUCTJSA-N 251.349 2.395 10 10 CECE Oc1ccsc1-c1nc([C@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)no1 2328617863 RYZNLBBFVDPOSW-RHEVIGMXSA-N 276.317 2.395 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]32)c(F)c1 2330894730 BMWAJBQSEPQPNM-YIVQXAGMSA-N 264.344 2.066 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)C[C@@H]2C[C@@H]2F)cc1 2331749428 FEOKRCATAKQQOQ-AEGPPILISA-N 265.376 2.042 10 10 CECE Nc1ccc(CC(=O)NC[C@@H]2C[C@@H]3CC[C@H]2C3)cc1 2334295597 JIWDUGXWRPLLEL-RDBSUJKOSA-N 258.365 2.364 10 10 CECE Nc1ccc(OCCOC[C@H]2O[C@H]3CC[C@H]2C3)cc1 2352712984 RPYKKVLZBQZVSE-TUKIKUTGSA-N 263.337 2.232 10 10 CECE CSc1cc(N2CC[C@H]3C[C@]2(CO)C3)ccc1CN 2353854097 OAYUNNLJCWADRS-WGRBQBNCSA-N 278.421 2.218 10 10 CECE CCN1CCc2cc([C@]3(O)C[C@@H]4C[C@H]3C[C@H]4N)ccc21 2354670897 FNXCCLIMUUNARS-MKVSYHDVSA-N 272.392 2.014 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CCC[C@H]2C[C@@H]1CN 2354707274 KNZLIMRPPRHHDH-XQHKEYJVSA-N 276.380 2.361 10 10 CECE O[C@H]1CC[C@H]2CCN(c3ccc4c(c3)CC[C@H]4O)[C@@H]1C2 2356172696 FMSADWVIADHSGP-QYHDQYMBSA-N 273.376 2.406 10 10 CECE O=C1N=C(N2CCCC2)S/C1=C\c1ccc(O)cc1O 24544142 GZYBOZPAFOMTQK-GHXNOFRVSA-N 290.344 2.164 10 10 CECE Nc1ccc(NC(=O)COCc2ccccc2)cc1 22162400 MIOGLGOQMNGZJT-UHFFFAOYSA-N 256.305 2.424 10 10 CECE CC(=O)NCCN(C)c1ccc(/C=C/C(=O)O)c(Cl)c1 308173475 YINKKAPCURREDJ-GQCTYLIASA-N 296.754 2.010 10 10 CECE Cc1nsc(Sc2ncc(C(=O)O)s2)n1 307254961 YVSDSRSNURRCNO-UHFFFAOYSA-N 259.337 2.152 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H](C)O)c(Cl)c1 61698172 UZUUGKFMRCYKIR-NXEZZACHSA-N 256.777 2.437 10 10 CECE CC[C@H]1CN2CCC[C@@H]2CN1Cc1cc(OC)ccc1O 182076085 SIEOHCVDEHZRNE-LSDHHAIUSA-N 290.407 2.459 10 10 CECE CCc1noc(C)c1C(=O)Nc1ccc(O)cc1C(=O)O 48847147 UXSXDWGWDWHGFL-UHFFFAOYSA-N 290.275 2.202 10 10 CECE CCN(c1ccc(CN)c(Cl)c1)[C@@H]1CCOC1 379954188 COHUGKSJNFODFT-GFCCVEGCSA-N 254.761 2.414 10 10 CECE CS(=O)(=O)c1cccc(NCc2cccc(O)c2O)c1 41117709 UHGGYYKFLWFAFM-UHFFFAOYSA-N 293.344 2.113 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N(C)C[C@@H](C)C(=O)O 86807515 PQKBLHFQODIMKE-NEPJUHHUSA-N 264.369 2.466 10 10 CECE CC[C@H](N)Cc1cccc2c1ccn2Cc1ncnn1C 88583381 LBYKVQMLLUMNEL-ZDUSSCGKSA-N 283.379 2.098 10 10 CECE Oc1cccc(Br)c1[C@@H]1NCCCC[C@@H]1O 1952130900 BSTHZNMXITVWOS-CMPLNLGQSA-N 286.169 2.330 10 10 CECE CCCCN(CCO)c1ccc(OC)cc1[N+](=O)[O-] 49011990 FOFWQHCGZZWGIS-UHFFFAOYSA-N 268.313 2.202 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(N)=O)c1c(F)cccc1Cl 90260570 SCYFQJVXNPLQHO-SNVBAGLBSA-N 285.710 2.296 10 10 CECE CCCOCC(=O)N(C)[C@H](C)c1ccccc1O 230354189 YTBVGTHPHYXCHJ-LLVKDONJSA-N 251.326 2.338 10 10 CECE COC(=O)[C@@H](CCc1ccccc1)NCCN=[N+]=[N-] 90256972 XYMSEJLADUUEFJ-GFCCVEGCSA-N 262.313 2.061 10 10 CECE CN1CCN(c2ccc(/C=C/C(=O)O)c(Cl)c2)CC1 234367197 VGHUUONMWUGPHA-HWKANZROSA-N 280.755 2.190 10 10 CECE Cc1c(Br)cc([C@H](N)CCO)c(O)c1C 238543254 OHSGCASNUUPNHA-SNVBAGLBSA-N 274.158 2.154 10 10 CECE CCNCc1ccc(OC)c(COCCCOC)c1 50126109 OGRBHNJKGSDPSB-UHFFFAOYSA-N 267.369 2.358 10 10 CECE CNCc1ccc(N2CCN(C(C)C)CC2)cc1C 50582396 HUMKUDSCKLNERH-UHFFFAOYSA-N 261.413 2.245 10 10 CECE COc1cc(OC)c2c(c1)[C@H](C1CCNCC1)CN2C 527416723 UZAVQRNHGVCCKX-AWEZNQCLSA-N 276.380 2.237 10 10 CECE COC[C@H]1CN(Cc2cc(C)c(C)cc2O)C[C@H](C)O1 253294181 CKTBPRCVQOILND-DZGCQCFKSA-N 279.380 2.245 10 10 CECE C[C@@H]1CCCC[C@H]1OC[C@H](O)CNCc1ccccc1O 253103080 YJXWMFGIVXOULA-FRFSOERESA-N 293.407 2.438 10 10 CECE CCOc1cccc(CN2CCO[C@H](C3CC3)C2)c1O 375330078 CIBJHTBIYIAQOF-HNNXBMFYSA-N 277.364 2.402 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)cc1Cl 381704260 CBBFMJANMMMSNP-ZCNHVBTFSA-N 278.783 2.004 10 10 CECE N[C@H]1CC[C@@H](C(F)(F)F)N(c2ccc3c(c2)CCO3)C1 2162847608 OMJVZRZQSVWZST-GWCFXTLKSA-N 286.297 2.480 10 10 CECE CCN1CCc2cc([C@@H](O)C[C@H](NC)C(F)F)ccc21 2163065107 XNLJHNIYBNUFLP-JSGCOSHPSA-N 284.350 2.346 10 10 CECE CCN1CCc2cc([C@](C)(N)c3cnn(C)c3)ccc21 2163066334 LCFVTKYWSMSAPH-INIZCTEOSA-N 270.380 2.025 10 10 CECE CN1CCc2cc(N(CCCN)CC(F)(F)F)ccc21 2163072634 CBDIAEDCACLNGC-UHFFFAOYSA-N 287.329 2.396 10 10 CECE CCN1CCc2cc([C@@]3(O)[C@H]4CCO[C@H]4[C@H]3C)ccc21 2163075236 BARDTSGASKHJBH-RNCIANSQSA-N 273.376 2.311 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)[C@@H]1CSCCO1 2163079166 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C[C@H](NC(=O)C1CCCNCCC1)c1ccccc1O 2289562949 DUOMSWZFYFFBJN-LBPRGKRZSA-N 276.380 2.349 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1C[C@@H]2CO[C@H]1C2 2298558607 RRXAEZKLZLPJPQ-KDDOJWQBSA-N 253.729 2.313 10 10 CECE CC[C@H]1NC[C@H]1NCc1ccc(C)c(Br)c1O 2307569428 IZYVKMNYNVYAIL-GHMZBOCLSA-N 299.212 2.303 10 10 CECE Cc1cccc(CNS(=O)(=O)c2ccccc2F)c1O 1255528303 FSDJLWYXWWUHJO-UHFFFAOYSA-N 295.335 2.318 10 10 CECE Cc1ccc(CN2CCC[C@@H](N)C2)c(O)c1Br 2307428556 GSKGEIRYBFSUMU-LLVKDONJSA-N 299.212 2.386 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@H]1[C@@H]2CCCC(F)(F)[C@@H]21 2309465979 FXZKGGNIWOGUME-CIUDSAMLSA-N 258.272 2.437 10 10 CECE CSc1cc(N2CCC[C@H]2[C@@H](C)O)ccc1CN 2328540070 QOCAEKWZUWMWSI-MFKMUULPSA-N 266.410 2.217 10 10 CECE O=C(O)[C@@H]1[C@@H]2CC[C@@H](C2)N1Cc1cc(Cl)ccc1O 2332928852 KXWHJOIZADONFP-WLTAIBSBSA-N 281.739 2.483 10 10 CECE CN[C@@H]1CCc2cc(N3CCOC[C@H](F)C3)ccc21 2336671876 SPGZPDKDVCIIAD-IUODEOHRSA-N 264.344 2.068 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H]3CC[C@H]2C[C@H]3O)cc1 2337143531 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C[C@H](N[C@@H]1C[C@@H](CO)[C@@H]2C[C@H]12)c1ccc(N(C)C)cc1 2354928045 ILCHFNNXBBHBNO-MUMJOVGASA-N 274.408 2.420 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 2355313905 GNPJFXSGKNRDPU-KVSVUVNWSA-N 273.332 2.214 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)C1=COCCC1 68510921 JVOPHDCXSIUQNE-UHFFFAOYSA-N 274.364 2.405 10 10 CECE COc1ccc(O)c(CN2CCCN(C3CC3)CC2)c1 179923753 LZGRLLITNLIPER-UHFFFAOYSA-N 276.380 2.071 10 10 CECE CCNC(=O)CNc1ccccc1C(=O)c1ccccc1 175596811 OGYWRTVRCAMUTB-UHFFFAOYSA-N 282.343 2.466 10 10 CECE CC(C)OC(=O)/C=C/c1ccc(N2CCOCC2)cc1 66656428 YRLKAYMIJRYLPD-VMPITWQZSA-N 275.348 2.488 10 10 CECE Cc1cc(N2CCCNCC2)ccc1OC[C@@H]1CCCO1 63063333 MWTWKEAFVLIWNQ-INIZCTEOSA-N 290.407 2.353 10 10 CECE NC[C@H](c1cc(Br)ccc1O)N1CCCC1 32050853 ODNCCARIZIOVFZ-LLVKDONJSA-N 285.185 2.250 10 10 CECE C[C@@H](CS(=O)(=O)NCCCN=[N+]=[N-])c1ccccc1 126685521 QEYJGGKOYNXVBE-NSHDSACASA-N 282.369 2.410 10 10 CECE CC1CCN(C(=O)c2ccn(-c3ccc(N)cc3)n2)CC1 35427748 FDTNDXGOSWAKFW-UHFFFAOYSA-N 284.363 2.327 10 10 CECE COc1ccc(N2CC[C@@H](NC(C)C)C2)cc1F 71199048 RTJRQPMVANLKLT-LLVKDONJSA-N 252.333 2.411 10 10 CECE Cc1ccc([C@H](C)NC[C@@H](O)CN2CCCCC2)c(O)c1 185115434 XKTIDHWIFPVGBX-LSDHHAIUSA-N 292.423 2.198 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)C[C@@H]1CCCCO1 48946855 NSZDLMKYXOYDRJ-HNNXBMFYSA-N 291.395 2.098 10 10 CECE COc1cc(Cl)cc([C@@H]2NCCCC[C@@H]2O)c1O 1952394781 VCZUCCPESPANSS-JQWIXIFHSA-N 271.744 2.230 10 10 CECE CO[C@H]1C[C@H](NCc2ccc(O)cc2O)C1(C)C 227831740 VBXTUCHKXRXMBA-STQMWFEESA-N 251.326 2.001 10 10 CECE C[C@@H](CN(C)[C@@H](C)c1ccc(F)cc1O)C(=O)O 86808034 LQYJGNWKVPJGBT-IUCAKERBSA-N 255.289 2.245 10 10 CECE Oc1cc(I)c(C(F)F)c(O)n1 238700870 JYUQPILASNEGIL-UHFFFAOYSA-N 287.003 2.035 10 10 CECE CC[C@H]1OCC[C@@H]1CNCc1ccc(O)c(O)c1 234181752 DEZBERNEGWJUBU-BXUZGUMPSA-N 251.326 2.003 10 10 CECE Nc1ccc(OCc2nc3nccnc3s2)cc1 236384070 JLIJAPOELOENPH-UHFFFAOYSA-N 258.306 2.248 10 10 CECE CCCOc1ccc(CN2CCC3(C2)OCCO3)c(O)c1 93013529 UKBSRSBWJYYEEP-UHFFFAOYSA-N 293.363 2.130 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1CCNC12CCC2 530178022 NJRGPTGUVYPDRV-ZDUSSCGKSA-N 266.772 2.420 10 10 CECE CSc1nc(Sc2ncc([N+](=O)[O-])s2)n[nH]1 389721781 GZXHWHQBILGMMB-UHFFFAOYSA-N 275.340 2.043 10 10 CECE CC(C)C(=O)CNC(=O)/C=C\c1ccc(N(C)C)cc1 701226324 LRPGSNHVZYEHTJ-YFHOEESVSA-N 274.364 2.107 10 10 CECE Nc1ccc(NC(=O)NC[C@H]2COCCC2(F)F)cc1 2166663784 UPUVMDQOZBNPJW-VIFPVBQESA-N 285.294 2.062 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3CCC[C@@H](CN)C3)ccc21 2163069137 ATMTXEWHJXLKKN-HACGYAERSA-N 274.408 2.477 10 10 CECE C[C@@H]1[C@@H]2OCC[C@@H]2[C@@]1(N)c1ccc2c(c1)CCCN2C 2163098202 UWSYKOLWRMFJLM-UMPQAUOISA-N 272.392 2.278 10 10 CECE C[C@@H]1CNCC[C@@](O)(c2ccc3c(c2)CCCN3C)C1 2163102044 HHZPFFPFPBZJEX-GUYCJALGSA-N 274.408 2.276 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H](C)COC 2163137645 FCJRPBFQJIVNAP-DAXOMENPSA-N 280.412 2.047 10 10 CECE CCN(CC)c1ccc([C@@H](NN)C2CCOCC2)cc1 2163142238 ANBJHTKTYHXSFF-MRXNPFEDSA-N 277.412 2.464 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)c(F)c1 2163567084 ZRWMNNDMMOBXBJ-RLSLPTNOSA-N 278.371 2.313 10 10 CECE CN1CCc2cc([C@H](O)[C@H](N)[C@H]3C[C@@H]4C[C@@H]4C3)ccc21 2163922633 UWFBBZCPIVIKAW-QZCUMHFISA-N 272.392 2.086 10 10 CECE CCNCc1ccc(N2CC[C@@H]3OCC[C@@H]3C2)cc1 724829830 OUQISAGREIVNOI-ZBFHGGJFSA-N 260.381 2.411 10 10 CECE Oc1ccccc1CNC[C@@H]1CC2(CCOCC2)CO1 712650254 GQICRRYYZGLQNH-AWEZNQCLSA-N 277.364 2.068 10 10 CECE Cn1nc2c(c1CNCc1cc(F)ccc1O)CCCC2 812773619 JBCIGCOGGDFMCX-UHFFFAOYSA-N 289.354 2.433 10 10 CECE C[C@@H](CF)NCc1ccc(N2CCOCC2)c(F)c1 814301203 YRVVCDQVTNNISM-NSHDSACASA-N 270.323 2.110 10 10 CECE Cc1ccc(Br)c([C@H](N)[C@@H](O)C2CC2)c1O 713786988 NNORJNRKHJXREZ-JQWIXIFHSA-N 286.169 2.234 10 10 CECE CO[C@@H]1CC(N2CCC[C@H](CN=[N+]=[N-])C2)C[C@H]1OC 2130567424 BCWDPVDHIAFARC-RAIGVLPGSA-N 268.361 2.201 10 10 CECE C[C@@H]1CCN(S(=O)(=O)Cc2ccc(N)cc2)C[C@H](C)C1 723788002 RCSQBPPYWANUED-CHWSQXEVSA-N 296.436 2.467 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CCN(C)C2=O)cc1Cl 723191178 FIAVELCLHPQCRI-ZANVPECISA-N 281.787 2.027 10 10 CECE Cc1ccc2c(c1)N(OCc1ccc(N)cc1)C(=O)CO2 821296188 AAYBCPKRDIJVSW-UHFFFAOYSA-N 284.315 2.434 10 10 CECE C[C@@H](NCC1=CCOCC1)c1cc([N+](=O)[O-])ccc1O 834860179 PINFAJBQIXJYGD-SNVBAGLBSA-N 278.308 2.298 10 10 CECE Oc1ccccc1CNCCCNCc1cccnc1 841041117 DMUYRHLIDLHADM-UHFFFAOYSA-N 271.364 2.057 10 10 CECE O=C(N[C@@H](C1CC1)[C@@H]1CCCCO1)c1cccc(O)c1O 848268065 YPNHWDBSOOVLMY-KBPBESRZSA-N 291.347 2.175 10 10 CECE CCN(C(=O)NCCc1ccc(N)cc1)[C@@H]1CCCOC1 846172965 OEXKJOAFLCIDNT-OAHLLOKOSA-N 291.395 2.022 10 10 CECE CN(C)c1ccc(CNC(=O)CCOCC2CC2)cc1F 751247515 NFDRMSIQOIKFEL-UHFFFAOYSA-N 294.370 2.325 10 10 CECE COc1cc(CN2CCc3nccnc3C2)c(O)cc1C 853607104 UOQVJYRBWAQTHI-UHFFFAOYSA-N 285.347 2.058 10 10 CECE C[C@@H](N[C@H]1CCCS(=O)(=O)CC1)c1ccccc1O 694778786 YIOUTEFJQHGMPY-NEPJUHHUSA-N 283.393 2.010 10 10 CECE CCO[C@H](CN[C@H](C)c1ccccc1O)CN(C)C 926965943 UFPNAYZNYLBCCS-CHWSQXEVSA-N 266.385 2.010 10 10 CECE CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCC(=O)N2)cc1 850547588 UZLJRGOSDKZVHJ-OCCSQVGLSA-N 275.396 2.072 10 10 CECE CCN(CCCO[C@@H]1CCOC1)Cc1ccc(N)cc1 699539770 SVZCPBZASOKNIN-MRXNPFEDSA-N 278.396 2.286 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2ccccc2O)nc1 865647561 YMFAFKRGCMQEGD-NSHDSACASA-N 258.321 2.477 10 10 CECE O=C(CSC(F)F)N1Cc2cccc(O)c2C1 871205135 OUPSOALSBOAHMP-UHFFFAOYSA-N 259.277 2.190 10 10 CECE Cc1cccc([C@H]2NCCc3c2ccc(O)c3O)n1 75794233 ISQYIWBUHRESEP-AWEZNQCLSA-N 256.305 2.036 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CCC[C@H]2C[C@H]21 388130394 MAPQEVCFVIOADX-LOWVWBTDSA-N 266.345 2.398 10 10 CECE CCOc1ccc(O)c([C@@]2(CC)CO[C@@H](C)CN2)c1 83482239 WTECELDVWUOVGU-XHDPSFHLSA-N 265.353 2.405 10 10 CECE Oc1ccc([C@@H]2NCCc3cccc(O)c32)c(F)c1 83594266 IMSHXZJLWFBBGY-HNNXBMFYSA-N 259.280 2.472 10 10 CECE Nc1ccc(NC(=O)NCCCOC(F)(F)F)cc1 398236365 SLALRHRXAADETR-UHFFFAOYSA-N 277.246 2.317 10 10 CECE C[C@@H](O)c1ccc(N(C)CC2(C)COC2)c(F)c1 702951045 GQWXLMFYLGDZRM-SNVBAGLBSA-N 253.317 2.352 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1ccc2c(c1)CCO2 1136483461 ONGGZUIIAQIATA-UHFFFAOYSA-N 285.299 2.214 10 10 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DWQSOVIBMXPYQY-UHFFFAOYSA-N 260.297 2.477 10 10 CECE C[C@H]1CCC[C@@H](C)N1C(=O)CN1CC[C@@H](CN=[N+]=[N-])C1 1912185043 LEXGPZKNDVSVBA-XQQFMLRXSA-N 279.388 2.408 10 10 CECE C[C@H](NC(=O)CN1CCC[C@@H](N=[N+]=[N-])C1)c1ccco1 1912150739 XWAAOQAWWLOIGU-WDEREUQCSA-N 277.328 2.232 10 10 CECE C[C@H](NC(=O)CN(C)CCCN=[N+]=[N-])c1ccco1 1912180737 FNSWQGLQFWSFOD-JTQLQIEISA-N 265.317 2.089 10 10 CECE COc1cccc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)c1O 1912201739 YNKIMSNWTCOSJA-VIFPVBQESA-N 276.296 2.173 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cs2)C1 1912201508 VMRUYJJCDJVMSN-ZCFIWIBFSA-N 267.270 2.181 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N3CC4(CC4)C3)ccc21 1914934806 TZUKVKJASNNEFG-CQSZACIVSA-N 271.364 2.280 10 10 CECE CN[C@@H](C)c1ccc(N(C)CC2(CO)CC2)c(F)c1 1915530644 KXPZVBOQMWIRKY-NSHDSACASA-N 266.360 2.315 10 10 CECE CCN(c1ccc(CNC)cc1Br)C1COC1 1915668961 ZEIOFGVFIXYVFX-UHFFFAOYSA-N 299.212 2.394 10 10 CECE CC[C@H]1C[C@@H]1COC[C@@H](O)COc1ccc(N)cc1 2135824326 KFJVAWIMAGTFHK-OUCADQQQSA-N 265.353 2.071 10 10 CECE Cc1cccc(-c2nnnn2Cc2ccc(N)cc2)c1 213320898 YPRHPUJAQSHKBB-UHFFFAOYSA-N 265.320 2.279 10 10 CECE Oc1cccc(CNCC2CC(C(F)F)C2)c1O 1925163510 SXYUHYSSNGWILG-UHFFFAOYSA-N 257.280 2.479 10 10 CECE Nc1ccc(CC(=O)NCC2CC(C(F)F)C2)cc1 1925183148 ZZYYEJOZTURXSN-UHFFFAOYSA-N 268.307 2.219 10 10 CECE CC(C)CNC(=O)[C@@H](C)N[C@@H](C)c1cc(F)ccc1O 228977581 NJCVLPLSJFWTJB-WDEREUQCSA-N 282.359 2.343 10 10 CECE CNCc1ccc(N2C[C@@H](O)CC3(CC3)C2)c(Cl)c1 1926434068 NYSRTSMDWIUOTG-LBPRGKRZSA-N 280.799 2.411 10 10 CECE CC(C)[C@H](NC(=O)Cc1ccc(O)c(O)c1)C1CC1 1641018106 XHDFAKDZDWFWJS-HNNXBMFYSA-N 263.337 2.191 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1ncccc1[N+](=O)[O-] 2137714431 JZMKIBGTTKJFEF-UHFFFAOYSA-N 261.237 2.096 10 10 CECE CNC(=O)[C@@H](C)CN(C)[C@@H](C)c1ccc(Cl)cc1O 2138552181 FOKZMZDYXGNPNC-UWVGGRQHSA-N 284.787 2.421 10 10 CECE CN1CCCc2cc(CN[C@H]3C[C@@H]4CC[C@@H]3O4)ccc21 161962055 XPWLYSYEQDLVNN-ZOBUZTSGSA-N 272.392 2.479 10 10 CECE CCNC(=O)CN1CCCc2cc([C@H](C)NCC)ccc21 162261898 DVRRXNFGSQOQLH-ZDUSSCGKSA-N 289.423 2.246 10 10 CECE CC[C@@H]1CCN(c2ccc(CN)c(OC)c2)CCO1 2139699466 WILYJHDPBMLKPF-CQSZACIVSA-N 264.369 2.159 10 10 CECE COc1cc(N2CC(F)(F)C2)ccc1C=CC(=O)O 2139682992 PEXUCOUIPJNDAK-UHFFFAOYSA-N 269.247 2.248 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(OC)c2)[C@H](C)CO1 2139705009 UCOPJPCHGJGNKU-BXUZGUMPSA-N 264.369 2.158 10 10 CECE Cc1cc(N2C[C@H](CO)OC[C@@H]2C)ccc1CNC(C)C 167309750 QOHKQCZCDNUSHZ-WMLDXEAASA-N 292.423 2.079 10 10 CECE CN1CCC[C@@H](CN(C)Cc2cc([N+](=O)[O-])ccc2O)C1 152391140 DQSIVTPDCKMCMZ-GFCCVEGCSA-N 293.367 2.074 10 10 CECE Nc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 159397205 SWRNAXNXNYCFNR-UHFFFAOYSA-N 285.303 2.036 10 10 CECE COCCN(CCOC)/N=N/c1ccc2c(c1)OCO2 1860481823 UTWWWITZXDAQBX-CCEZHUSRSA-N 281.312 2.009 10 10 CECE CCN(CC)[C@@H](CCN)c1cccc(OC)c1O 11762710 UZBYDKISILEKFN-LBPRGKRZSA-N 252.358 2.133 10 10 CECE CC[C@H](C(=O)O)N1C[C@@H](C)Nc2cc(OC)ccc21 251208119 IUAINFFUVIJVDL-BXKDBHETSA-N 264.325 2.179 10 10 CECE CCc1cc(CNCC[C@@H](C)CN)ccc1OC 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C[C@@H](c1cc(F)ccc1O)N1CC([C@H]2CCNC2)C1 1886866964 UYUSFVAOGRYNMS-QWRGUYRKSA-N 264.344 2.134 10 10 CECE CC[C@H](c1ccccc1O)N1CC([C@@H]2CCNC2)C1 1886868479 VXUKYVTWSYNGJQ-IUODEOHRSA-N 260.381 2.385 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H](C)NC(=O)OC(C)(C)C 1887712502 MMIAVEHWXAKDCM-SECBINFHSA-N 285.348 2.058 10 10 CECE Nc1ccc(CN2CC[C@H](C(=O)O)CC23CC3)cc1 1891570625 CXOIMDRECJEUFE-LBPRGKRZSA-N 260.337 2.098 10 10 CECE CN[C@H](CC1CCC1)[C@H](O)c1ccc2c(c1)CCN2C 2147634271 BSZYYIULFBCJPG-NVXWUHKLSA-N 274.408 2.491 10 10 CECE CC[C@@H](N)Cc1cnc(Sc2cccnn2)s1 1949612062 SWLOHSMNSXMORK-MRVPVSSYSA-N 266.395 2.364 10 10 CECE ONCc1cc(Br)cc(Br)c1O 1951358316 WQDLLPIUANUYCG-UHFFFAOYSA-N 296.946 2.396 10 10 CECE C[C@H](N)c1ccc(N2CCN3C(=O)CC[C@@H]3C2)c(Cl)c1 168589626 FXUPYQWURMMZAO-CMPLNLGQSA-N 293.798 2.171 10 10 CECE C[C@H](N)[C@@H]1CCCCN1[C@H](C)c1cc(O)ccc1O 251228798 ASLNMWGWHKGHRJ-WDMOLILDSA-N 264.369 2.361 10 10 CECE CCOc1cccc(CNC[C@H](CO)C(F)(F)F)c1O 1967742248 FPQAZPATDUGLFO-SNVBAGLBSA-N 293.285 2.051 10 10 CECE Oc1cccc(F)c1CNCC12CCC(CC1)O2 1967810721 ZNTXRMRQZNTBQQ-UHFFFAOYSA-N 251.301 2.333 10 10 CECE CC1(C)CC[C@H](C(=O)O)N(Cc2ccccc2O)C1 1968207393 KXIKKDBEXQCCTK-GFCCVEGCSA-N 263.337 2.467 10 10 CECE COCCN(Cc1ccc(F)cc1O)[C@@H](C)COC 1968930851 GHSZVAXORYXXDI-NSHDSACASA-N 271.332 2.015 10 10 CECE CCCNCc1ccc(N2CC[C@@H](O)[C@@H](F)C2)c(F)c1 2144566191 IRJNJUKUIZNHTR-DZGCQCFKSA-N 284.350 2.234 10 10 CECE Oc1c(CNC[C@@H](O)CC(F)(F)F)ccc(F)c1F 1970818511 XWPKHZAJDQZADH-ZETCQYMHSA-N 285.212 2.073 10 10 CECE C[C@H]1CCN(CC(=O)N(C)c2ccc(N)cc2)C[C@H]1C 253074250 PMJPLXMJPRULRZ-QWHCGFSZSA-N 275.396 2.210 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCS[C@H](C)[C@@H]3C)ccc21 253079527 URNRGPXARWPTOG-RBZYPMLTSA-N 291.420 2.229 10 10 CECE C[C@@H]1C[C@H]2CN(Cc3cccc(Cl)c3O)CCN2C1=O 1971495902 BRAYXWCONGDSHD-PWSUYJOCSA-N 294.782 2.098 10 10 CECE CC1(C)CN(C(=O)Cc2ccc(N)cc2)CC1(F)F 1973825056 KEFXWSZRBUVJFJ-UHFFFAOYSA-N 268.307 2.315 10 10 CECE COCC1(CNC(=O)c2ccc(O)c(O)c2)CCCC1 2150627669 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2.369 10 10 CECE O=C(CCCNCc1ccc(Cl)cc1O)NC1CC1 1964036293 SHBJAPQKJHADAW-UHFFFAOYSA-N 282.771 2.194 10 10 CECE CCN(CCCC(=O)O)Cc1c(O)cccc1OC 1963270341 YLYXMUTYRZHBEN-UHFFFAOYSA-N 267.325 2.088 10 10 CECE CC[C@H]1COCCN1Cc1cc(C(C)=O)ccc1O 37312782 OYHXKUZAKKBMAW-AWEZNQCLSA-N 263.337 2.206 10 10 CECE Cc1cc(N(C)C[C@@H]2CC[C@@H](C)O2)ccc1CCN 1885300059 LGZVUWRFSIDZNN-CJNGLKHVSA-N 262.397 2.500 10 10 CECE COc1ccc(N2CCN(C(=O)/C=C(\C)Cl)CC2)cc1 899940125 GSKZRTFZANFTSJ-VAWYXSNFSA-N 294.782 2.486 10 10 CECE CN(CCOc1ccc(N)cc1)CC[C@H]1CCOC1 1885684213 QLOXAQJEFMAXJW-ZDUSSCGKSA-N 264.369 2.006 10 10 CECE COc1ccccc1NC[C@H](O)C[C@H]1CCCO1 1964698012 HIPZLLVAUVCZAJ-VXGBXAGGSA-N 251.326 2.037 10 10 CECE Cc1cccc(CN[C@@H]2CCC[C@@H](C(=O)O)C2)c1O 1964687775 SDLGEFAENZSUGC-DGCLKSJQSA-N 263.337 2.434 10 10 CECE CCCN1CCC(NCc2ccc(O)cc2O)CC1 20189624 JLJCEZUPBIMEBN-UHFFFAOYSA-N 264.369 2.062 10 10 CECE CC(C)(C)OC(=O)NC1(C(=O)NCCN=[N+]=[N-])CC=CC1 1965102440 PLIWWPVQTHSRDZ-UHFFFAOYSA-N 295.343 2.026 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)[C@]1(C)CCCCO1 2148156069 NOFHJWOIMMNLJH-PMPSAXMXSA-N 279.380 2.363 10 10 CECE CP(C)(=O)C1CCN(C(=O)Cc2ccc(N)cc2)CC1 1967339200 DEYXSIWEXZVWGG-UHFFFAOYSA-N 294.335 2.425 10 10 CECE C[C@H](NCc1nnn(C)c1C(F)F)c1ccccc1O 1967548132 WPJQIHKGPLGPMU-QMMMGPOBSA-N 282.294 2.309 10 10 CECE COc1cccc(CNC2CC(C(C)(C)O)C2)c1O 1967753634 STDWEJZQIWTRMO-UHFFFAOYSA-N 265.353 2.040 10 10 CECE CC[C@@H]1CCN(Cc2c(O)cccc2OC)CCO1 1967877980 BEYQVRNZOGBXSR-GFCCVEGCSA-N 265.353 2.402 10 10 CECE CN(C[C@@H](F)C1CCOCC1)c1ccc(CN)cc1 1972629939 GAVPRZDFHYFVPN-OAHLLOKOSA-N 266.360 2.346 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1C[C@@H]2COC[C@@H]2C1 1973083778 UYOOOBQLQTYZJL-IAZYJMLFSA-N 269.291 2.185 10 10 CECE CNCc1ccc(N2CCCC23CCN(C)CC3)cc1 2145383589 YCJADHLOTZKVQS-UHFFFAOYSA-N 273.424 2.471 10 10 CECE C[C@H]1OC2(C)CC1(NCc1ccc(F)c(F)c1O)C2 1973794002 JQZVLPOIEFTYCJ-UWEQVVMYSA-N 269.291 2.470 10 10 CECE CC(C)(CO)c1c(C(F)(F)F)ccc(O)c1O 258266480 CELJWQAVQXWZRT-UHFFFAOYSA-N 250.216 2.387 10 10 CECE NN[C@@H](c1ccccc1O)C1(N2CCCC2)CCCC1 2146234716 NMFAWYUQPOVWGV-HNNXBMFYSA-N 275.396 2.305 10 10 CECE COC(=O)CC[C@@H](N)c1cc([C@@H](C)F)ccc1O 260118952 HMCZEHWPSWANGA-LDYMZIIASA-N 255.289 2.376 10 10 CECE Cc1cc(CNCC(C)C)ccc1N1C[C@H](O)[C@@H](F)C1 2149240669 DYYILQZQKMNBTK-HOCLYGCPSA-N 280.387 2.260 10 10 CECE CN1CCCc2cc([C@@H](O)C(=O)c3cscn3)ccc21 2147118912 STCNSWURQKIARE-CQSZACIVSA-N 288.372 2.442 10 10 CECE CCC[C@@H](C)N(C)C[C@H](O)COc1ccc(N)cc1 36789732 WPODANUZOWQQQW-OCCSQVGLSA-N 266.385 2.129 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)[C@@H]1[C@H]2CCC[C@H]21 2151276456 UAKGIXZDRVQQSD-FOLVSLTJSA-N 274.364 2.295 10 10 CECE CCOC(C)(C)COCC(=O)N(C)c1ccc(N)cc1 2150566110 WPLVQBIUYMBKEI-UHFFFAOYSA-N 280.368 2.063 10 10 CECE NC(=O)CCCNCc1ccc(N2CCCCC2)cc1 37659252 OBDHMTHMQMNQPF-UHFFFAOYSA-N 275.396 2.032 10 10 CECE C[C@@H](O)[C@H]1CCN(c2ccc(CNC3CC3)cc2)C1 162198247 CYLKKENTHSNFIP-OCCSQVGLSA-N 260.381 2.146 10 10 CECE CN(Cc1ccccc1O)C(=O)c1ccc(CN)cc1 37823733 FJHRTJUFHFDJJU-UHFFFAOYSA-N 270.332 2.123 10 10 CECE COC(=O)C(C)(C)CSc1ncc([C@H](C)O)s1 1997403725 GXPJQTMNWKRJCE-ZETCQYMHSA-N 275.395 2.488 10 10 CECE Nc1ccc(OCCNC(=O)[C@@H]2CCC[C@H](F)C2)cc1 2152324206 IQPLIXGKYTYPBS-NEPJUHHUSA-N 280.343 2.292 10 10 CECE CN(c1ccc(CN)cc1Cl)[C@@]1(C)CCOC1 2006841050 GCPZCZZUAIZHOC-ZDUSSCGKSA-N 254.761 2.414 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2COCCCO2)cc1 2153984975 DODSKBAUHPANPV-CZUORRHYSA-N 278.396 2.209 10 10 CECE CNCc1ccc(OCC(=O)N[C@H](C)C(C)C)c(C)c1 2155022118 MTNSEOYBJKGTFL-CYBMUJFWSA-N 278.396 2.254 10 10 CECE CC1(C)C[C@@H](C(=O)O)CCN1Cc1ccc(O)cc1O 2155060829 CMIBCOJIJFEHPG-JTQLQIEISA-N 279.336 2.173 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@@H]1CCC[C@H]2C[C@@H]21 2155390869 NBUOVEZMDTVVKX-WCFLWFBJSA-N 275.348 2.401 10 10 CECE Nc1ccc(NC(=O)COC2CC(F)(F)C2)cc1 2031585723 ZEVODBUMILWOPA-UHFFFAOYSA-N 256.252 2.022 10 10 CECE C[C@H](NC[C@H]1OCC[C@@H]1C)c1cc(O)ccc1O 2034988177 YZCLQWTVEYAQRD-PKFCDNJMSA-N 251.326 2.173 10 10 CECE C[C@@H]1CN(C(=O)[C@@H]2CNc3ccccc3N2)C[C@H]1C 300298052 HIWVKZRHADODHY-GYSYKLTISA-N 259.353 2.007 10 10 CECE CC(C)[C@@](O)(CN1CC[C@@H](N=[N+]=[N-])C1)C(F)(F)F 2038028945 SQRTWYFKONJCEG-BDAKNGLRSA-N 266.267 2.320 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CC[C@@H]3C[C@@H]3C2)cc1 403287261 SLKNKYHNASLTDD-YRGRVCCFSA-N 274.364 2.343 10 10 CECE CN(C[C@@H]1C[C@@H]1C(F)F)c1ccc2c(c1)NC(=O)[C@@H]2O 2159777046 RIRRXNHCJOKZPA-VIRWGQHYSA-N 282.290 2.010 10 10 CECE COCCO[C@@H]1CCN(c2ccc([C@H](C)O)cc2F)C1 2158702305 WSRMMFRCRQBEDU-WCQYABFASA-N 283.343 2.121 10 10 CECE CCN(Cc1cccc(F)c1O)[C@H]1CCCCNC1=O 2171192365 ITRSLPOBMFIXIS-ZDUSSCGKSA-N 280.343 2.022 10 10 CECE CCN(c1ccc(CNC)c(Cl)c1)[C@H]1CCCNC1=O 2171242682 SPRIQQIOZVGOEI-AWEZNQCLSA-N 295.814 2.164 10 10 CECE C[C@@H]1CN(C)CCCN1Cc1ccc(F)c(F)c1O 703519915 WRDMJSNVEOJKFZ-SNVBAGLBSA-N 270.323 2.196 10 10 CECE O=C(NCc1ccncc1Cl)c1ccc(O)c(O)c1 704407541 JEKLXLSDISTVPZ-UHFFFAOYSA-N 278.695 2.076 10 10 CECE C[C@H](O)c1ccc(N2CCOC(C)(C)[C@H]2C)cc1O 687924084 VDQJULDIVBDVJN-WDEREUQCSA-N 265.353 2.449 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](CO)CC(C)(C)C2)cc1O 2172572256 OMZONEXHZZQJML-NEPJUHHUSA-N 279.380 2.290 10 10 CECE CCn1ncc([C@H](N)c2ccc3c(c2)CCN3C)c1C 2163136605 VKMQJYBCJWWSOF-MRXNPFEDSA-N 270.380 2.252 10 10 CECE CC(C)c1nnsc1[C@@H](NN)c1ccc(N(C)C)cc1 2163110095 FWDQYCBAUOKCPY-ZDUSSCGKSA-N 291.424 2.280 10 10 CECE CCN(C[C@H](C)O)c1ccc(CNC)cc1Cl 691409891 IFYQBWGVCLKFHM-JTQLQIEISA-N 256.777 2.267 10 10 CECE CNCc1ccc(N2CC[C@](C)(CO)C2)cc1Cl 381333514 CCWQRHIVYVHBEL-AWEZNQCLSA-N 268.788 2.268 10 10 CECE CCN(CCOC[C@@H]1CCCO1)Cc1ccc(N)cc1 693047808 OHPRALAQTNKAND-INIZCTEOSA-N 278.396 2.286 10 10 CECE C[C@H](NCc1cc2c(cc1O)OCO2)[C@H]1CCCCO1 381877553 HEDGYRBLEDAIKQ-GXFFZTMASA-N 279.336 2.168 10 10 CECE Nc1ccc(CS(=O)(=O)NC[C@]23CCCC[C@H]2C3)cc1 693571012 XWNPPVNWDNNNGR-DZGCQCFKSA-N 294.420 2.269 10 10 CECE COc1cccc(CN2CC[C@@H](N(C)C)[C@@H](C)C2)c1O 693629193 HQPNPELIEWPYCH-GXTWGEPZSA-N 278.396 2.173 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@@]1(C)C[C@@H]1C 714675659 CPVJQJCPRUTGRN-NHCYSSNCSA-N 254.334 2.254 10 10 CECE CC(C)c1ncc(Cn2ccc3c(c2=O)CNCC3)s1 2172952846 MZAODBREWKUSTC-UHFFFAOYSA-N 289.404 2.122 10 10 CECE CCN(CC)C1[C@@H]2CN(c3ccc(CNC)cc3)C[C@@H]12 384214470 DAIDJIWBAPFEPL-HZPDHXFCSA-N 273.424 2.182 10 10 CECE C[C@H](N(C)S(=O)(=O)Cc1ccc(N)cc1)C1(C)CC1 385362423 GPYNSNWWYONTSW-NSHDSACASA-N 282.409 2.219 10 10 CECE Oc1ccc(Cl)cc1CN1C[C@@H]2COC[C@H]2C1 718263424 AGNFUPOJKDZABB-GHMZBOCLSA-N 253.729 2.124 10 10 CECE COc1cccc(CN[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2O3)c1O 386613129 BZIBFGRTRJLBQL-AHLTXXRQSA-N 277.364 2.446 10 10 CECE C[C@@]1(CO)CCCCN1c1ccc(CN)cc1F 722968264 GSDVJBSMHYIQKT-AWEZNQCLSA-N 252.333 2.026 10 10 CECE C[C@@H]1CC(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C[C@@H](C)O1 724374759 JEORIXVQCVLHPM-CKYFFXLPSA-N 266.345 2.491 10 10 CECE COCCC(C)(C)NC(=O)CCc1ccc(N)cc1 398373605 QALIKOPNDOFSRE-UHFFFAOYSA-N 264.369 2.133 10 10 CECE CC[C@H]1C[C@@H](C)CN1C(=O)COc1ccc(N)cc1 399743784 JVWFUZWYGHIVIR-YPMHNXCESA-N 262.353 2.295 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)c1ccsn1 2167133342 MMOATVCDQWZKDY-CABCVRRESA-N 289.404 2.130 10 10 CECE COc1cccc(Cn2ncc(CC(C)C)c2N)c1O 2070262298 QDMORLBLZSGENN-UHFFFAOYSA-N 275.352 2.426 10 10 CECE Cc1nn(Cc2c(O)cccc2Cl)cc1CO 2070280244 FNTVXMGOCDMBKL-UHFFFAOYSA-N 252.701 2.091 10 10 CECE COc1cc(Cl)cc(CN[C@H]2C[C@H](CN(C)C)C2)c1O 2169450923 OTGZULDPUYMDDV-MJHDQNEOSA-N 298.814 2.484 10 10 CECE COc1cccc(CN[C@@H]2CCN(C3CCC3)C2)c1O 2169572263 ZHPNMBBIKOQQCU-CYBMUJFWSA-N 276.380 2.117 10 10 CECE Cc1cccc(O)c1CN[C@H]1c2ccccc2C[C@@H]1O 2176406500 XPLMKROWMKUVPK-IRXDYDNUSA-N 269.344 2.449 10 10 CECE CCN(C)C[C@@H]1CCN([C@@H](C)c2c(O)cccc2O)C1 2170299102 VASXBPYRHBJXLR-STQMWFEESA-N 278.396 2.432 10 10 CECE CS[C@H]1CN(CCCc2ccc(N)cc2)C[C@@H]1N(C)C 2170699877 VLFXZQGFHBBPNO-HOTGVXAUSA-N 293.480 2.179 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ccc[nH]1 2170992067 RNYQLRMAMWFGFV-GFCCVEGCSA-N 272.304 2.403 10 10 CECE Cc1ccc(O)c(CN(C)[C@H]2CCCC(=O)N(C)C2)c1 2188460455 QVMWCIOKFWLGJP-AWEZNQCLSA-N 276.380 2.143 10 10 CECE CCCNCc1ccc(N2CCN(C)C3(CC3)C2)cc1 2188417590 DHWOSJPCMYXXBR-UHFFFAOYSA-N 273.424 2.471 10 10 CECE C[C@H]1OC2(C(=O)N3CCCC[C@@H](CN=[N+]=[N-])C3)CC1C2 2193086069 AYWSZTJKHAWABE-QZPOHEPASA-N 278.356 2.493 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H]4CC[C@@]4(CO)C3)ccc21 2198875939 GVKYXOFDLDANEC-XYPHTWIQSA-N 272.392 2.102 10 10 CECE C[C@H](N[C@@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12)c1c(O)cccc1O 2188731013 LFCCSLFAMCWDJT-LALDZFCWSA-N 275.348 2.314 10 10 CECE NCc1ccc(N2C[C@H]3COCC[C@@H]32)c(C(F)(F)F)c1 2193275043 NJOHMCRAQAAIGK-JQWIXIFHSA-N 286.297 2.389 10 10 CECE Oc1cc(-c2nc([C@@H]3CC[C@@H]4C[C@@H]43)no2)cc(O)c1O 2188909046 ICODIPALKDCVKG-VDAHYXPESA-N 274.276 2.367 10 10 CECE CCC(=O)N1CCN(c2ccc(CNC)cc2Cl)CC1 2182606531 VXHIXSCQIXMOCB-UHFFFAOYSA-N 295.814 2.118 10 10 CECE CN1CCc2cc([C@@H](O)c3cnc(F)c(F)c3)ccc21 2183237389 ATBKBHDZGNHBOS-CQSZACIVSA-N 276.286 2.434 10 10 CECE Oc1c(F)cc(F)cc1CNCc1ccnn1C1CC1 2194125625 PGNXTPQFBBZUAM-UHFFFAOYSA-N 279.290 2.492 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@H]4C[C@@H](O)[C@H]3C4)ccc21 2184687457 ROCAXDPLHPJLPO-GAEVZRCVSA-N 272.392 2.243 10 10 CECE CCN[C@@H]1CCc2cc(N3CC(CN(C)C)C3)ccc21 2184725469 JEKWIHYMUPGLRF-QGZVFWFLSA-N 273.424 2.281 10 10 CECE Nc1ccc(CCN[C@H]2C[C@@H](Cn3cccn3)C2)cc1 2184816714 SQDPSLJBBLBDSQ-FZNQNYSPSA-N 270.380 2.076 10 10 CECE FC(F)(F)COc1ccc(N2C[C@H]3NCC[C@@H]3C2)cc1 2194318540 LZZBLQRUIPBCSY-ZWNOBZJWSA-N 286.297 2.426 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@H]1CC[C@@H](O)CC1 2042067931 QIJHLVQHOUUFIQ-BJHJDKERSA-N 252.333 2.024 10 10 CECE C[C@H](O)c1cc(F)c(N2Cc3cnn(C)c3C2)c(F)c1 2194522407 KSZOXKPTUINEHR-QMMMGPOBSA-N 279.290 2.272 10 10 CECE C[C@@H]1CN(c2c(F)cc([C@@H](C)O)cc2F)CC[C@@H]1CO 2194527544 YHJCFDOAPRCPGS-GMTAPVOTSA-N 285.334 2.473 10 10 CECE CC(F)(F)[C@H]1C[C@H]1C(=O)NCc1ccccc1O 2045970103 RNWCPKVNASLHSQ-ZJUUUORDSA-N 255.264 2.300 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC(N(C)C3CC3)C2)c(F)c1 2194716479 YVIGBRXDPYBWCO-SECBINFHSA-N 281.350 2.267 10 10 CECE CC[C@H](N)c1ccc(N2CC[S@](=O)[C@@H](C)C2)cc1 2051913486 DBWQRIQHUSGOJR-MIUNTBIASA-N 266.410 2.054 10 10 CECE Nc1ccc(CCNC(=O)Nc2cnsc2)cc1 2052567569 UTKQUUAZHHIWRY-UHFFFAOYSA-N 262.338 2.090 10 10 CECE CC1(O)CCN(c2cc(Cl)c(CN)cc2F)CC1 2057250775 XONCWEJIRRYVPQ-UHFFFAOYSA-N 272.751 2.289 10 10 CECE CCC[C@H](C)NC(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2059057595 GMMUJSWZIRJEMA-QWRGUYRKSA-N 253.350 2.066 10 10 CECE CN(c1ccc(CN)cc1Cl)C1CC2(COC2)C1 2061782692 LFHOQUOBRPYQLL-UHFFFAOYSA-N 266.772 2.414 10 10 CECE O[C@@H]1CCN(c2ccc(CNC3CC3)cc2)[C@H]1C1CC1 2187155334 GVWTVLQAZYMKNA-SJORKVTESA-N 272.392 2.288 10 10 CECE O=C(CN1[C@H]2CC[C@H]1CC(F)C2)c1ccc(O)c(O)c1 2192117983 BNNXMWOGBDYBSV-RYUDHWBXSA-N 279.311 2.245 10 10 CECE CN(C)c1ccc([C@H](NN)C2CC(C)(F)C2)cc1 2065812727 JWZOGAMLRFTTON-QRMWWUJWSA-N 251.349 2.395 10 10 CECE CO[C@@H]1C[C@H](CF)N(Cc2cc(F)ccc2O)C1 2069998206 ZONIGBAAZUCSJB-VXGBXAGGSA-N 257.280 2.090 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2CC3(CCC3)CO2)C1 2110143654 BITYABUZLMEXLK-GHMZBOCLSA-N 264.329 2.247 10 10 CECE CO[C@H]1CCN(c2ccc3c(c2)CCCN3)C[C@H]1OC 2199548465 AUVOPKYPAQWFIV-JKSUJKDBSA-N 276.380 2.285 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1C[C@](C)(F)C1 2077782664 WRRFQCFBOXWKLR-YEORSEQZSA-N 251.301 2.489 10 10 CECE C[C@]1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)CCCCO1 2078494841 YMOPQWYQKGGYAS-ZYHUDNBSSA-N 252.318 2.247 10 10 CECE C[C@@H](c1ccccc1O)N(C)[C@H]1CCCN(C)C1=O 2101128901 PQAYIGKEYLGSPA-AAEUAGOBSA-N 262.353 2.006 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3CCC[C@]3(CO)C2)cc1 2103170598 DOWCMMUCHCTBDY-JGGQBBKZSA-N 260.381 2.305 10 10 CECE COc1ccc(CNCC[C@@H]2CO[C@@H](C)C2)c(O)c1 2103184804 XGFGPWUOCUDAAV-RYUDHWBXSA-N 265.353 2.306 10 10 CECE CCc1ocnc1C(=O)N1CCC(CN=[N+]=[N-])CC1 2104139213 HMBSBVNPSKXRMH-UHFFFAOYSA-N 263.301 2.400 10 10 CECE CNCc1ccc(N2CCC=C(F)C2)cc1OC 2084015363 AUOBPEZXWKYSMF-UHFFFAOYSA-N 250.317 2.478 10 10 CECE COc1cccc(O)c1CNCc1cnn(C)c1Cl 2104441288 ZBXJEJHQSXLHQK-UHFFFAOYSA-N 281.743 2.078 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)c1ncccc1C 2105379577 NRMXETXMPJEWNP-CABCVRRESA-N 258.321 2.090 10 10 CECE C[C@@H]1CNCC[C@@H]1N(C)c1ccc2c(c1)CCCO2 2106597563 QXRGQWOOFYRSDJ-DOMZBBRYSA-N 260.381 2.446 10 10 CECE CN1CCCc2cc([C@H](O)C[C@@H]3CCCN3)ccc21 2106824798 COXKJGNYPVUZIW-GOEBONIOSA-N 260.381 2.245 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@]3(C)CCCN3)ccc21 2106822427 FSDZYDOXFGFWHU-HZPDHXFCSA-N 260.381 2.245 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](O)[C@@H](F)C2)cc1 2088302395 VQLQLSPFTGQHPB-GJZGRUSLSA-N 266.360 2.094 10 10 CECE C[C@@H]1CCOCC[C@]1(O)c1ccc2c(c1)CCN2C 2109112535 PQXMEVLQBNKDSS-MLGOLLRUSA-N 261.365 2.313 10 10 CECE CN1CCc2cc([C@H]3NC[C@H](C4CC4)CO3)ccc21 2089973246 PSQSDEINXDZXDS-HOCLYGCPSA-N 258.365 2.324 10 10 CECE Cc1cc2n(n1)CCN(c1ccc([C@H](C)N)cc1)C2 2089968707 RRFTWWSXGDSUDH-LBPRGKRZSA-N 256.353 2.231 10 10 CECE CN[C@H](C=C(C)C)[C@H](O)c1ccc2c(c1)CCN2C 2091227304 ZNESJHTYRWEECI-GDBMZVCRSA-N 260.381 2.267 10 10 CECE CNCc1ccc(N(C)C[C@@H](O)C2CCCC2)cc1 2111302105 ORXCHTDJAAVHCL-MRXNPFEDSA-N 262.397 2.393 10 10 CECE C[C@H](O)c1ccc(N2CCOC3(CCC3)C2)cc1O 2095420508 XROJPASYOJCEPL-NSHDSACASA-N 263.337 2.205 10 10 CECE CCn1cnc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)c1 2099332349 IJEPTVGVSITFMN-SNVBAGLBSA-N 262.317 2.208 10 10 CECE Nc1ccc(CCN2CCCO[C@@H]3CCC[C@H]32)cc1 2113809482 RJEHKVLSRWEPRY-HZPDHXFCSA-N 260.381 2.455 10 10 CECE CCN(C)C[C@H]1CCN(c2ccc(CN)cc2C)C1 2113867664 TTWRXJAIIFFPOG-OAHLLOKOSA-N 261.413 2.232 10 10 CECE Oc1ccc(CNC[C@@H]2[C@H]3CCC(F)(F)[C@H]32)c(O)c1 2114401782 LIEZNDGSWOYBIE-NQBHXWOUSA-N 269.291 2.479 10 10 CECE COc1cc(N2C[C@H](F)[C@@H](F)C2)ccc1CNC1CC1 2204556940 JXWNKRZPQLOUKC-KBPBESRZSA-N 282.334 2.443 10 10 CECE Cc1ccc(CN[C@H](C)CS(=O)(=O)C(C)(C)C)c(O)c1 2204632316 GRYXYZUCZNMMQM-GFCCVEGCSA-N 299.436 2.392 10 10 CECE Cc1cccc(CNC(=O)[C@H]2CCCC[C@]2(C)N)c1O 2204621208 MNDADIXBAKZERX-CJNGLKHVSA-N 276.380 2.224 10 10 CECE CCN(Cc1ccc(F)cc1O)[C@H]1CCCCNC1=O 2204654513 GBDUFCIPYCWFIU-ZDUSSCGKSA-N 280.343 2.022 10 10 CECE CNCc1nccc(N(C)Cc2ccccc2O)c1C 2205623658 HSZRXGLAUCZHDY-UHFFFAOYSA-N 271.364 2.451 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](N)CC[C@H]3C2)cc1OC 2206165312 BJELDOSSYIHPTA-YNEHKIRRSA-N 276.380 2.267 10 10 CECE CC[C@H](C)[C@H](Nc1c(N)cccc1C(N)=O)C(F)F 2271601332 KYGCOMKDXOWZSV-XVKPBYJWSA-N 271.311 2.459 10 10 CECE COc1ccc(N2Cc3ncsc3C2)c(C=O)c1 2220423718 PTAXTEYZTURJCG-UHFFFAOYSA-N 260.318 2.484 10 10 CECE CN(Cc1cc(N)ccc1O)[C@@H]1CC[C@@H]2[C@H]1C2(F)F 2230450875 UJISKNMRMWETCL-NQBHXWOUSA-N 268.307 2.450 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2cccc3c[nH]nc23)C1 2230485191 HOBDUPXCHYVVOY-SECBINFHSA-N 256.269 2.088 10 10 CECE CN(C)c1ccc(OC[C@@H](N)c2cnsc2)cc1 2221875419 BWMDBZSMNGUNPZ-CYBMUJFWSA-N 263.366 2.288 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CC[C@H]2C(F)(F)F)cc1 2232620450 PXQZPORGEVWIIN-MNOVXSKESA-N 288.269 2.105 10 10 CECE Cc1cccc(O)c1CN[C@@H](C(N)=O)c1ccccc1 2232830074 KTVBHWSRWVYQRY-OAHLLOKOSA-N 270.332 2.017 10 10 CECE COC1(CF)CN(c2ccc([C@@H](C)O)cc2C)C1 2223981734 CUNYBKJJZRVRGI-LLVKDONJSA-N 253.317 2.223 10 10 CECE CC(C)N(CCOCCF)Cc1ccc(N)cc1 2224060020 SSPQNUGXILZPQM-UHFFFAOYSA-N 254.349 2.465 10 10 CECE CN(C)C[C@@]1(O)CCN(c2ccc3c(c2)CCCC3)C1 2235113750 TZQQXJFCCHNJFZ-KRWDZBQOSA-N 274.408 2.068 10 10 CECE C[C@@H]1O[C@H](C)[C@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])[C@@H]1C 2225800573 RMTWYSITEDVAEB-IXXAWXHISA-N 266.345 2.394 10 10 CECE COc1ccc(N2CCCC[C@H]2CN(C)C)c(CN)c1 2235953512 BOAGKCACUBNQJO-AWEZNQCLSA-N 277.412 2.074 10 10 CECE COc1ccc(N2CC[C@H]2C2CCOCC2)c(CN)c1 2235970276 NYNZBFRNSBNOOD-INIZCTEOSA-N 276.380 2.159 10 10 CECE Oc1cccc2c1[C@H](NC[C@@H]1COC3CC1C3)CC2 2226346074 RBFFAKQURSSOJT-FKZOYECMSA-N 259.349 2.394 10 10 CECE COc1ccc(N2CCC[C@H]2C(C)(C)O)c(OC)c1 2226804969 LPGOPTXZAKALCW-AWEZNQCLSA-N 265.353 2.444 10 10 CECE COc1ccc(N2CC[C@H](O)[C@H]2C(C)C)c(OC)c1 2226803519 ZGEVRORMYYRMOL-DZGCQCFKSA-N 265.353 2.299 10 10 CECE CN(C)c1ccc(OCc2ccnc(C(=O)O)c2)cc1 2237697193 DBNQHBOXWSKBKZ-UHFFFAOYSA-N 272.304 2.425 10 10 CECE C[C@@H]1C[C@H](O)[C@@H](C)N(c2ccc([C@@H](C)O)c(O)c2)C1 2227600186 MISWHWPTBSJWBJ-BIAAXOCRSA-N 265.353 2.041 10 10 CECE COc1ccc(N(CC(F)F)C2CC2)c(CCN)c1 2227685519 HIRYNVDMOPAJNM-UHFFFAOYSA-N 270.323 2.430 10 10 CECE CC[C@]1(C)COCCN1c1ccc(OC)cc1CN 2227680931 DGMNIKCJILWPGO-OAHLLOKOSA-N 264.369 2.159 10 10 CECE COc1ccc(N(C)[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)c(CO)c1 2227711318 OAUMEXNYWRULOA-KQKHJQKJSA-N 259.349 2.278 10 10 CECE CN(C[C@H](F)[C@H]1CCOC1)C(=O)Nc1ccc(N)cc1 2238341506 ZLMURYQUCNRQDQ-GWCFXTLKSA-N 281.331 2.107 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC=C[C@]1(C)C(=O)O 2239429187 GNMZGNDPHJWWFQ-MEBBXXQBSA-N 277.320 2.264 10 10 CECE CCOc1ncc([C@@H](O)[C@@H](NC)c2ccccc2O)s1 2239774061 VBRMKLGMQHOIHI-QWHCGFSZSA-N 294.376 2.242 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@]2(F)CCOC2)cc1O 2229945629 MSEQOSJVYIGBMG-HZMBPMFUSA-N 269.316 2.010 10 10 CECE CC[C@H](C)NCc1ccc(N(C)C2CN(C)C2)c(F)c1 2240046392 HYDNXCOBQKHBCV-LBPRGKRZSA-N 279.403 2.464 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@@H](C)CCS(C)(=O)=O 2240751335 DHZHSNWSECTNHM-STQMWFEESA-N 298.452 2.274 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H](C)C(=O)NC)c(C)c1 2240755533 VUJPGJZRDPSQBC-OLZOCXBDSA-N 277.412 2.236 10 10 CECE C[C@@H](Sc1ncc(C(=N)NO)s1)[C@H]1CCCO1 2253285466 LTQPBPPHTBZNCS-RNFRBKRXSA-N 273.383 2.107 10 10 CECE CO[C@@H](C)CS[C@@H](C)C(=O)Nc1ccc(N)cc1 2256535167 USBOAWCIQRLZOA-UWVGGRQHSA-N 268.382 2.364 10 10 CECE Cc1ccc(CN2C[C@@H](CC(=O)O)C[C@@H]2C)c(O)c1 2270160923 WCSRUMIZKIOUBO-NWDGAFQWSA-N 263.337 2.386 10 10 CECE O=C(NC[C@]12CCC[C@H]1CC2)c1ccc(O)c(O)c1 2273385364 WWDKXHYIKSOSJE-XHDPSFHLSA-N 261.321 2.408 10 10 CECE COc1ccc(O)c([C@@H](C)NCC[C@@H]2CCO2)c1 2264021281 IUMMTMLBQPLCAD-GHMZBOCLSA-N 251.326 2.230 10 10 CECE NC[C@H]1CC(F)(F)CN1Cc1c(O)cccc1Cl 2264261894 SBSSOKIBUUYQKV-MRVPVSSYSA-N 276.714 2.214 10 10 CECE CN(C)c1ccc(CN(C)[C@@H]2CNCC2(C)C)cc1 2274228654 YGMWLJCZILAZTB-OAHLLOKOSA-N 261.413 2.182 10 10 CECE Nc1ccc(CNC[C@]23C[C@](C(F)F)(CO2)C3)cc1 2266283305 GHAJNWNIRAOKAP-HDJSIYSDSA-N 268.307 2.173 10 10 CECE CSc1ncc(CNC(=O)c2cc(N)cnc2C)s1 2269094779 UPGJFCJTTDZIPY-UHFFFAOYSA-N 294.405 2.081 10 10 CECE COc1ccc(N2CC(C(C)(C)O)C2)c2c1CCC2 2269164358 MPYCRISOYOKREN-UHFFFAOYSA-N 261.365 2.391 10 10 CECE Cc1cc(N(C)Cc2ccnn2C)ccc1[C@@H](C)O 2269685663 FBTFVZHVHDKRCC-GFCCVEGCSA-N 259.353 2.418 10 10 CECE Cc1cc(N2CC(n3ccnc3)C2)ccc1[C@@H](C)N 2269660367 KMDIOMJEJAWUIJ-GFCCVEGCSA-N 256.353 2.273 10 10 CECE C[C@H](CNCc1ccc(N2CCNCC2)cc1)C(F)F 2286067560 CIJRQHKGSQIQNK-GFCCVEGCSA-N 283.366 2.087 10 10 CECE CC[C@H](O)CN(CC)c1c(OC)cc(OC)cc1OC 2287067845 FMMSNXXUYFWSMX-NSHDSACASA-N 283.368 2.310 10 10 CECE Cc1ccc(/C=C\C(=O)N2CCc3ccncc32)cn1 492546463 DLGDWSGRWJNEMX-PLNGDYQASA-N 265.316 2.388 10 10 CECE CNC1(CNCc2ccc(C)c(Br)c2O)CC1 2307571285 SLELGDYLJUMIFE-UHFFFAOYSA-N 299.212 2.305 10 10 CECE CC(C)N1CC[C@@](Sc2nccs2)(C(=O)O)C1 2307033607 HVBLLSVHTJJRGO-NSHDSACASA-N 272.395 2.173 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)C[C@@H]1CC[C@@H](F)C1 2315992267 JSZPXGVZZIFZCD-NXEZZACHSA-N 278.353 2.087 10 10 CECE CC(=O)N1CCN(N=Nc2cc(C)ccc2C)CC1 2330162811 QFEOSHPVJCPPFU-UHFFFAOYSA-N 260.341 2.466 10 10 CECE CSc1cc(N2C[C@@H]3CCO[C@@H]3C2)ccc1CN 2328542935 GPAKOCOQZCTDST-WCQYABFASA-N 264.394 2.092 10 10 CECE CN(C)c1ccc([C@H](N)[C@@]2(O)C[C@@H]3CC[C@H]2C3)cc1 2329488852 KQDKGJIYAZAXQP-SHPPOPEUSA-N 260.381 2.304 10 10 CECE CC(C)C(C)(C)OC[C@@H](O)COc1ccc(N)cc1 2337620100 PHZBYDOMUIHHCQ-ZDUSSCGKSA-N 267.369 2.460 10 10 CECE CS[C@H]1C[C@@H](OC(=O)CCOc2ccc(N)cc2)C1 2353071170 NJCBBONZYLPKKH-BETUJISGSA-N 281.377 2.475 10 10 CECE Nc1ccc(NC(=O)COC2CC3(CSC3)C2)cc1 2353381636 JBTHYNSSBBVTHD-UHFFFAOYSA-N 278.377 2.120 10 10 CECE Nc1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3CO2)cc1 2355837364 FAGMLIHXPZFVAU-GZBFAFLISA-N 275.348 2.170 10 10 CECE Cc1noc(CN[C@@H](C)c2ccc(F)cc2O)n1 62747848 PSJBPNDEURHWNY-ZETCQYMHSA-N 251.261 2.074 10 10 CECE Nc1ccc(Br)c([C@@H]2CCCN2)c1O 307729250 GYIVLQORNMTWMZ-QMMMGPOBSA-N 257.131 2.161 10 10 CECE NCc1ccc(N2CC[C@@H](C(F)(F)CO)C2)c(Cl)c1 1892707087 IZVZNZXUZWCJGT-SNVBAGLBSA-N 290.741 2.253 10 10 CECE COc1ccc(N(CCCN)CCc2ccccn2)cc1 37662346 PIBLPHHCXLFZHO-UHFFFAOYSA-N 285.391 2.488 10 10 CECE COc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1O 126892554 ZXBGKVPFWXJSAK-GHMZBOCLSA-N 251.326 2.010 10 10 CECE CC[C@@H](C)NC(=O)CCN[C@H](C)c1ccc(OC)cc1O 38013891 SWMDUWDKXGAHIE-VXGBXAGGSA-N 294.395 2.356 10 10 CECE CN(CCN1CCCC1)c1ccc(/C=C\C(=O)O)cc1 213971339 QBRVSVDUNGIWLH-TWGQIWQCSA-N 274.364 2.316 10 10 CECE CC1(NS(=O)(=O)Cc2ccc(N)cc2)CCCC1 42176132 QAEPJXQTIQDTMN-UHFFFAOYSA-N 268.382 2.021 10 10 CECE C[C@H](N)[C@@H]1CCN([C@@H](C)c2cc(F)ccc2O)C1 227202048 RYQNPOFSPFUASN-GARJFASQSA-N 252.333 2.261 10 10 CECE C[C@@H]1CN(Cc2c(O)ccc3ccccc23)C[C@H](CO)O1 191520580 QGXKDFMPOBGPMH-TZMCWYRMSA-N 287.359 2.127 10 10 CECE CC(=O)NN1C(=O)/C(=C/c2ccccc2F)SC1=S 40867514 LPZRIVANHUXFDF-POHAHGRESA-N 296.348 2.078 10 10 CECE N=C1NC(=O)N(Cc2ccccc2)[C@H]1c1ccc(O)c(O)c1 381874934 ZXALBAHESHGCKL-AWEZNQCLSA-N 297.314 2.342 10 10 CECE O=C1CC[C@@H](c2ccc(Br)cc2O)N1 238727387 SJUNHAPLSJBSGB-QMMMGPOBSA-N 256.099 2.106 10 10 CECE CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 335808071 HTXXFHJVAUNVFL-UHFFFAOYSA-N 285.391 2.154 10 10 CECE CN1CCC(C[C@H](O)c2ccc3c(c2)CCN3C)CC1 2163064282 VZDOSKKVBUXIDD-KRWDZBQOSA-N 274.408 2.444 10 10 CECE CCN1CCc2cc([C@H](O)c3cc(C)n(C)n3)ccc21 2163060984 FHTPQNCFJSUONK-INIZCTEOSA-N 271.364 2.193 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3C[C@@](F)(CN)C3)ccc21 2163066553 NEPSRNFHTOCDED-BPUTZDHNSA-N 278.371 2.179 10 10 CECE C[C@@H]1CN[C@H]([C@H](O)c2ccc3c(c2)CCN3C)[C@H](C)C1 2163069000 OCAATBPPZVRXQF-HJSHSUPBSA-N 274.408 2.346 10 10 CECE CCN(CCCO)Cc1cc(Cl)c(F)cc1O 295291981 JGQRRDUCCCCZPW-UHFFFAOYSA-N 261.724 2.389 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H]3[C@H]4CCOC[C@H]43)ccc21 2163106793 LNGIJVBZQPWSRB-ABFRBSLYSA-N 272.392 2.351 10 10 CECE O[C@@H](CCn1cncn1)c1ccc(N2CCCC2)cc1 2163114466 WCVFOQNWAXHQMZ-HNNXBMFYSA-N 272.352 2.002 10 10 CECE Cc1nscc1[C@](C)(O)[C@H](N)c1ccc(N(C)C)cc1 2163124185 TYGRFYCPIRIEJF-CABCVRRESA-N 291.420 2.425 10 10 CECE 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294.370 2.412 10 10 CECE [N-]=[N+]=NC1CN(CC(=O)N2CCC[C@H]3CCCC[C@H]32)C1 1912144669 WUMCDGCLAVDSHI-DGCLKSJQSA-N 277.372 2.162 10 10 CECE C[C@H](C(=O)NCc1ccco1)N1CCC[C@H](N=[N+]=[N-])C1 1912189283 VFHMLGROVXTMSL-MNOVXSKESA-N 277.328 2.059 10 10 CECE CCc1conc1CNCc1cccc(OC)c1O 2136053927 PEBPFGBAIIWRGF-UHFFFAOYSA-N 262.309 2.241 10 10 CECE C[C@H](c1ccccc1O)N1CC[C@H]2CC[C@]21C(=O)O 2136403828 CKCHKJCRAUBCGC-UEKVPHQBSA-N 261.321 2.392 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3C(F)(F)F)ccc21 1916166441 YHRGGSLIJINVLJ-QWRGUYRKSA-N 285.269 2.040 10 10 CECE COc1cc(OC)c2c(c1)[C@@H](CC(=O)O)CCCN2C 212321416 JKOLOMVYCZXCLT-SNVBAGLBSA-N 279.336 2.492 10 10 CECE C[C@H](O)c1ccc2c(c1)CC(=O)N2Cc1ccc(N)cc1 213217349 QMHDTDIAXRPHEC-NSHDSACASA-N 282.343 2.411 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC[C@@H](C)[C@@H]1CN 226338220 MOLMOEKEEQMOFF-SUNKGSAMSA-N 264.369 2.218 10 10 CECE C[C@@H]1CCC[C@H]1C(=O)NCCOc1ccc(N)cc1 226492977 KQFLABKBVROTOR-BXUZGUMPSA-N 262.353 2.200 10 10 CECE 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287.451 2.486 10 10 CECE CNCc1ccc(N2CCCOCC2)c(Cl)c1 164020302 PCTSBIVQWINDTD-UHFFFAOYSA-N 254.761 2.286 10 10 CECE C[C@H](O)CN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1858586943 MSRFTAVALVTQMD-KIFNTFBYSA-N 297.376 2.408 10 10 CECE CN(C)CC(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1866208360 TWJXSELIJBAYOH-UHFFFAOYSA-N 283.375 2.360 10 10 CECE COc1ccc(N(C)C[C@@H]2CCCCN2)cc1OC 259018592 YLCPFXDUBFGYTD-LBPRGKRZSA-N 264.369 2.282 10 10 CECE CN1CC(=O)N(c2ccc(N)cc2)c2ccccc21 259202616 IYWJSRDVRUJPCU-UHFFFAOYSA-N 253.305 2.383 10 10 CECE CN(CC(N)=O)c1ccc(CNC(C)(C)C)c(Cl)c1 234261408 DXEFHVNHXXNLTB-UHFFFAOYSA-N 283.803 2.150 10 10 CECE CN(CCCCO)Cc1ccc(N2CCCC2)cc1 1235692981 XONMLHBCBCMJPG-UHFFFAOYSA-N 262.397 2.491 10 10 CECE OC[C@@]12CCC[C@@]1(CNCc1cccc(F)c1O)C2 2143018372 NJYHOSBNFLLLLJ-GJZGRUSLSA-N 265.328 2.174 10 10 CECE CO[C@@H]1CN(c2ccc(CO)cc2Cl)C[C@H]1F 1942648566 VHKZGFGATKHSKQ-ZYHUDNBSSA-N 259.708 2.005 10 10 CECE Oc1ccc(CN(C[C@H]2CCCNC2)C2CC2)c(O)c1 236589873 OUHJGKGPHYGCDJ-LBPRGKRZSA-N 276.380 2.062 10 10 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COC[C@H]1CC[C@H](C(=O)N(C)Cc2ccc(N)cc2)C1 2181804959 CYZJXMUIYRRUGE-KBPBESRZSA-N 276.380 2.290 10 10 CECE C[C@@H]1CCN(CCCc2ccc(N)cc2)[C@@H](C(=O)O)C1 2179665322 CNSHMOOWXUHABW-IUODEOHRSA-N 276.380 2.387 10 10 CECE CNCc1ccc(N(C)C[C@H]2C[C@@H](O)C2)c(Cl)c1 703885885 QIUWQNOUUBHBAK-TXEJJXNPSA-N 268.788 2.267 10 10 CECE COc1cc(N2CCC[C@H](N)[C@H]2C)cc(OC)c1OC 2181950650 LFNFFIXHRLGDTD-PWSUYJOCSA-N 280.368 2.028 10 10 CECE CCNCc1ccc(N2C[C@@H](CO)[C@@H](C)C2)cc1C 708160189 CMOSERXJHFQGRK-ZFWWWQNUSA-N 262.397 2.169 10 10 CECE C[C@H]1CN(Cc2cc(F)cc(F)c2O)CC[C@@H]1N(C)C 708433557 LUDXNDQTYNAUKB-HZMBPMFUSA-N 284.350 2.442 10 10 CECE CC(C)[C@@H](CNCc1cc(F)cc(F)c1O)N(C)C 708516111 DQENEFVRTNXAJA-CYBMUJFWSA-N 272.339 2.346 10 10 CECE CC(C)[C@]1(O)CCCN(CCOc2ccc(N)cc2)C1 710194288 YMZLVOGWRRKEJX-INIZCTEOSA-N 278.396 2.131 10 10 CECE C[C@H]1CCN(CC(=O)N(C)c2ccc(N)cc2)CCS1 379501606 DRKWYGIMUATUFX-LBPRGKRZSA-N 293.436 2.059 10 10 CECE C[C@H](CNCc1cccc(O)c1O)[C@H]1CCCCO1 711964271 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10 CECE CC(C)CNCc1ccc(N2CC(O)(C(F)F)C2)cc1 2172117713 KKEFSRQRTALNQA-UHFFFAOYSA-N 284.350 2.248 10 10 CECE Cc1ncncc1CNCc1ccc2c(c1)CCCO2 2178828822 SMTQBYBRGYEYSQ-UHFFFAOYSA-N 269.348 2.400 10 10 CECE COC1(OC)CC[C@H]1CN[C@H](C)c1ccc(O)cc1O 2173381824 LFKAFJBDDPPIFF-MNOVXSKESA-N 281.352 2.148 10 10 CECE C[C@@H](NC(=O)COc1ccc(N)cc1)C1CC2(CC2)C1 2184425824 ICDNXOPCPRXXJG-LLVKDONJSA-N 274.364 2.343 10 10 CECE O[C@H]1CCCc2cc(N3C[C@@H]4C[C@@H]3CC[C@@H]4O)ccc21 2184685421 XJXCEWOEPNXMKH-CSFVBSKPSA-N 273.376 2.406 10 10 CECE CN[C@@H]1CCCc2cc(N3CCC[C@@H](CO)C3)ccc21 2184686812 LCNQKBWGBWIULI-CXAGYDPISA-N 274.408 2.492 10 10 CECE CCN[C@@H]1CCc2cc(N(C)[C@H](C)C[S@@](C)=O)ccc21 2184710348 DMCUIJJBTLZHOA-CBLJQSSYSA-N 294.464 2.487 10 10 CECE CCCOc1cc(N2CCC[C@H](CNC)C2)ccc1N 2191573979 BSHKARIHGQQQDP-CYBMUJFWSA-N 277.412 2.493 10 10 CECE Cc1cc(N2CC[C@H]([C@H]3CCCO3)C2)ccc1CN 2096703761 YFSGOXKPFUXHJH-GOEBONIOSA-N 260.381 2.459 10 10 CECE C[C@H](O)c1ccc(N2CCN3CCCC[C@H]2C3)cc1 2097983484 UWNVKWPKKHGVRY-BBRMVZONSA-N 260.381 2.414 10 10 CECE CN(C[C@@H]1CCN1C)c1ccc(CN)c(C(F)(F)F)c1 2186456566 XRBIUWVZYRJRRD-LBPRGKRZSA-N 287.329 2.304 10 10 CECE C[C@@H]1SCCC[C@H]1N(C)c1ccc2c(c1)NC(=O)[C@H]2N 2197307312 ZGHZHXSXQQSIPP-FZZIBODNSA-N 291.420 2.359 10 10 CECE CN(c1ccc(CN)cc1F)[C@H]1CC[C@H](O)CC1 2042074235 KJCBIZWNLIWCRT-HAQNSBGRSA-N 252.333 2.024 10 10 CECE CNC[C@@H]1CCCCN1c1ccc(OC)c(F)c1 2044288310 DIZRGVNYGSYHBY-LBPRGKRZSA-N 252.333 2.413 10 10 CECE CC(C)Oc1ccc(N2C[C@@H](F)C[C@H]2CN)cc1 2044311211 OKHIYRNEOSLIKM-AAEUAGOBSA-N 252.333 2.349 10 10 CECE CNCc1ccc(N2CCC(C3(O)CC3)CC2)cc1C 2187042785 RYGPJKBWHZKJOB-UHFFFAOYSA-N 274.408 2.456 10 10 CECE CN1CCc2cc([C@@H](N)[C@](O)(C(F)F)C3CC3)ccc21 2197940297 ILSDNKCHOILPHI-HIFRSBDPSA-N 282.334 2.085 10 10 CECE Nc1ccc(C[C@H](O)[C@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 2045499971 XHQRSFBIQYSSHY-SYEHKZFSSA-N 253.292 2.464 10 10 CECE C[C@H](c1ccccc1O)N(C)Cc1cc(=O)c(O)co1 2192601525 ZBEKINQDSWKGAG-SNVBAGLBSA-N 275.304 2.244 10 10 CECE C[C@H](CCNC(=O)c1cccc(O)c1O)C(F)F 2047774096 HMNATLRYLWONEQ-SSDOTTSWSA-N 259.252 2.119 10 10 CECE Nc1ccc(OCCN2CC3(CC(F)C3)C2)cc1 2051885435 OBUZDHGMCAGDCO-UHFFFAOYSA-N 250.317 2.082 10 10 CECE C[C@@H](N)c1ccc(N2CC[S@](=O)C[C@H]2C)c(Cl)c1 2051917737 KVGCGDVBAJVEBP-MHNGPXOMSA-N 286.828 2.317 10 10 CECE CNCc1cc(F)c(N(C)CC23CC(CO2)C3)c(F)c1 2193115209 VXKAGAFXMCBZAX-UHFFFAOYSA-N 282.334 2.299 10 10 CECE C[C@@H]1CC[C@@H](CNCc2ccc(O)c(O)c2)OC1 2053735988 OLXKIVWDTMZKPC-PWSUYJOCSA-N 251.326 2.003 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H]3[C@@H]2CO)c2ccccc12 2198997544 SVSBYMJOFQDWKF-MJEQTWJJSA-N 268.360 2.116 10 10 CECE N[C@@H]1CCC2(CCC2)N(c2ccc3c(c2)OCCO3)C1 2193434597 HRWGVIMEXGBAAR-GFCCVEGCSA-N 274.364 2.308 10 10 CECE CCNCc1ccc(N2CC[C@@H]2[C@H](C)O)c(Cl)c1 2061817889 MHIUTWBUKVTAOK-GXFFZTMASA-N 268.788 2.409 10 10 CECE CC1(C)CN(CCN2CCC[C@@H](N=[N+]=[N-])CC2)C(=O)O1 2193752238 GAILMZMNXWSXBS-LLVKDONJSA-N 281.360 2.382 10 10 CECE C[C@H](NCc1noc(C(F)F)n1)c1cc(O)ccc1O 2199443953 YZVLLHOPAOBJBN-LURJTMIESA-N 285.250 2.269 10 10 CECE CO[C@H]1CN([C@H](C)c2ccc(C)cc2O)CC[C@H]1OC 2199566930 MYQSZOVPCISSMN-WQVCFCJDSA-N 279.380 2.497 10 10 CECE O=C(c1cc(O)c(O)c(O)c1)N1CCCC[C@@H]1C1CC1 2188927073 CFMKUCYWLXCXPM-LLVKDONJSA-N 277.320 2.208 10 10 CECE CC[C@]1(C)C[C@](CN)(N(C)c2ccc(OC)cc2)CO1 2189433493 DVBGYNOSTSDRGF-HZPDHXFCSA-N 278.396 2.418 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@H]1CC[C@H]2C[C@@H]1C2 2189643357 RZROBWZEGOYGOD-ZOWXZIJZSA-N 274.364 2.295 10 10 CECE COc1ccc([C@H](C)NC[C@@]23CCOC[C@H]2C3)c(O)c1 2194437384 QIDWNVBJXIAVMU-OZVIIMIRSA-N 277.364 2.478 10 10 CECE C[C@@H]1SCCC[C@@H]1NC(=O)Cc1ccc(N)cc1 2076691869 LCONUHTVRRNASG-GWCFXTLKSA-N 264.394 2.212 10 10 CECE COC[C@](C)(CN1CCC[C@H](N=[N+]=[N-])CC1)OC 2077549253 ULCJAPGKAPREKF-RYUDHWBXSA-N 256.350 2.203 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)C1CC2(C1)CC(F)(F)C2 2102631607 QUPWWRSZBYSKNS-QMMMGPOBSA-N 274.271 2.165 10 10 CECE COc1ccc(O)c(CNCC[C@@H]2CO[C@@H](C)C2)c1 2103183770 PYUIKIKCBFPJCJ-RYUDHWBXSA-N 265.353 2.306 10 10 CECE COc1cccc(O)c1CN1C[C@H](C)OCC[C@H]1C 2104431555 FNGIBVSJWKTJSX-NEPJUHHUSA-N 265.353 2.400 10 10 CECE O=C(NC12CCC(F)(CC1)C2)c1ccc(O)c(O)c1 2104457273 YREBIUFYQNHYMS-UHFFFAOYSA-N 265.284 2.252 10 10 CECE CN(C)c1ccc2c(c1)OCCN2CC1(F)CC1 2085465175 UPLVACSIXLBECM-UHFFFAOYSA-N 250.317 2.454 10 10 CECE CN(c1ccc2c(c1)OCCCO2)[C@@H](CN)C1CC1 2106325833 MNDMVUHISYLSDC-ZDUSSCGKSA-N 262.353 2.021 10 10 CECE COc1ccc(N2C[C@H](CN)CC[C@H]2C)cc1OC 2106333615 GRJYODPCPOPVAR-NEPJUHHUSA-N 264.369 2.267 10 10 CECE COc1ccc(N(CC2CCC2)C2CNC2)c(F)c1 2106350536 JZNDZXAGPARQAR-UHFFFAOYSA-N 264.344 2.413 10 10 CECE C[C@@H]1CNCC[C@@H]1N(C)c1ccc2c(c1)COCC2 2106600406 OWUBJSNLOUKQNC-WBMJQRKESA-N 260.381 2.194 10 10 CECE CCN1CCc2cc([C@@H](O)C3(O)CCCC3)ccc21 2106796685 SZIVSACSAQTGFW-OAHLLOKOSA-N 261.365 2.408 10 10 CECE CN[C@@H](c1ccc(N2CCCC2)cc1)c1cn[nH]c1 2106829632 YOQUCCVAUKGJLQ-HNNXBMFYSA-N 256.353 2.319 10 10 CECE C[C@]1([C@H](O)c2ccc(N3CCCC3)cc2)CCCN1 2106830602 IFGQKLXOHFCMQQ-HZPDHXFCSA-N 260.381 2.462 10 10 CECE CN1CC[C@H]([C@@H](N)c2ccc(N3CCCC3)cc2)C1 2106827181 AFLVTBUFBGUXNK-HOCLYGCPSA-N 259.397 2.238 10 10 CECE C[C@H]1CCNC[C@H]1N(C)c1ccc2c(c1)CCCO2 2107349478 KLEGPSWEPJDPNI-SWLSCSKDSA-N 260.381 2.446 10 10 CECE C[C@H]1C[C@H]1N(CCO)c1ccc(CNC2CC2)cc1 2110794946 PZOMYNUIDNMLKF-BLLLJJGKSA-N 260.381 2.146 10 10 CECE C[C@@]12CCC[C@@H]1C(=O)N2CCOc1ccc(N)cc1 2090640930 DLLCBZXDMHPZHH-UKRRQHHQSA-N 260.337 2.049 10 10 CECE CNCc1ccc(N2C[C@@H]3CCC[C@H](C2)C3O)cc1 2111488421 RLXCCBQGAVYBLQ-MZBDJJRSSA-N 260.381 2.003 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H]2CCC[C@H](C1)C2O 2111467397 YTEUETYARJSIIQ-MZBDJJRSSA-N 261.365 2.085 10 10 CECE CN[C@@H](C1CC1)[C@@H](O)c1ccc2c(c1)CCCN2C 2091617634 CEPJZYKJVGAMLY-HOTGVXAUSA-N 260.381 2.100 10 10 CECE CO[C@@H]1CN(c2ccc([C@@H](C)O)cc2F)CC12CC2 2093320530 DXDLTVBIQXDEEA-QMTHXVAHSA-N 265.328 2.494 10 10 CECE Cc1ccc(OCc2cccc3nccn23)c(N)n1 2095389167 UUHSGGSSWOBBBO-UHFFFAOYSA-N 254.293 2.199 10 10 CECE CC(C)(CN1CCC[C@H](N=[N+]=[N-])CC1)CS(C)(=O)=O 2099335784 CSJASOXUHJQTPA-NSHDSACASA-N 288.417 2.222 10 10 CECE CC(C)(CN1CCC[C@@H](N=[N+]=[N-])CC1)CS(C)(=O)=O 2099335783 CSJASOXUHJQTPA-LLVKDONJSA-N 288.417 2.222 10 10 CECE CO[C@H]1CCN(c2ccc(CO)c(Cl)c2)C[C@]1(C)OC 2201534695 PEFGBHSFWYYMDJ-GJZGRUSLSA-N 299.798 2.463 10 10 CECE O=C1Nc2cc(N3CC[C@H]4CC[C@H]3C4)ccc2[C@@H]1O 2112505725 DWIFHWYTOQNEBI-BFVZDQMLSA-N 258.321 2.051 10 10 CECE CC(C)[C@H]1CN(C)CCN1c1ccc(CO)cc1F 2114159317 KBCCZCVFYUGHMX-OAHLLOKOSA-N 266.360 2.094 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2ccno2)c([N+](=O)[O-])c1 2202509328 NJPHVPDWXJGHHG-VIFPVBQESA-N 277.280 2.273 10 10 CECE CC[C@H]1CN(C)CCCN1c1ccc(CO)c(OC)c1 2204543834 SUOBJTCCMQQYAG-AWEZNQCLSA-N 278.396 2.108 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2COC3)cc1OC 2204554604 NVCUVNAYHQCUMA-GJZGRUSLSA-N 276.380 2.172 10 10 CECE CCO[C@H]1C[C@@H](OC)CN(Cc2ccc(F)cc2O)C1 2204652907 IEWGZVYKXXWUBF-KGLIPLIRSA-N 283.343 2.157 10 10 CECE Cc1cccc(CNC(=O)CC[C@H]2CCCCN2)c1O 2204621182 FCHJGJUWYXLQIF-CQSZACIVSA-N 276.380 2.239 10 10 CECE CC1(C)CN(CCF)CCN1Cc1ccc(F)cc1O 2204658499 KJARBQUPOVAHGQ-UHFFFAOYSA-N 284.350 2.397 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@H]2CC[C@@H](N)C[C@H]2C1 2206179666 PDFWKIUWRKGQCI-MROQNXINSA-N 276.380 2.218 10 10 CECE Cc1cc(N2CC[C@@H]3[C@H](O)C[C@H]3C2)ccc1[C@@H](C)N 2269652062 RRNQWBZXAUUBSA-GUYJKWIASA-N 260.381 2.222 10 10 CECE CN[C@H](C)c1ccc(N(CCO)CC2CC2)cc1C 2269652002 RFUAZIZQKUOHTD-CYBMUJFWSA-N 262.397 2.484 10 10 CECE COCC[C@H](COC)NCc1cnc(SC)s1 2208605843 WJBDLRCSBGJTKB-SECBINFHSA-N 276.427 2.006 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cccc(F)c1N 2271352826 ALGPJEWWZITFEA-NXEZZACHSA-N 263.276 2.369 10 10 CECE COc1ccc(N2CC[C@@H](CO)[C@@H]2C)c(F)c1F 2219766237 GGHWOYAJNCLSQQ-IUCAKERBSA-N 257.280 2.181 10 10 CECE C[C@@H](N=c1nc(C(F)F)[nH]n1C)c1ccccc1O 2230565770 DHLPALPJEOSLRU-SSDOTTSWSA-N 268.267 2.053 10 10 CECE C[C@H](CO)CC1CN(c2ccc(CN)c(Cl)c2)C1 2222868695 SZBGBLKQTFSKNT-JTQLQIEISA-N 268.788 2.253 10 10 CECE COc1cccc(S(=O)(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])c1 2234169689 WRIIFJABJAXVIL-NEPJUHHUSA-N 296.352 2.205 10 10 CECE CC(C)C[C@@H](NC(=O)COc1ccc(N)cc1)C(F)F 2234648076 KYVMMNBUFDURLN-GFCCVEGCSA-N 286.322 2.444 10 10 CECE COc1ccc(N2CC[C@H](O)C(F)(F)CC2)cc1OC 2235127562 UCLGNMGTIDULID-ZDUSSCGKSA-N 287.306 2.300 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1ccc(F)c(O)c1 2225797140 DLZCQSLXIBXUQM-NXEZZACHSA-N 264.260 2.493 10 10 CECE CNCc1cc(OC)ccc1N1CC(COC(C)C)C1 2235965363 ZQEVMRNMKMFXOR-UHFFFAOYSA-N 278.396 2.276 10 10 CECE CCCN(c1ccc(OC)cc1C[C@@H](C)N)C1COC1 2235968580 UAGJVTAOQMLNQB-GFCCVEGCSA-N 278.396 2.200 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@H](OC)C2(C)C)c(CN)c1 2235960324 UVIXMPVQIXXOGP-CABCVRRESA-N 278.396 2.404 10 10 CECE C[C@@H]1CC[C@H]1CN(C)c1cc2c(cc1N)OCC(=O)N2 2236149300 FZXMPDHYDAHTCI-ZJUUUORDSA-N 275.352 2.082 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@]23COC[C@H](C2)C3)c1 2236367589 YCGZZTBUJFZVDC-HSMVNMDESA-N 277.364 2.478 10 10 CECE Cc1ocnc1CN1CCN(c2ccc(N)cc2)C1=O 2236658819 NAJHNDXSAPTQRK-UHFFFAOYSA-N 272.308 2.007 10 10 CECE O[C@H]1CCN(c2ccc(OCC(F)F)cc2)C[C@@H]1F 2226741789 XTQXYRWEYBBPSP-RYUDHWBXSA-N 275.270 2.240 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CCN3C)C[C@@H]1CO 2226813823 KSQJPBOFDDLHBS-TZMCWYRMSA-N 260.381 2.134 10 10 CECE COc1ccc(N2CC[C@@H](O)CC23CC3)cc1OC 2226805372 JJNITWSYBCVVPQ-GFCCVEGCSA-N 263.337 2.198 10 10 CECE COc1ccc(N2CCCC[C@@H](CO)C2)c(C=O)c1 2227691446 AGJQRCAKAXRJBQ-GFCCVEGCSA-N 263.337 2.107 10 10 CECE CNCc1cc(OC)ccc1N1C[C@H](C)O[C@H](C)C1 2227676393 TYWDWEPFBHXOMA-TXEJJXNPSA-N 264.369 2.028 10 10 CECE CN1CCCc2cc(CNC[C@]3(F)CCOC3)ccc21 2238263627 RPXIMWAURGFAOK-MRXNPFEDSA-N 278.371 2.287 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)[C@H]2C[C@@H]3C[C@@H]3C2)cc1 2238586251 PLKXSWOCTLXBGN-YALNPMBYSA-N 273.424 2.483 10 10 CECE Cc1cc(N2CCC23CN(C)C3)ccc1CNC(C)C 2238612269 YGFNGZKZYAUOJH-UHFFFAOYSA-N 273.424 2.387 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@H]1CC[C@H]1C(=O)O 2228926838 GTHZRFSFXLVDEA-NQBHXWOUSA-N 263.337 2.496 10 10 CECE CN(C)c1ccc([C@]2(O)CCCCC23CNC3)cc1 2228945616 NOVQXQKCAGFKHO-MRXNPFEDSA-N 260.381 2.104 10 10 CECE C[C@H]1C[C@@](Oc2ccc(N(C)C)cc2)(C(=O)O)CS1 2229371392 YUGHAFQPQICHKF-HZMBPMFUSA-N 281.377 2.480 10 10 CECE CC[C@H](C)NCc1ccc(N2CC[C@@H](O)C2)cc1OC 2240019969 HANDZFPRCFMSLH-SWLSCSKDSA-N 278.396 2.154 10 10 CECE Cc1cc(CNC2CCC2)ccc1OCCOCCO 2240245155 RMMOHNAURJPSKC-UHFFFAOYSA-N 279.380 2.025 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCN(C)C(=O)C1(C)C 2240830620 OUCZBCTWCUZORL-GFCCVEGCSA-N 275.396 2.072 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC(N2CCSCC2)C1 2240838330 SWZFYTUDNKWYJT-CYBMUJFWSA-N 291.464 2.252 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1[C@H]2CC[C@H]1[C@H](F)[C@@H](O)C2 2240840760 XTAHULDBNXWPSY-VEEUSGEASA-N 279.355 2.488 10 10 CECE Oc1cccc(Br)c1CNC12COCC(C1)C2 2250968479 NXTGYRXLBFBXDE-UHFFFAOYSA-N 298.180 2.423 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@H](C)CO)cc1C 2257464786 FZFSNQBVTSHWRL-CHWSQXEVSA-N 250.386 2.483 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@H](C2)[C@H]3O)cc1Cl 2270697683 BJMLTBFPKBBZNM-ICCCGROCSA-N 283.755 2.174 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)c1cscc1OC 2271425662 PULBTTXLBJYPBE-ZIAGYGMSSA-N 279.361 2.456 10 10 CECE FC(F)Oc1ccc(N2[C@H]3CC[C@H]2CNC3)cc1 2263918874 PJJJMFIYZHXITM-QWRGUYRKSA-N 254.280 2.229 10 10 CECE COc1ccc(N2CCC=C[C@H]2CO)c(OC)c1C 2278059982 DKDBBZZOVAEMID-LBPRGKRZSA-N 263.337 2.139 10 10 CECE COc1ccc(N2CCS[C@@H](CO)C2)c2c1CCC2 2269176821 BVRFODYDIXZBAR-LLVKDONJSA-N 279.405 2.098 10 10 CECE COc1ccc(N2CC[C@@H](N)[C@H](C)C2)c2c1CCC2 2269168261 NELHJLDHJAXZAH-BXUZGUMPSA-N 260.381 2.357 10 10 CECE COC[C@]1(C)C[C@H]1C(=O)N[C@H](C)c1ccccc1O 2269282985 ZUKVJTNAXQXSKE-GMXABZIVSA-N 263.337 2.242 10 10 CECE Cc1cc(N2C[C@H]3C[C@H]2CC[C@@H]3O)ccc1[C@H](C)O 2269680718 DGSWUAGULGRBLW-DMEJVMROSA-N 261.365 2.398 10 10 CECE CC(C)C[C@]1(C)NC(=O)N(c2ccc(N)cc2)C1=O 2269929197 FJRMVLALAFQNPU-AWEZNQCLSA-N 261.325 2.130 10 10 CECE COc1ccc(C(=O)N2CC(N=[N+]=[N-])C2)c(Cl)c1OC 2283451184 QNROHAOWLZKMFJ-UHFFFAOYSA-N 296.714 2.492 10 10 CECE COc1cc(C)c(N2CC[C@@](C)(O)[C@@](C)(O)C2)c(C)c1 2285085688 UVDIAPKKRQHPFK-CVEARBPZSA-N 279.380 2.024 10 10 CECE Cc1cc(N2C[C@H](C(N)=O)CC[C@H]2C)ccc1[C@@H](C)O 2285152156 XIFWMPQYMAFIKC-JHJVBQTASA-N 276.380 2.139 10 10 CECE CC[C@@]1(CO)COCCN1c1ccc([C@@H](C)O)c(C)c1 2285164634 NKTCOEOTJFKDGX-CZUORRHYSA-N 279.380 2.026 10 10 CECE CC(=O)Nc1ccc(C=C2SC(=S)N(C)C2=O)cc1 2296453262 DTJLVQSTOOKKSC-UHFFFAOYSA-N 292.385 2.476 10 10 CECE CN(C(=O)c1cc(O)c(O)c(O)c1)C1CCC=CCC1 2285745016 IFNALSSOUCWAFS-UHFFFAOYSA-N 277.320 2.374 10 10 CECE N[C@@H]1C[C@@H]2CC[C@H](C1)[C@H]2NCc1ccc2c(c1)CCO2 2285853412 HWRXASISBPFXAG-IUGPZWINSA-N 272.392 2.227 10 10 CECE CON(CC1CCC1)[C@H](C)C(=O)Nc1ccc(N)cc1 2288892846 PTJFJYUXWIRYRT-LLVKDONJSA-N 277.368 2.259 10 10 CECE N[C@@H]1C[C@@H]2C[C@H]1CN(Cc1ccc(Cl)cc1O)C2 2312378571 JNBGKWGTQURRKG-XHVZSJERSA-N 266.772 2.215 10 10 CECE C[C@H](N[C@H]1C[C@@H]2CO[C@H]1C2)c1ccc(F)cc1O 2313117249 NVCWYRQOYJIVMC-COPCRZHJSA-N 251.301 2.359 10 10 CECE C[C@H](c1ccccc1O)N1[C@H]2CC[C@H](C2)[C@@H]1C(=O)O 2332932414 YTRIZJXCORAZSQ-NJBDSQKTSA-N 261.321 2.391 10 10 CECE C[C@@]1(O)C[C@@H]2C[C@H]1C[C@H]2NCc1ccc(F)cc1O 2333192775 PXCBKBOIPSTFKD-HTTKSJEASA-N 265.328 2.170 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)cc21 2333684744 FTZGWNURPOAXDS-ZLKJLUDKSA-N 259.349 2.316 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1c1ccc2c(c1)CC[C@@H]2N 2336759756 TZLMJHMIZIKKEU-HRCADAONSA-N 260.381 2.372 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1CCCc1ccc(N)cc1 2336762797 VPGMLUMTRRZMQO-JKSUJKDBSA-N 262.397 2.437 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H]2C[C@H]1C[C@@H]2N(C)C 2341128232 SRUCEVMUJGCEHC-XFMPKHEZSA-N 260.381 2.478 10 10 CECE Nc1ccc(CNCc2cnc3c(c2)CCC3)cc1 2342210547 PNVWVCYZZXDIFE-UHFFFAOYSA-N 253.349 2.442 10 10 CECE CC[C@H](c1ccccc1O)N1CCOC[C@H](OC)C1 2351627820 JFTWSIYDFABFCU-TZMCWYRMSA-N 265.353 2.191 10 10 CECE CN[C@@H](c1ccccc1O)c1ncc2ccccn12 2352696288 HLBSBYXCSIDUFT-AWEZNQCLSA-N 253.305 2.349 10 10 CECE C[C@H](NC[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)c1cc(O)ccc1O 2353918740 UVKZPOMNMUHHTR-SSLSOBBVSA-N 275.348 2.172 10 10 CECE CN(C)c1ccc([C@H](N)[C@]2(O)C[C@@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1 2355316577 QVSAUTKCNBJCRJ-CZVOBTNASA-N 272.392 2.159 10 10 CECE NC[C@@H]1C[C@@H]2CC[C@H]1N2c1ccc2c(c1)OCCCO2 2355418864 DMPXKBAWAVNOIT-SGMGOOAPSA-N 274.364 2.164 10 10 CECE CN1CCCc2cc(CN[C@H]3[C@@H]4CCCO[C@@H]43)ccc21 2355544957 TYNFEDFKUBSPJU-XIRDDKMYSA-N 272.392 2.336 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3CC[C@H](O)[C@H]2C3)cc1O 2355755979 UTLASSPCHGZKJN-BVIHXZOGSA-N 277.364 2.185 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3C[C@@H]4C[C@@H]4CO3)ccc21 2355828884 VFHDQXZPSHQOCQ-ABFRBSLYSA-N 272.392 2.494 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2C[C@@H]3C[C@@H]3CO2)cc1O 2355834360 WKHQOILWJPISBX-CIQGVGRVSA-N 277.364 2.307 10 10 CECE CCOc1ccc(O)c(CN(CC)CC(=O)NC(C)C)c1 179587552 WCGGTUNCTJHVOT-UHFFFAOYSA-N 294.395 2.137 10 10 CECE CN(Cc1cnns1)c1ccc(/C=C/C(=O)O)cc1F 400012428 ICVDVIWDCXSLPQ-HWKANZROSA-N 293.323 2.411 10 10 CECE C[C@@H](N)c1ccc(N2[C@@H]3CC[C@@H]2CC(O)C3)c(F)c1 111388964 GCGUHYYFFXZYRX-YUSALJHKSA-N 264.344 2.338 10 10 CECE 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283.755 2.206 10 10 CECE Cc1ccc(CN[C@H]2CCN3CCC[C@H]2C3)c(O)c1 2139770637 LMGUVEGVTRYCHZ-GJZGRUSLSA-N 260.381 2.275 10 10 CECE COc1cc2c(c(O)c1OC)C(=O)c1ccccc1C2=O 14775074 KHFQPAMXJRRXJD-UHFFFAOYSA-N 284.267 2.185 10 10 CECE CCCn1ncnc1CN1CCc2cc([C@@H](C)N)ccc21 162122092 AUGSNPKOUCPMBT-GFCCVEGCSA-N 285.395 2.271 10 10 CECE CCn1ncnc1CN1CCc2cc([C@H](C)NC)ccc21 162129588 UBNTUGZRDSDIMA-LBPRGKRZSA-N 285.395 2.141 10 10 CECE CNC(=O)c1ccc(Nc2ccc(N)cc2)c([N+](=O)[O-])c1 158093443 RICLIYOJTDIFFR-UHFFFAOYSA-N 286.291 2.280 10 10 CECE Nc1ccc(NC(=O)C[C@H]2C(=O)Nc3ccccc32)cc1 160434588 DMWVGNGEGOGHOC-CYBMUJFWSA-N 281.315 2.333 10 10 CECE C[C@H](NCc1cccc(F)c1O)c1nnc2ccccn12 164961916 JAHHYJZAFFXLEU-JTQLQIEISA-N 286.310 2.425 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC([C@H](C)C(=O)O)C2)c1 166103155 AJFTVEBZVCJULS-WDEREUQCSA-N 263.337 2.414 10 10 CECE Cc1ccc(CC(=O)NCc2ccc(O)c(O)c2)s1 159060383 DTLLLNTWCHCZNS-UHFFFAOYSA-N 277.345 2.327 10 10 CECE CN(c1ccc2c(c1)OCCCO2)[C@@H]1CCC[C@H]1N 258849179 DZZVQXWPBKCSNU-CHWSQXEVSA-N 262.353 2.164 10 10 CECE CC(C)NCCN(C)c1ccc2c(c1)OCCCO2 258923065 OQJSGARGXMMZQY-UHFFFAOYSA-N 264.369 2.282 10 10 CECE COc1cc(C)c(N(C)CC[C@H](C)CN)cc1OC 258879271 KFALDYNBHKNFKN-NSHDSACASA-N 266.385 2.433 10 10 CECE C[C@@H]1CCCCN1[C@H](C)C(=O)Nc1ccc(N)cc1 252191958 RTHLAOKDNXFCTN-VXGBXAGGSA-N 261.369 2.470 10 10 CECE CCOc1cccc(CNC[C@@H]2CCO[C@@H]2C)c1O 233789237 NKBZTDFGSDNDMD-NEPJUHHUSA-N 265.353 2.306 10 10 CECE COCCO[C@H]1CCCN(Cc2cccc(F)c2O)C1 802652654 PZOGVOIJOVHVNX-ZDUSSCGKSA-N 283.343 2.159 10 10 CECE C[C@]1(CNCc2cc3c(cc2O)OCO3)CCCCO1 922815706 FERVFDHAMOOYRU-OAHLLOKOSA-N 279.336 2.170 10 10 CECE CCN[C@@H](CSc1nccs1)c1ccn(C)n1 1943201006 VUULLKLAOUYPAC-JTQLQIEISA-N 268.411 2.320 10 10 CECE CN1CCc2cc([C@H](C[C@@H]3CC34CC4)NN)ccc21 2142755474 PURPVIAOOFEKDM-KGLIPLIRSA-N 257.381 2.374 10 10 CECE COC[C@@]1(F)CCN(Cc2cc(F)ccc2O)C1 1875797865 WLCQFDZGDKNYNY-CYBMUJFWSA-N 257.280 2.092 10 10 CECE Oc1ccc2ccccc2c1CN[C@@H]1COC[C@H]1F 1876140234 OKZFQMYYMNZYMA-ZIAGYGMSSA-N 261.296 2.372 10 10 CECE C[C@H]1C[C@@H]1CCC(=O)NCCOc1ccc(N)cc1 1876947818 ONSROBWQDQQXOH-RYUDHWBXSA-N 262.353 2.200 10 10 CECE Cc1nc(O)cc(N(C)[C@@H](C)c2ccccc2O)n1 1877528615 HKGWQZMKHTYITC-VIFPVBQESA-N 259.309 2.394 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(N)=O)[C@H]1CCCC2(CC2)C1 1879776438 OYPPXIZAIDNYGZ-WDEREUQCSA-N 265.361 2.101 10 10 CECE CCOc1cccc(CNC[C@]23C[C@H](CO2)C3)c1O 1879827852 SETIFSUSHKBXFM-WGRBQBNCSA-N 263.337 2.060 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](C)[C@H]2CO)c(F)c1 1880929927 XKACUYOBUWPEGN-VYUIOLGVSA-N 270.323 2.192 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@@H]2C(C(=O)O)[C@H]2C1 2143622891 KHIBJQXYMLGTNH-SWHYSGLUSA-N 274.364 2.076 10 10 CECE C[C@@H]1CCN(Cc2ccc(Cl)cc2O)[C@H]1C(=O)O 1963117528 XAIFKMYTCTZUEQ-PRHODGIISA-N 269.728 2.341 10 10 CECE CN1CC[C@@H](NCc2ccc3c(c2)CCO3)C(C)(C)C1 1964059828 UDWVACSHCKSURY-MRXNPFEDSA-N 274.408 2.441 10 10 CECE C[C@@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)N(C)C(=O)OC(C)(C)C 1885563216 QUOFWWSHCGVSQD-UWVGGRQHSA-N 297.359 2.153 10 10 CECE COc1ccc(CNc2cccnc2OC)c(O)c1 40906433 ZNOWEAYNTHFACR-UHFFFAOYSA-N 260.293 2.417 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC(C)(C)[C@@H]1C(=O)O 2144823968 YSPZBMCEZAWNMQ-ZANVPECISA-N 279.336 2.344 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)c1ccc(F)cn1 2148160684 DOISRBBHNPZIMR-CABCVRRESA-N 276.311 2.311 10 10 CECE C[C@@H](NCCN1CCCOC1=O)c1ccc(F)cc1O 1969510919 OTSZXAROCLZFNB-SNVBAGLBSA-N 282.315 2.024 10 10 CECE CCN1CC[C@H](CN[C@H](C)c2ccc(O)cc2O)C1 252438653 FBUBXIUVRGMDRL-VXGBXAGGSA-N 264.369 2.090 10 10 CECE COC1(OC)CC[C@H]1CNCc1cc(F)cc(F)c1O 1972388329 SVIUPPBCXYQPRI-JTQLQIEISA-N 287.306 2.159 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@@H]2CC[C@]21CN 2145598989 KLRJTRLPZUWMQQ-HSMVNMDESA-N 276.380 2.362 10 10 CECE COc1cccc(CN[C@H]2CC[C@]23CCCO3)c1O 1974319416 GJRHMJNWGJFQEF-DZGCQCFKSA-N 263.337 2.202 10 10 CECE CN1C[C@H](CN)C[C@H]1c1ccc(N2CCCC2)c(F)c1 258652855 QGWOEGTWJNONBC-LRDDRELGSA-N 277.387 2.377 10 10 CECE COc1cc2c(cc1OC)N(C[C@@H]1CCCN1C)CC2 2146268460 TUVYDUQLAGECLF-ZDUSSCGKSA-N 276.380 2.161 10 10 CECE CC(C)(C)NCc1cc(F)c(N2CC[C@H]2CO)c(F)c1 2148958807 RHIABWBSGYZAQX-NSHDSACASA-N 284.350 2.424 10 10 CECE CCN(C[C@@H]1C[C@@H]2COCC[C@@H]2O1)c1ccc(N)cc1 2148975153 YQCQDIXEJQSEBC-KCXAZCMYSA-N 276.380 2.289 10 10 CECE CCN1CCO[C@@H](CN[C@@H](C)c2ccc(C)cc2O)C1 168866059 MIFVOGPGKNJFIS-KBPBESRZSA-N 278.396 2.072 10 10 CECE [N-]=[N+]=NC1CN(C[C@H](O)c2cccc(Br)c2)C1 2003671105 MYDBZPLZVWVEIK-NSHDSACASA-N 297.156 2.477 10 10 CECE C[C@@H](N)c1ccc(N2[C@H](CO)C[C@H]3OCC[C@@H]32)c(Cl)c1 2146690665 CCHFPSBQTITZSK-PBUVFVDJSA-N 296.798 2.088 10 10 CECE CCCN[C@@H](C1CC1)[C@H](O)c1ccc2c(c1)CCN2C 2147882080 SXPICRKVYLRNQN-DLBZAZTESA-N 274.408 2.491 10 10 CECE CN(C)c1ccc([C@H](NC2CCCCC2)C(N)=O)cc1 37969695 DODGIDKKNHOBSP-HNNXBMFYSA-N 275.396 2.201 10 10 CECE N[C@](CO)(CSc1nccs1)C1CCCC1 1995495496 YKRXRSKCHBHZSO-LLVKDONJSA-N 258.412 2.115 10 10 CECE CN1CCc2cc(CN3[C@H]4CC[C@@H]3C[C@H](N)C4)ccc21 2151257928 OSDDMINWCASAEC-MUJYYYPQSA-N 271.408 2.133 10 10 CECE C[C@@H]1C[C@H](Sc2nccs2)C[C@@](N)(C(=O)O)C1 2006678442 UAZPQKIFWYWGGK-VHSKPIJISA-N 272.395 2.206 10 10 CECE CCOc1cccc(CNCC(=O)OC(C)(C)C)c1O 164127655 BIQMJSOOZSFFBL-UHFFFAOYSA-N 281.352 2.222 10 10 CECE O=C(N[C@@H]1C(F)(F)C12CCCC2)c1cccc(O)c1O 2153778792 CWBJXKFAYGQHQH-LBPRGKRZSA-N 283.274 2.406 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]2[C@@H](C)O)c(Cl)c1 2011149140 NCYDPIJVIWVKIL-LNLATYFQSA-N 255.745 2.353 10 10 CECE CCCN(CCN(C)C)Cc1cc(C(C)=O)ccc1O 45699873 GMPYBPSKDXTXJC-UHFFFAOYSA-N 278.396 2.368 10 10 CECE Nc1ccc(COc2nc(Cl)nnc2Cl)cc1 2012666340 JTYVJUIDKSTTHU-UHFFFAOYSA-N 271.107 2.340 10 10 CECE CNCc1ccc(OCCc2cncc(C)n2)c(C)c1 2155010527 INICPGOXRKLCMC-UHFFFAOYSA-N 271.364 2.434 10 10 CECE CN([C@@H]1CCC[C@H]2C[C@@H]21)S(=O)(=O)Cc1ccc(N)cc1 2155402932 RUJQOUGXJREDPG-AEGPPILISA-N 294.420 2.219 10 10 CECE C[C@@H](NCCP(C)(C)=O)c1ccc(O)cc1O 2018300736 KREBGIQBJPLNKS-SECBINFHSA-N 257.270 2.371 10 10 CECE CCNC[C@]1(CN(C)c2ccc(OC)cc2)CCOC1 51253187 RRSWTPPGTLTDSD-INIZCTEOSA-N 278.396 2.148 10 10 CECE C[C@@H]1C[C@H](Nc2c(N)cccc2Cl)CCS1(=O)=O 2027439698 FRHLAUDNVRTHGE-RKDXNWHRSA-N 288.800 2.300 10 10 CECE COCCCN1C(=O)C(=Cc2ccccn2)SC1=S 2039911093 BGPYFQFAECFEOW-UHFFFAOYSA-N 294.401 2.319 10 10 CECE C[C@@H]1CCN(Cc2ccc(Cl)cc2O)C[C@H]1CN 2029655287 DFWBYPFPAXYDCT-ZYHUDNBSSA-N 268.788 2.462 10 10 CECE CSCC[C@@H](O)CCNCc1cc(C)ccc1O 2029923525 IOVUPRHFUCXNJM-ZDUSSCGKSA-N 269.410 2.294 10 10 CECE Cc1ccc([C@H](C)NCCc2nncs2)c(O)c1 2033511179 INWCKHLTKYWABJ-JTQLQIEISA-N 263.366 2.445 10 10 CECE CC[C@@H](C)C(=O)Nc1ccnn1-c1ccc(N)cc1 61628805 CKEFMQSRCIOCMX-SNVBAGLBSA-N 258.325 2.439 10 10 CECE CN(Cc1ccc(N)cc1)Cc1nccnc1Cl 2034090971 CPLDJUXPEULCCJ-UHFFFAOYSA-N 262.744 2.344 10 10 CECE COc1ccc(N(C)C[C@](C)(N)C(F)(F)F)cc1 2035337105 ONBDIHHDWRSPFH-NSHDSACASA-N 262.275 2.411 10 10 CECE CC1(C)CC(S(=O)(=O)NCc2ccccc2O)C1 2036296270 OCVCHHRIZILEPA-UHFFFAOYSA-N 269.366 2.000 10 10 CECE CN[C@H](c1ccccc1O)[C@](C)(O)c1cncs1 2038230640 VJSPGONMUBKQBJ-CHWSQXEVSA-N 264.350 2.017 10 10 CECE CC[C@H](C)N(C)CCN[C@H](C)c1ccc(O)cc1O 300665339 BHZQUGASPUMOIP-NWDGAFQWSA-N 266.385 2.479 10 10 CECE CC1(C)C[C@@H](CNCc2cccc(O)c2O)CO1 2041453063 MZVTYEXEDMYPNO-JTQLQIEISA-N 251.326 2.003 10 10 CECE Cc1ccc(O)c(CN[C@H]2C[C@H]3CC[C@H]2N(C)C3)c1 401522831 CVFAAZSVWASGHD-VHDGCEQUSA-N 260.381 2.273 10 10 CECE CCN(c1ccc([C@@H](C)N)c(O)c1)[C@@H]1CCOC1 310821144 DLAKYHHSTWORTN-ZYHUDNBSSA-N 250.342 2.027 10 10 CECE C[C@H]1COCC[C@H]1NCc1ccc2c(c1)CCN2C 311506099 RFVLHXPNACIRHT-SWLSCSKDSA-N 260.381 2.194 10 10 CECE O=C(O)[C@@H]1CC[C@@H]2CCN(Cc3ccccc3O)[C@H]2C1 312906151 KBDSHHJMRNVWOQ-BZPMIXESSA-N 275.348 2.467 10 10 CECE Cc1ccncc1[C@@H](C)NC(=O)c1ccc(O)c(O)c1 2159962335 FADSSOHRFAJVHQ-SNVBAGLBSA-N 272.304 2.292 10 10 CECE CCN(CCCc1ccc(N)cc1)Cc1cnn(C)c1 2169980135 SUHXCTNKMCDNGF-UHFFFAOYSA-N 272.396 2.457 10 10 CECE CC1(C)CCN(C(=O)Nc2ccc(N)cc2)CC[S@]1=O 321845499 GBSYHGXTRTXMJL-HXUWFJFHSA-N 295.408 2.034 10 10 CECE Oc1cccc(F)c1CN1CCC(NCC2CC2)CC1 2160795867 ZPSHGRXEJZGWEU-UHFFFAOYSA-N 278.371 2.495 10 10 CECE C[C@H](N)c1ccc(N(C)CCCn2cncn2)c(Cl)c1 2170124435 XYZNVNJYMGUZEC-NSHDSACASA-N 293.802 2.478 10 10 CECE CCC[C@@H]1CN(c2ccc(OC)c(OC)c2)CCN1 86123247 LBFHMMIXHCTDGX-GFCCVEGCSA-N 264.369 2.282 10 10 CECE CCN(C)C[C@@H]1CCN(c2ccc(CNC)c(C)c2)C1 2170238547 UWTWPNRFNUELKQ-HNNXBMFYSA-N 275.440 2.492 10 10 CECE C[C@@H]1CC(C)(C)CN1CC(=O)N(C)c1ccc(N)cc1 2170901662 YSQJFRAFZLXPOT-GFCCVEGCSA-N 275.396 2.352 10 10 CECE CNCc1ccc(N(C)C[C@H]2CCCN(C)C2)c(F)c1 705162677 OJTODGPWGOSDRF-AWEZNQCLSA-N 279.403 2.323 10 10 CECE CN1CC[C@H]2[C@@H](CCCN2c2ccc(CN)c(F)c2)C1 2171157641 KDWWCHSFFKSNTH-BBRMVZONSA-N 277.387 2.205 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1cccc(O)c1O 691691361 ZJZXUUQRGCBRHA-MRVPVSSYSA-N 262.269 2.013 10 10 CECE C[C@@H]1OCCN([C@H](C)c2c(O)cccc2O)[C@H]1C 380572144 CMUMTUOYNPSMMU-AXFHLTTASA-N 251.326 2.268 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)c1ccns1 2163136413 SMDKGEBAPULSHL-CABCVRRESA-N 289.404 2.130 10 10 CECE O=C(NC[C@]12CCCC[C@H]1C2)c1ccc(O)c(O)c1 693575407 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Cc1c[nH]c(=N)cc1COc1ccc(N(C)C)cc1 2352440739 HFNMWOZSPOSPEM-UHFFFAOYSA-N 257.337 2.448 10 10 CECE CO[C@H]1CN(c2ccc(CN)c(SC)c2)CC12CC2 2353858182 GGXBOOSNVLYGQE-AWEZNQCLSA-N 278.421 2.482 10 10 CECE COc1cccc(CN2C[C@H]3CC[C@H](OC)[C@H]3C2)c1O 2353934668 KJFOKNIKNNNXCU-XBFCOCLRSA-N 277.364 2.258 10 10 CECE CO[C@H]1CN([C@@H](C)c2cc(C)ccc2O)[C@@H]2COC[C@@H]21 2354361951 FXBRDUQAWHJXCI-ZIEJDFEHSA-N 277.364 2.107 10 10 CECE O=c1c(-c2ccc(O)cc2)coc2cc(O)c(O)c(O)c12 6472605 HDXSEWOOSVMREY-UHFFFAOYSA-N 286.239 2.282 10 10 CECE endogenous,in-man CCNCc1ccc(OC)c(CN2C[C@H](C)O[C@@H](C)C2)c1 50124237 GSRRVDIIZQXRPC-KBPBESRZSA-N 292.423 2.414 10 10 CECE CCCNC[C@@H](C)N1CCN(c2ccc(OC)cc2)CC1 52418117 STWZVWHAURICBX-OAHLLOKOSA-N 291.439 2.205 10 10 CECE CCCCN(CC(N)=O)c1ccc(CNC2CC2)c(C)c1 50584496 AKRFVBIDEVFXIY-UHFFFAOYSA-N 289.423 2.339 10 10 CECE CCOc1ccc(O)c(CNC(C)(C)CCO)c1 174577447 ATNGCGKAFAKUIM-UHFFFAOYSA-N 253.342 2.042 10 10 CECE Oc1c(Cl)cccc1CNC[C@@H]1CCC[C@H]1O 124849584 WQJAUNNIOAANEU-JOYOIKCWSA-N 255.745 2.296 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H]4C[C@@H]4[C@@H]3CO)ccc21 2357561052 BOWQRELBFBDVCX-STECZYCISA-N 272.392 2.100 10 10 CECE COCCNCc1ccc(N2CC=C(C)C2)cc1C 1893040027 IIFBGJBCRNPLMN-UHFFFAOYSA-N 260.381 2.497 10 10 CECE COc1cccc(CN[C@@H]2CCC[C@@H]2n2ccnc2)c1O 37107026 YPLSEEPCEMIDAU-KGLIPLIRSA-N 287.363 2.481 10 10 CECE CCN(CC)c1ccc([C@H](N)C(C)(C)C(=O)O)c(O)c1 1951977555 ONRJFLOFHSVILY-ZDUSSCGKSA-N 280.368 2.349 10 10 CECE COc1cccc(CNCC[C@H]2CC[C@H]2OC)c1O 2130386794 UIXBIBAHUHUOAZ-DGCLKSJQSA-N 265.353 2.306 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@@H]2CC(O)C3)cc1F 126625914 ODAFCDLGKMIJGT-PBWFPOADSA-N 278.371 2.379 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2C[C@@H]3CC[C@@H]2O3)c1 132120633 INFJNBSMFJMEBR-PBLBJHRBSA-N 263.337 2.371 10 10 CECE CO[C@H]1CC[C@@H]1CCNC(=O)Nc1ccc(N)cc1 2130351307 DPVYJBXAWCEETA-MFKMUULPSA-N 263.341 2.205 10 10 CECE COc1cc(N2C(=O)CC3(CCCCC3)C2=O)ccc1N 41157258 DWUPPLJWOWUINL-UHFFFAOYSA-N 288.347 2.491 10 10 CECE CC[C@H]1CN(c2ccc(OC)c(F)c2)CCCN1 86287051 FYEFIDHQGCBEQZ-NSHDSACASA-N 252.333 2.413 10 10 CECE Cn1c(I)cc2cc(O)c(O)cc21 89203720 JDVDPIUCOPQSRC-UHFFFAOYSA-N 289.072 2.194 10 10 CECE C[C@@H]1CCN(Cc2cc(Cl)ccc2O)[C@@H]1C(=O)O 227170681 XJQFXEZKOHTZCU-PELKAZGASA-N 269.728 2.341 10 10 CECE Cc1ccc(NC(=O)CN2C(=O)CSC2=S)c(C)c1 82322546 FVIPKJZFAPJYTK-UHFFFAOYSA-N 294.401 2.102 10 10 CECE COc1ccc(O)c([C@@H](C)N2CC[C@@H](C)[C@@H](N)C2)c1 226296910 VKQHBFBJKWCVSU-GYSYKLTISA-N 264.369 2.131 10 10 CECE C[C@H](N[C@H](C)c1ccc2ccccc2c1O)c1nnn[nH]1 44888644 LDMOTRMRGHJEBE-ZJUUUORDSA-N 283.335 2.470 10 10 CECE C[C@H]1CN(C)CC[C@@H]1NCc1cc(Cl)ccc1O 134407836 MWHHAXYPDKYYPI-GWCFXTLKSA-N 268.788 2.475 10 10 CECE CN1CC[C@H]2[C@H](CCCN2Cc2cccc(F)c2O)C1 290611161 WPKYSAFQQZRBAV-DOMZBBRYSA-N 278.371 2.447 10 10 CECE C[C@H]1CCN(Cc2cc(Cl)ccc2O)[C@@H]1C(=O)O 227170688 XJQFXEZKOHTZCU-UFBFGSQYSA-N 269.728 2.341 10 10 CECE COc1ccc([C@H](NN)c2ccc(N(C)C)cc2)cc1F 97731078 MUXIUUKKGNQESB-MRXNPFEDSA-N 289.354 2.453 10 10 CECE C[C@H](N[C@@H](C)[C@@H]1CCOC1)c1c(O)cccc1O 235507655 FJMBMHNSPXARPC-GARJFASQSA-N 251.326 2.173 10 10 CECE CC(=O)N(c1ccc(N)cc1)S(=O)(=O)c1cccs1 244227103 WDGUTVFAANAQJE-UHFFFAOYSA-N 296.373 2.072 10 10 CECE C[C@H](NC[C@H](O)[C@H]1CCCO1)c1cc(Cl)ccc1O 527951511 BSVLTYWCFHDANH-QCZZGDTMSA-N 285.771 2.236 10 10 CECE Cc1ccc(-c2cn(C(C)(C)CN)c(S)n2)n1C 606598644 FXEXLIXYZXKNBD-UHFFFAOYSA-N 264.398 2.180 10 10 CECE CC(C)NCc1ccc(N2CC[C@](C)(CO)C2)cc1 381326696 AEZPEKZOIOWQMU-INIZCTEOSA-N 262.397 2.393 10 10 CECE COC[C@]1([C@H](O)[C@@H](N)c2ccccc2O)CC=CCC1 2166474050 LRYIEAWRFHJRTC-XHSDSOJGSA-N 277.364 2.126 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[C@@H]2C(=O)NC)cc1 723184608 FFTVIJFXTPIDMR-IUODEOHRSA-N 275.396 2.072 10 10 CECE CC(=O)C(=O)COC(=O)c1cc(C)c(F)cc1Cl 808526395 QCROCAQCVSELSP-UHFFFAOYSA-N 272.659 2.102 10 10 CECE CN1CCCc2cc([C@H](O)C3CC(F)(CN)C3)ccc21 2163098109 UDFHSORFNKPDPD-SIWZUTFBSA-N 278.371 2.179 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)C1(C)CSC1 2163141450 USMOAWMSNLMVGO-HUUCEWRRSA-N 292.448 2.053 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@H]1COCCC1(F)F 2166666785 ABKSILUATNJQCO-NSHDSACASA-N 286.322 2.078 10 10 CECE CCC[C@@H]1CCOCC[C@]1(O)[C@H](N)c1ccccc1O 2165368051 IXSDCKFDOPKMOQ-DAXOMENPSA-N 279.380 2.350 10 10 CECE CC[C@H](NCc1ccc(O)c(O)c1O)[C@@H]1CCCOC1 724009101 DKLLIKQPGBPFCT-NEPJUHHUSA-N 281.352 2.098 10 10 CECE CO[C@H]1C[C@H](N(C)c2ccc([C@H](C)O)cc2)C[C@H]1OC 2166101440 FYUCDKYBDCJXPI-VCOSZWKGSA-N 279.380 2.369 10 10 CECE CN(C(=O)c1cccc(C(=O)O)c1)c1ccc(N)cc1 2162710799 YTVNCYYZRGYVGB-UHFFFAOYSA-N 270.288 2.244 10 10 CECE C[C@@H](NCCCN)c1ccc(N2CCOCC2)cc1Cl 817938930 VVLJCDQSHUANAE-GFCCVEGCSA-N 297.830 2.176 10 10 CECE CCN(C)c1ccc(CN2[C@H]3CC[C@H]2[C@H](CO)C3)cc1 815118732 KFSOXBRDYVINAO-XIRDDKMYSA-N 274.408 2.488 10 10 CECE CCc1nccn1CCN[C@@H](C)c1cc(O)ccc1O 719736502 YPUFBDYXGRUYNZ-NSHDSACASA-N 275.352 2.208 10 10 CECE C[C@@H](NCCCN)c1ccc(Br)cc1O 817938004 BDODQYITJZATOA-MRVPVSSYSA-N 273.174 2.154 10 10 CECE Cc1cn(C)nc1CN(C)c1ccc([C@H](C)O)cc1 723495820 WFWKDJVZYLSAJU-LBPRGKRZSA-N 259.353 2.418 10 10 CECE COCCN1CCC[C@H]1CN[C@H]1CCc2cccc(O)c21 834562668 UYGPOJZGWYVXJM-GJZGRUSLSA-N 290.407 2.080 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@]2(C)CCC(=O)N2)cc1 835059818 DQRZEWJGPKASHI-BDUNBXCCSA-N 287.407 2.024 10 10 CECE Cc1cc(CCNC(=O)Cc2ccc(N)cc2)cc(C)c1O 832166609 PIYBETOFXHHQFJ-UHFFFAOYSA-N 298.386 2.493 10 10 CECE Oc1ccc(Cl)cc1CN1CCNC[C@@H]1C(F)F 843124931 QARHSWVYWUCPIF-SNVBAGLBSA-N 276.714 2.085 10 10 CECE COc1ccc(NC(=O)c2cc(O)cs2)nc1 743717240 RPVVYQDLLZLCOL-UHFFFAOYSA-N 250.279 2.110 10 10 CECE CC1(C)CN(Cc2cc(Cl)ccc2O)[C@@H]2COC[C@H]2O1 846119174 YEGKYTXBWFZDLB-TZMCWYRMSA-N 297.782 2.424 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)C1(n2cccn2)CC1 929530929 FIGBSVMKQIIFAT-UHFFFAOYSA-N 298.390 2.097 10 10 CECE O=C(NCc1c(O)cccc1F)C1(Br)CC1 928705530 JLOVATXBBMGECU-UHFFFAOYSA-N 288.116 2.075 10 10 CECE Oc1cc2c(cc1CN1CC(CC3CC3)C1)OCO2 857065931 CAGBXFRMEPAWRE-UHFFFAOYSA-N 261.321 2.353 10 10 CECE O=C(O)/C=C\c1ccc(N2CCO[C@@H](C3CC3)C2)cc1 695338412 CXFQMHVGSULDLT-JBGNVSFKSA-N 273.332 2.400 10 10 CECE CC[C@H](N[C@@H]1CCN[C@H]1C)c1ccc(F)cc1O 863546259 HUECUMZNBUBRSH-TVYUQYBPSA-N 252.333 2.322 10 10 CECE CCOC(=O)c1cccc(CNCc2ccccc2O)n1 862274493 PCDRKAVZDNHIKT-UHFFFAOYSA-N 286.331 2.254 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@H]1CCN(C)C1 386892112 XXGCHBLPPIKSAC-PWSUYJOCSA-N 252.333 2.228 10 10 CECE C[C@H](NC(=O)c1cncc(Cl)n1)c1ccccc1O 1472610530 BBWVOXXVVKAOLU-QMMMGPOBSA-N 277.711 2.327 10 10 CECE COc1cc(C)cc(CN[C@H]2C[C@H](C)n3ncnc32)c1O 895232047 XWLKMOALRJIEEZ-JQWIXIFHSA-N 288.351 2.096 10 10 CECE C/C=C/C=C/c1nnc([C@@H](N)c2ccc(O)cc2O)o1 83537663 FLKJDQPNNJVUQO-VGOFJFCRSA-N 273.292 2.118 10 10 CECE N[C@H](c1nc2c(s1)CCCC2)c1ccc(O)cc1O 83548170 DONSOQKNXMBRSY-ZDUSSCGKSA-N 276.361 2.481 10 10 CECE CCC[C@@H](C)c1nnc([C@H](N)c2ccc(O)c(O)c2)o1 83580573 VRDQLBGDRPTBKA-PRHODGIISA-N 277.324 2.433 10 10 CECE Cc1c(O)cccc1[C@H]1NCCc2ccc(O)c(O)c21 83724401 VGECWIURBBMGKT-OAHLLOKOSA-N 271.316 2.347 10 10 CECE C/C(=C\c1cccnc1)C(=O)N1C[C@H](C)Cn2nccc21 893880370 MAPHCXIWYOTHHZ-OXBCTQFSSA-N 282.347 2.364 10 10 CECE O=C(Nc1cc([C@@H]2CCCO2)[nH]n1)c1cc(O)cs1 792676289 SVWITMZXUJBECB-VIFPVBQESA-N 279.321 2.281 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccnc(Br)c1 701302858 HCAQFOBUVXNMCG-UHFFFAOYSA-N 284.117 2.274 10 10 CECE CN(C(=O)CC1(C(=O)O)CCCC1)c1ccc(N)cc1 702063713 GCJXKCUATDLPLA-UHFFFAOYSA-N 276.336 2.267 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](N3CCC3)C2)c(F)c1 702306976 DYJWOSFGMFMTTF-YPMHNXCESA-N 264.344 2.163 10 10 CECE CNCc1ccc(N2CC[C@H](O)C[C@@H]2C)c(Cl)c1 705998418 WRVFGIIETIANCE-JQWIXIFHSA-N 268.788 2.409 10 10 CECE CN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(F)cc(F)c1O 708397400 CHZLGSDVHARFDL-OLZOCXBDSA-N 282.334 2.339 10 10 CECE CCN(Cc1cc(F)cc(F)c1O)[C@H]1CCN(C)C1 708432787 CRROOFJNVUKLPI-LBPRGKRZSA-N 270.323 2.196 10 10 CECE CC(C)[C@H]1CN(CCOc2ccc(N)cc2)CCO1 709001132 RVTHSSABOOBPCI-OAHLLOKOSA-N 264.369 2.004 10 10 CECE NC(=O)c1ccc(Cl)cc1NCc1cc(N)ccc1O 62785959 CCJUOSDCMAZUJY-UHFFFAOYSA-N 291.738 2.339 10 10 CECE OCCN(CC1CC1)c1ccc(CNC2CC2)cc1F 688443780 CJSDWIBSZAOHBG-UHFFFAOYSA-N 278.371 2.286 10 10 CECE CN1CCN(Cc2cc(F)ccc2O)CCC1(C)C 712664883 UUWBBCUNELOCJS-UHFFFAOYSA-N 266.360 2.447 10 10 CECE CCN[C@H](CSc1nccs1)c1cn(CC)nn1 715005145 KSJQKZYXQSBHHG-SNVBAGLBSA-N 283.426 2.197 10 10 CECE C[C@@H](O)c1ccc(N(C)CC23CCN(CC2)C3)c(F)c1 715789458 BBMYHYWOTRUALD-GFCCVEGCSA-N 278.371 2.411 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@H](CO)C(C)(C)C 689216827 FMHUZKGQLQKFJR-CQSZACIVSA-N 278.396 2.067 10 10 CECE Cc1ccnc(C(=O)NCCCSc2nccs2)n1 792164296 HKMYFHKALNBWPN-UHFFFAOYSA-N 294.405 2.154 10 10 CECE Cc1nc2c(C(=O)NCc3ccc(O)cc3O)cccc2o1 1142533634 OIVDCBCFRYXHSN-UHFFFAOYSA-N 298.298 2.477 10 10 CECE CN1CCc2cc([C@H]3NCCn4cccc43)ccc21 1917187396 HHNFZQUFHWDBDG-MRXNPFEDSA-N 253.349 2.173 10 10 CECE CCN1CCC[C@H]1CN(C)c1ccc(CN)cc1F 92620673 HFPMESFGAVXODU-ZDUSSCGKSA-N 265.376 2.205 10 10 CECE Cc1ccc(NC(=O)COc2ccc(N)cc2)c(C)n1 94663818 WVGPSVKGXSWDIX-UHFFFAOYSA-N 271.320 2.298 10 10 CECE 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CLIVTWJNWAGZJU-SRVKXCTJSA-N 265.353 2.300 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1CN3CCC1CC3)CC2 311969004 APWMPKUGKHOSMD-ZIAGYGMSSA-N 258.365 2.063 10 10 CECE CN[C@@H](C)c1ccc(N2CC(N3CC(F)C3)C2)cc1Cl 2159092031 BLOYBHHZIRKAAL-JTQLQIEISA-N 297.805 2.463 10 10 CECE CC[C@@H](O)c1ccc(N(C)[C@H](C)CCS(C)(=O)=O)cc1 2160755282 AHXBVDXEVSRQCF-IUODEOHRSA-N 299.436 2.389 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CCC[S@@](=O)CC1 322119000 ZACVDCCFHLSXGI-HXUWFJFHSA-N 294.464 2.452 10 10 CECE CO[C@@H]1C[C@@H](C)CC[C@H]1NCCc1ccc(O)c(O)c1 2161987418 VGJKWPVARWNCMT-NORZTCDRSA-N 279.380 2.434 10 10 CECE Nc1ccc(OCc2nc([C@H]3CCCO3)no2)cc1 87800800 QQPYZLTZOJCRLX-LLVKDONJSA-N 261.281 2.082 10 10 CECE CN1CCc2cc([C@H](CN)N3CCC[C@H]3CF)ccc21 2171805719 QKCJCSHWWOTIAW-HOCLYGCPSA-N 277.387 2.113 10 10 CECE Nc1ccc(OCCCN2CC[C@@H]3COC[C@@H]3C2)cc1 702054798 YWZRZZCAVOFKMO-KGLIPLIRSA-N 276.380 2.006 10 10 CECE O=C1Nc2cc(N3CC[C@H]4CC[C@@H](C3)S4)ccc2[C@H]1O 703841226 AFBDSJXWCPMUCG-UHIISALHSA-N 290.388 2.146 10 10 CECE C[C@@H]1C[C@H](N)CN(Cc2c(O)cccc2Br)C1 706855397 GQIWUBZYNVCHEG-ZJUUUORDSA-N 299.212 2.324 10 10 CECE CC[C@]1(O)CCCN(Cc2cc(C(C)=O)ccc2O)C1 710246445 DMPVMVXWGOQGOD-INIZCTEOSA-N 277.364 2.332 10 10 CECE CCNCc1ccc(N(C)[C@@H](CC)CO)cc1C 379130400 APSPVAQWWXMMIN-AWEZNQCLSA-N 250.386 2.312 10 10 CECE CC(C)N(C[C@@H](C)O)c1c(F)cc(CN)cc1F 691398616 BIQKKNRHOHDQPC-SECBINFHSA-N 258.312 2.019 10 10 CECE CNC[C@H]1CCN(Cc2ccc(Br)cc2O)C1 691485712 CNIASLGGIGQIKJ-SNVBAGLBSA-N 299.212 2.196 10 10 CECE CCSC1CCN(C(=O)c2ccc(O)c(O)c2)CC1 383314689 QNQNWJAMKLPVFR-UHFFFAOYSA-N 281.377 2.456 10 10 CECE CC(C)n1ncnc1[C@@H](O)CCc1ccc(N)cc1 695879661 IGRMFJMAGWNLHD-ZDUSSCGKSA-N 260.341 2.107 10 10 CECE CCc1nnc(CN[C@H](C)c2c(O)cccc2O)s1 391939446 MZCFCYJSFCSSGG-MRVPVSSYSA-N 279.365 2.363 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[C@H](O)[C@H]2C)cc1O 394975687 BVNVBKGEJGHTSE-JMSVASOKSA-N 278.396 2.412 10 10 CECE Cc1ccc(O)c(CN2C[C@H]3C(N4CCCC4)[C@@H]3C2)c1 395197478 BKOPBRPENJMLJE-HUUCEWRRSA-N 272.392 2.227 10 10 CECE Cc1nc(=NCc2ccccc2O)[nH]cc1Br 396718047 LPFRIKNFRSIAOI-UHFFFAOYSA-N 294.152 2.287 10 10 CECE Nc1ccc(N2C(=O)[C@H]3CC[C@@H]3C2=O)cc1C(F)(F)F 397502466 SSINYTYVNYNXOW-YUMQZZPRSA-N 284.237 2.187 10 10 CECE Cc1nocc1CNCc1ccc2c(c1)CCN2C 397895521 IJVJUZYZVUEEBO-UHFFFAOYSA-N 257.337 2.265 10 10 CECE CCO[C@@H]1C[C@H](OC)CN(Cc2cc(C)ccc2O)C1 2165449060 KLYRXQBBOVETIF-LSDHHAIUSA-N 279.380 2.326 10 10 CECE C[C@H](O)C[C@H](C)CN[C@@H](C)c1c(O)cccc1O 398593018 QRUCVTZVHSATSA-DCAQKATOSA-N 253.342 2.155 10 10 CECE C[C@@H]1CC=C[C@@](O)([C@H](N)c2ccc3c(c2)CCN3C)C1 2175432389 HUTBUEFTIWCBCO-JLZZUVOBSA-N 272.392 2.396 10 10 CECE C[C@H]1CCC[C@@H]1S(=O)(=O)Nc1ccc(O)cc1C(=O)O 2175556909 QYYORXPULQIWMD-UFBFGSQYSA-N 299.348 2.021 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)[C@@H]1CCC[C@H]1F 2175592192 HDHBNWASDJKFGR-LERXQTSPSA-N 279.359 2.418 10 10 CECE CC(C)Cc1cc(CN)n(Cc2c(O)cccc2F)n1 2070122336 QMTPQSYKRTXHSF-UHFFFAOYSA-N 277.343 2.433 10 10 CECE O=C(O)[C@@H]1CN[C@H](c2ccccc2O)c2ccccc21 2176736340 SZDLFPVMFHCBMS-HIFRSBDPSA-N 269.300 2.253 10 10 CECE CCCS(=O)(=O)CCN(C)c1ccc([C@H](N)CC)cc1 2170440204 SDMUVDINRLZMRA-OAHLLOKOSA-N 298.452 2.357 10 10 CECE CC1(C)CSCCN1c1cc2c(cc1F)[C@H](O)C(=O)N2 2170952641 RJJIRJXSNHOHIM-LBPRGKRZSA-N 296.367 2.143 10 10 CECE Cc1ccc([C@@H](C)N(C)[C@@H]2CCN(C)C(=O)C2)c(O)c1 2188463448 IPWNYTZIEYCTDG-CHWSQXEVSA-N 276.380 2.314 10 10 CECE COc1cccc(CN[C@@H](C)c2ccc(O)cc2O)n1 2181846323 VGXXEZSOPJFMKA-JTQLQIEISA-N 274.320 2.352 10 10 CECE CNCc1ccc(OC)c(CO[C@@H]2CCOC[C@@H]2F)c1 2197027719 XACQMLYPSSANSH-DZGCQCFKSA-N 283.343 2.058 10 10 CECE CNCc1ccc(N2CC(O)(c3cccs3)C2)cc1C 2193352056 CRXKGMRIBCNZJD-UHFFFAOYSA-N 288.416 2.484 10 10 CECE COc1ccc(N2CC[C@H](O)[C@H]2C(C)C)c([N+](=O)[O-])c1 2182493837 RYQXUXJTBSEZAB-UONOGXRCSA-N 280.324 2.199 10 10 CECE CC[C@H]1C[C@H](N(C)C(=O)c2ccc(O)c(O)c2)CCO1 2182913015 UALQRLAWDAHDRT-NEPJUHHUSA-N 279.336 2.127 10 10 CECE COc1ccc(CNCc2c[nH]nc2C(F)F)c(O)c1 2183026643 JBSGGAVJOARWNA-UHFFFAOYSA-N 283.278 2.351 10 10 CECE C[C@@H]1[C@@H](C)[C@@](O)(c2ccc3c(c2)CCN3C)CCN1C 2193725029 LFIUVNQDQCKSKJ-PBFPGSCMSA-N 274.408 2.227 10 10 CECE C[C@@H](F)CN1CCN(c2ccc([C@@H](C)O)cc2F)CC1 2190002992 RMVLASKCGRMCTK-VXGBXAGGSA-N 284.350 2.359 10 10 CECE OCc1cc(F)c(N2CC[C@H](CO)C23CCC3)c(F)c1 2190357510 ACLRVMKHORCMOK-LLVKDONJSA-N 283.318 2.198 10 10 CECE CN(CCn1ccnc1)c1ccc2c(c1)CCC[C@H]2N 2184682321 NQEVDIZFUBJIPL-MRXNPFEDSA-N 270.380 2.356 10 10 CECE CN1CC[C@H](CN(C)c2ccc3c(c2)CCC[C@@H]3N)C1 2184684521 NHENPDGVADMNQQ-GUYCJALGSA-N 273.424 2.411 10 10 CECE COc1cccc(O)c1CN[C@H](C)c1csnn1 2042581290 NWESXFXZGPULMG-MRVPVSSYSA-N 265.338 2.103 10 10 CECE Oc1cccc(F)c1CNC1CC2(CCOC2)C1 2042598943 GNCGBTRJLBXMNN-UHFFFAOYSA-N 251.301 2.190 10 10 CECE CO[C@H](C1CC1)[C@H](C)NCc1c(O)cccc1F 2042603698 WSRHJJWORDGPHN-XPTSAGLGSA-N 253.317 2.434 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](CN(C)C)C2)c(F)c1 2194695629 WILWQKOVQKTQBR-QWRGUYRKSA-N 283.366 2.372 10 10 CECE COCC(COC)C[C@@](C)(N)c1ccc(N(C)C)cc1 2199354176 WRFBZBRFWWILMG-MRXNPFEDSA-N 280.412 2.226 10 10 CECE Cc1cc(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)nnc1C 2185775706 JFEWVMNSBUIOQY-NSHDSACASA-N 274.328 2.256 10 10 CECE CN(C)c1ccc([C@@H](O)C[C@](C)(N)C(F)F)cc1 2052021961 ABFCOMANGDPWCF-AAEUAGOBSA-N 258.312 2.159 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@H]1C[C@@H]1CF 2191371478 GJEITJYSKAVNMN-IJLUTSLNSA-N 279.359 2.133 10 10 CECE OCc1ccc(N2CCOC[C@@H]2C(F)F)c(Cl)c1 2055447765 HSDWTZPOZPJZHO-LLVKDONJSA-N 277.698 2.303 10 10 CECE COc1ccc(N(CC(C)C)C[C@@H]2CCCN2)c(N)c1 2191576511 JHLDWFWODUMMEO-ZDUSSCGKSA-N 277.412 2.492 10 10 CECE CC(C)(F)C1CN(C(=O)Nc2ccc(N)cc2)C1 2058550752 BAAWNGYNKWJGKB-UHFFFAOYSA-N 251.305 2.481 10 10 CECE CSCCNC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2061936353 OMPBLZYSZVYKKJ-SNVBAGLBSA-N 271.390 2.471 10 10 CECE CC(C)N1C[C@H]2C[C@H]1CN2Cc1cc(F)cc(F)c1O 2187560250 OVQYXMNOVIOPRI-OLZOCXBDSA-N 282.334 2.337 10 10 CECE Oc1c(CN[C@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)ccc(F)c1F 2070882123 USDNLSFGBNHLNR-IZBBKAEPSA-N 251.276 2.414 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1[C@H](O)C[C@H]2[C@H]1C2(C)C 2192566142 FHISIIRRWRPSCQ-CLWVCHIJSA-N 275.392 2.477 10 10 CECE C[C@@H](NCC1COCCOC1)c1ccc(N(C)C)cc1 2188060265 AAAUQRXDGIHZSS-CYBMUJFWSA-N 278.396 2.066 10 10 CECE CC(C)c1cc(=N[C@@H](C)c2ccccc2O)[nH]c(=N)[nH]1 2192625214 GRJTWGWBAOMCEG-JTQLQIEISA-N 272.352 2.313 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@@](C)(CO)C2)c(Cl)c1 2199843387 PGNXXEAYUZLTSK-XHDPSFHLSA-N 298.814 2.195 10 10 CECE OC[C@@H](F)[C@H]1C[C@@H](NCc2c(O)cccc2Cl)C1 2078425122 MRRRPZLVJTXLDO-VDDIYKPWSA-N 273.735 2.244 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)[C@]23CCC[C@H]2CSC3)C1 2082084769 YVVCMDGAULQDQS-UMNHJUIQSA-N 266.370 2.431 10 10 CECE Cc1ccc(O)c(CN2CCC[C@@]23CC[S@](=O)C3)c1 2102290784 GIYNAWDUNJPGMU-KXBFYZLASA-N 279.405 2.188 10 10 CECE COCCNCc1ccc(N2CC(CF)C2)cc1Cl 2102859427 ZRDHZOMRYJOVBX-UHFFFAOYSA-N 286.778 2.482 10 10 CECE CCOC(=O)[C@H](NCC1CC1)c1c(O)cccc1F 2104474946 XYDBKDZAZIIXIF-CYBMUJFWSA-N 267.300 2.135 10 10 CECE Oc1cc2c(cc1CN[C@@H]1C[C@@H]1C(F)(F)F)OCO2 2105435329 ZKUHEOLAQIIYRO-JGVFFNPUSA-N 275.226 2.161 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2CC3(CCC3)CN2)cc1 2106795884 LRQRURNYDNADMI-CABCVRRESA-N 260.381 2.318 10 10 CECE CN1CCCc2cc([C@@H](NN)[C@@H]3[C@H]4CC[C@H]43)ccc21 2106862597 WJOSJGXNKMXMGV-BFJAYTPKSA-N 257.381 2.229 10 10 CECE Cc1ncc([C@@H](O)c2ccc3c(c2)CCCN3C)o1 2106822024 AUTBCNZQICSVSU-HNNXBMFYSA-N 258.321 2.447 10 10 CECE CCC[C@@H](OCC)[C@H](NN)c1ccc(N(C)C)cc1 2106858163 SSSFOCJDWKSUEH-HUUCEWRRSA-N 265.401 2.462 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CCCNC3)ccc21 2106820118 HCJCHYVRJWADKD-ZBFHGGJFSA-N 260.381 2.102 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@H]1CCOC1 2106833053 GPHMPRHFGOJNEQ-HOCLYGCPSA-N 260.381 2.366 10 10 CECE CN1CCc2cc([C@H](NN)C3CC(F)(F)C3)ccc21 2106867412 GGVKIJVDXAZIBF-ZDUSSCGKSA-N 267.323 2.229 10 10 CECE Cc1nc(CN(C)[C@@H](C)c2ccccc2O)n(C)n1 2087054329 TVSSHDTURAHYTE-JTQLQIEISA-N 260.341 2.022 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)cc1 2107281669 DTYXCJXLGGHPSS-WXYCVUISSA-N 260.381 2.304 10 10 CECE C[C@H]1CSCCCN1c1ccc2c(c1)NC(=O)[C@@H]2O 2087307247 AVJWBYICSQJMIJ-TVQRCGJNSA-N 278.377 2.004 10 10 CECE Nc1ccc(NS(=O)(=O)C[C@@H]2C[C@H]2C(F)(F)F)cc1 2108373139 SFSWCACTRZAHLN-OIBJUYFYSA-N 294.298 2.209 10 10 CECE CC1=C[C@H](C)CN(CC(=O)c2ccc(O)c(O)c2)C1 2108850602 DTORFIMHLBTUTK-JTQLQIEISA-N 261.321 2.179 10 10 CECE CNCc1ccc(N2C[C@]3(C)C[C@]3(CO)C2)cc1Cl 2109163692 WWQUYVUBYFWULG-LSDHHAIUSA-N 280.799 2.268 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C2CN(C)C2)c(F)c1 2089241647 QDCWUSLLWVARNS-NSHDSACASA-N 265.376 2.246 10 10 CECE Nc1cc2c(cc1N1CC[C@@H](CCF)C1)OCCO2 2109627725 RSPIPOYYRDRELI-SNVBAGLBSA-N 266.316 2.226 10 10 CECE NCc1ccc(N2CC[C@H]2C2CCOCC2)cc1F 2089501451 KYDZXMWSKMGGPH-HNNXBMFYSA-N 264.344 2.290 10 10 CECE CC1(C)CCc2cc(N3C[C@@H]4C[C@]4(N)C3)ccc2O1 2110241120 MNMHARGTJRXMCB-LRDDRELGSA-N 258.365 2.328 10 10 CECE C[C@H](NCc1ccc(F)c(F)c1O)[C@H]1CCC[C@@H]1O 2111560563 JCQIRMMXOATFTC-XRNSZHNASA-N 271.307 2.310 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)CC(C)(C)OC 2091862450 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C[C@H]1CCCN(Cc2ccc3c(c2)CCN3C)[C@H]1CN 252101336 GIDCDJOBBSSUNS-GUYCJALGSA-N 273.424 2.238 10 10 CECE CN1CC[C@@H](NCc2cc(F)ccc2O)CC12CC2 1974263606 YSYKGGDUGLOPQC-CYBMUJFWSA-N 264.344 2.248 10 10 CECE CC1(C)C[C@H](C(=O)O)CCN1Cc1ccccc1O 1974496809 ZDVTYZLIJBRJQS-LLVKDONJSA-N 263.337 2.467 10 10 CECE Nc1ccc(CNC[C@@H]2Cc3ccccc3CO2)cc1 2148949640 WTQYEEKPSSJCHX-KRWDZBQOSA-N 268.360 2.500 10 10 CECE NCc1ccc(N2CCCC[C@@H](O)C2)cc1Br 2003411958 IDZMXAUUOMZZKN-GFCCVEGCSA-N 299.212 2.259 10 10 CECE CNC(=O)[C@H]1[C@H](C)CCN1c1ccc([C@@H](C)N)cc1Cl 2146448159 VVYMTZZYCINCFA-GPCCPHFNSA-N 295.814 2.321 10 10 CECE COc1ccc(CNC(C)(C)C)cc1CN1CCC1=O 2146803427 UQFGBPWQJDGDFE-UHFFFAOYSA-N 276.380 2.316 10 10 CECE O=C1Nc2cc(N3CC4CC3(CF)C4)c(Cl)cc2[C@@H]1O 2146900058 UEJSUZQYAMSNIM-XUTOFBKGSA-N 296.729 2.264 10 10 CECE COC(=O)CCSCCCC(=O)Nc1ccc(N)cc1 36336366 LZCQAWYLLNEPSZ-UHFFFAOYSA-N 296.392 2.284 10 10 CECE CC[C@@H](C)[C@H](NCc1cc(OC)ccc1O)C(=O)OC 37102422 UOVVEYMPTHTGOJ-YGRLFVJLSA-N 281.352 2.078 10 10 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10 10 CECE COc1cc(N2CC[C@@H](N)C[C@@H]2C)cc(OC)c1OC 49694296 GQXPXBYEHPEQCV-WDEREUQCSA-N 280.368 2.028 10 10 CECE CCCNCc1ccc(N2CC[C@H]2CO)cc1Cl 2031685495 BUBDCWCMABEKQJ-ZDUSSCGKSA-N 268.788 2.411 10 10 CECE C[C@@H]1CCS[C@@H]1C(=O)N(C)Cc1ccc(N)cc1 2033391125 XCIMRGWVRCKOQP-MFKMUULPSA-N 264.394 2.369 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC[C@H]2CN(C)C)c1 61645751 UXSWOZRGGUZYDV-HNNXBMFYSA-N 276.380 2.121 10 10 CECE C[C@H](N[C@@H]1COCC[C@H]1C)c1ccc(O)cc1O 2035123936 MGZCVWUMLIBXQW-GBIKHYSHSA-N 251.326 2.173 10 10 CECE CCCN(CCOC)C(=O)Nc1ccc(N)cc1 2036717227 DFRRIAWHUKJOOP-UHFFFAOYSA-N 251.330 2.159 10 10 CECE CC(C)[C@@H](O)[C@@H](C)N[C@@H](C)c1ccc(O)cc1O 2041299690 KUZRVKKSBZHAHZ-IMSIIYSGSA-N 253.342 2.154 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3CCC[C@]3(CO)C2)c(F)c1 2159407170 BSLZQWLYAYVYDD-PVXIVEMSSA-N 278.371 2.444 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](C)[C@@H](CO)C2)cc1 700451059 SSHJLBADKGYOOP-UMVBOHGHSA-N 262.397 2.422 10 10 CECE NN[C@H](c1ccccc1O)[C@@H]1CC[C@H]2COCC[C@@H]2C1 2159589557 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Cc1ccc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])c(O)n1 701139843 LYSWCLYJGOUAHP-SECBINFHSA-N 261.285 2.011 10 10 CECE CNCc1ccc(N2CCC[C@H](N3CCC3)C2)cc1 702243670 NMGVTYDXXISUDT-INIZCTEOSA-N 259.397 2.081 10 10 CECE OCc1ccc(N2CCO[C@@H]([C@@H]3CCOC3)C2)cc1Cl 2171691081 OPJCYLFJQVIZBG-IUODEOHRSA-N 297.782 2.074 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@]3(C)C[C@@H]3C)ccc21 704015762 FFJXODOSRIAVCD-FSBGKCOPSA-N 273.380 2.382 10 10 CECE CN(CCCOc1ccc(N)cc1)CCn1cccc1 2171845936 KRUGINIGVZZREC-UHFFFAOYSA-N 273.380 2.471 10 10 CECE C[C@H]1CN(Cc2cc(Br)ccc2O)C[C@@H]1CN 708898792 APDJIEFJEXLONP-ONGXEEELSA-N 299.212 2.181 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC(O)(C(F)F)C1 2172122934 WRCXSWZDSHHMHN-UHFFFAOYSA-N 282.334 2.063 10 10 CECE CC(C)N1CC(N[C@H](C)c2ccc(F)cc2O)C1 379173264 PHYXDXWIDMGDMG-SNVBAGLBSA-N 252.333 2.275 10 10 CECE C[C@H](O)c1ccc(N(CCO)C(C)(C)C)cc1O 691083589 IODGJWAYCOEDOL-JTQLQIEISA-N 253.342 2.043 10 10 CECE CCc1cccc(CNCCC(=O)N(CC)CC)c1O 691470188 ZKNUWNOTIZAQBR-UHFFFAOYSA-N 278.396 2.303 10 10 CECE CN1CCc2cc([C@@H](N)[C@]3(O)C[C@H]4C=C[C@H]3C4)ccc21 2163133738 PCUUDAYEOVQGOA-WPUCRFQZSA-N 270.376 2.006 10 10 CECE CCc1cccc(CN(C)[C@@H]2CCCN(C)C2)c1O 692130082 SPQRXUIRHOOBGA-OAHLLOKOSA-N 262.397 2.481 10 10 CECE CC(C)S[C@H]1CCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 383226601 QVXCKDZHWHLUJH-FZMZJTMJSA-N 291.420 2.359 10 10 CECE Cc1cc(N(C)CC23CCN(CC2)C3)ccc1CO 715783007 HVHFBIWAXBNPAB-UHFFFAOYSA-N 260.381 2.019 10 10 CECE Cc1ccc([C@H](C)NCC[C@H](O)C(F)F)c(O)c1 716775370 UEOKFEVKLPSOKH-ONGXEEELSA-N 259.296 2.367 10 10 CECE COc1ccncc1[C@@H](N)c1ccc(N(C)C)cc1 388274693 ONMVHQGGUYYPGR-HNNXBMFYSA-N 257.337 2.204 10 10 CECE CCNCc1ccc(N2C[C@H](O)CC[C@H]2C)cc1C 399317834 GSOGXZUSPTVBAP-CZUORRHYSA-N 262.397 2.454 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2CCCCC23CC3)cc1 2173572815 AEWLUHYGKRRYII-CQSZACIVSA-N 274.364 2.487 10 10 CECE CO[C@@H](CC(=O)Nc1ccc(O)c(O)c1)C(F)(F)F 2062301438 UNPZFBSYQABPLG-VIFPVBQESA-N 279.214 2.004 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@H](C(C)(C)O)C2)cc1Cl 2174148047 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COc1cccc(CN(C)[C@@H]2CCCN(C)CC2)c1O 2192752138 BTLDYGLUQRLPCV-CQSZACIVSA-N 278.396 2.317 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2CCCC(=O)N(C)C2)cc1 2188487878 VONBWJHHBPQCDD-DOMZBBRYSA-N 276.380 2.187 10 10 CECE CN1CCCc2cc(CNC3CC4(COC4)C3)ccc21 2182184029 VUURFNXLOPGEOF-UHFFFAOYSA-N 272.392 2.338 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@@H]2C(C)C)c([N+](=O)[O-])c1 2182493836 RYQXUXJTBSEZAB-KGLIPLIRSA-N 280.324 2.199 10 10 CECE COc1cccc(C)c1[C@H](O)[C@H](N)c1ccccc1O 2183295193 MHWXXYSIQDEOJC-CVEARBPZSA-N 273.332 2.443 10 10 CECE NCc1ccc(N(C2CC2)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2O)cc1 2197088206 HPICYRRXHJZYQU-PYTWLRIVSA-N 272.392 2.274 10 10 CECE CN1CC[C@]2(CCN(c3ccc4c(c3)CC[C@@H]4O)C2)C1 2184736263 RCCMPGVZTJCZEH-IRXDYDNUSA-N 272.392 2.198 10 10 CECE CN1CC[C@@H]2[C@H](CCN2c2ccc3c(c2)CC[C@@H]3O)C1 2184729346 IFWFRPIXQNIJJY-XYPHTWIQSA-N 272.392 2.197 10 10 CECE C[C@H]1C[C@@H]2CN(c3ccc4c(c3)CC[C@H]4N)CCN2C1 2184725906 LSKXLQMURXDCIQ-XGWLTEMNSA-N 271.408 2.163 10 10 CECE CCN(CC)c1ccc([C@H](N)c2cnns2)cc1 2044730597 PHNFZPDVBUMQQR-ZDUSSCGKSA-N 262.382 2.432 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H](O)C[C@H]3C2)c(F)c1 2185193080 HKPNNHRLJYKSBD-SCUASFONSA-N 278.371 2.313 10 10 CECE N[C@@]12CCC[C@H]1CN(c1ccc3c(c1)OC(F)(F)O3)C2 2198070022 XRMBCQJOAIHEAA-TVQRCGJNSA-N 282.290 2.326 10 10 CECE C[C@@H]1C[C@@H]1N(C)c1cc2c(cc1Cl)[C@H](O)C(=O)N2 2052754704 GPZYYTGZJQOKHN-HUABCPSTSA-N 266.728 2.170 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC3(C2)CC(C)(O)C3)c(F)c1 2194519521 RNQKVJLVEMYZAH-SECBINFHSA-N 283.318 2.369 10 10 CECE C[C@H]1CC[C@H](CNCc2cc(F)ccc2O)OC1 2053748045 KRURGOXIIQMLJJ-GXFFZTMASA-N 253.317 2.436 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H](O)C23CCC3)c(F)c1 2194692765 WFJAFHXTIMPFGV-RNCFNFMXSA-N 282.334 2.478 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@H]3[C@@H](O)CC[C@H]3C2)c(F)c1 2194716543 ZMAGYROJXADUES-GRLOZPDXSA-N 282.334 2.192 10 10 CECE CCNCc1ccc(N(C)[C@H]2C[C@H](O)C2)c(Cl)c1 2058952748 RPKFSIWFJUZQOP-HAQNSBGRSA-N 268.788 2.409 10 10 CECE 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2.225 10 10 CECE C[C@@H]1CCCN(c2ccc(CN)cc2F)[C@H]1CCO 700347949 VYKJJAZSPXXAEK-RISCZKNCSA-N 266.360 2.272 10 10 CECE CC(=O)C(=O)COc1ccc(Cl)cc1C(C)=O 288972520 USBKXORNSYZVHJ-UHFFFAOYSA-N 254.669 2.080 10 10 CECE Cc1nc(/C=C\C(=O)NCCc2ccc(N)cc2)cs1 706263229 ZISCUDDEWLPOSL-SREVYHEPSA-N 287.388 2.406 10 10 CECE CC[C@](N)([C@@H](O)c1ccc2c(c1)CCN2C)C(F)(F)F 2163075044 YOFHJCCYMGJKKV-STQMWFEESA-N 288.313 2.382 10 10 CECE CCN1CCc2cc([C@]3(O)CCNC[C@@H](C)C3)ccc21 2163077057 UAERHUFMIDZVEO-GUYCJALGSA-N 274.408 2.276 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CCCN(C)C3)ccc21 2163075901 IXDWZAHYVMBWLG-WBVHZDCISA-N 274.408 2.444 10 10 CECE CCN1CCc2cc([C@@](C)(O)CC(OC)OC)ccc21 2163080286 SWXHBUSOPPTOCQ-INIZCTEOSA-N 279.380 2.286 10 10 CECE CN1CCCc2cc([C@@](C)(O)[C@@H]3CCCCN3)ccc21 2163097140 LMFQPZIAZQQTFB-DLBZAZTESA-N 274.408 2.419 10 10 CECE O[C@@H](Cn1ccnn1)c1ccc(N2CCCCC2)cc1 2163102060 HLHJAXQCROUSJV-HNNXBMFYSA-N 272.352 2.002 10 10 CECE C[C@H](O)[C@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 293490054 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COc1cc(CN(C)CCc2ccc(N)cc2)sn1 722396288 OBKGHKOLDCUUTK-UHFFFAOYSA-N 277.393 2.408 10 10 CECE C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@H](C)C1O 827152314 RILLRJDKYKSACO-UWVGGRQHSA-N 269.772 2.494 10 10 CECE COc1cc(Cl)cc([C@@H]2NCCCCC2=O)c1O 1952668706 FEMDZFDVBFBUEU-LBPRGKRZSA-N 269.728 2.438 10 10 CECE C/C=C\C[C@@H](CO)NCc1cccc(Cl)c1O 588492082 HYYQSGDZRPLOFS-QUCGXOGASA-N 255.745 2.462 10 10 CECE CC[C@@H](NC[C@](C)(COC)OC)c1ccccc1O 1895309187 UJZZJSHIGDIGMG-UKRRQHHQSA-N 267.369 2.484 10 10 CECE COc1ccc(O)c(CNC(=O)[C@@H](OC)C2CCCC2)c1 830544080 LHOONHNDHUMMBN-HNNXBMFYSA-N 293.363 2.222 10 10 CECE Cc1ccc([C@@H](C)NCC23CC(CN2)C3)c(O)c1C 854225993 CGTVDYZDDBUMHO-VEAWUBTESA-N 260.381 2.412 10 10 CECE Cc1ccc([C@H](C)NC[C@]2(CCO)CCOC2)c(O)c1C 756656607 YXMAVWCPERAWDW-YOEHRIQHSA-N 293.407 2.449 10 10 CECE COC(=O)C1=CC[C@H](N[C@@H](C)c2cc(F)ccc2O)C1 858473493 OTSCKBDMEWODIG-CABZTGNLSA-N 279.311 2.444 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)CCC(F)F)C2)cc1 855226612 RDHWHMBMGAMVPT-LLVKDONJSA-N 298.333 2.435 10 10 CECE C[C@H]1CCC[C@@H](CNC(=O)c2cc(O)cs2)O1 855796635 JDWJTOARKDNWMC-WPRPVWTQSA-N 255.339 2.141 10 10 CECE O=C(c1cc(O)cs1)N1CCC[C@H]2COCC[C@H]21 756800014 PYMCODXDIQIUMF-GXSJLCMTSA-N 267.350 2.095 10 10 CECE CN(Cc1cnccn1)c1ccc(/C=C/C(=O)O)cc1 699539875 YJZFGRYMZQMFAY-QPJJXVBHSA-N 269.304 2.211 10 10 CECE CN(C)c1ccc([C@@H](O)CC2(CS(C)(=O)=O)CC2)cc1 696781041 QBYMYKDTKCRSLU-AWEZNQCLSA-N 297.420 2.001 10 10 CECE CN1C[C@H]2CCN(Cc3cc(F)c(N(C)C)cc3F)[C@H]2C1 862375081 WTUYTEKADLLUKK-BZNIZROVSA-N 295.377 2.167 10 10 CECE O=C(OC[C@H]1CCCO1)N1Cc2cccc(O)c2C1 867690587 JVAVXNSJOFSDLW-LLVKDONJSA-N 263.293 2.023 10 10 CECE CCN(CC)[C@H](C)CNC(=O)N[C@@H](C)c1ccccc1O 868353621 MWWFFNWIKVJPSX-OLZOCXBDSA-N 293.411 2.483 10 10 CECE COC(=O)[C@H]1CCN(Cc2cc3c(cc2O)CCCC3)C1 768442827 ODVVUFKOQUTBIT-AWEZNQCLSA-N 289.375 2.266 10 10 CECE COc1cc(N)c(N2CCCCC[C@@H]2CO)cc1OC 133130649 IHIKFERKTIOVRG-LLVKDONJSA-N 280.368 2.027 10 10 CECE CC(C)N[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1 71198552 PDMOGEXJKRDUNE-GFCCVEGCSA-N 262.353 2.035 10 10 CECE Oc1ccccc1CNC[C@@H](O)Cc1ccccc1F 886232349 VAIZTQMEICGWNL-AWEZNQCLSA-N 275.323 2.225 10 10 CECE Cc1cc(Cl)cc(CN2C[C@@H](O)C[C@@H]2C)c1O 788271127 YODKCHKVQUFAHU-CABZTGNLSA-N 255.745 2.309 10 10 CECE COc1cccc([C@H](N)c2nnc(C3CCC3)o2)c1O 83543977 LBTWYXDKIMNWDQ-NSHDSACASA-N 275.308 2.099 10 10 CECE Nc1ccc(OCCCN2CCO[C@H](CCF)C2)cc1 700588085 LFAKPURONSBZQE-OAHLLOKOSA-N 282.359 2.098 10 10 CECE CC(C)C[C@H](C(=O)O)N1CCCc2cc(CN)ccc21 700830678 GIHFTKLRHHNLRK-OAHLLOKOSA-N 276.380 2.397 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)[C@H]1COC[C@H]1C 705140229 KYAUWXZRPXLTKR-DOMZBBRYSA-N 276.380 2.288 10 10 CECE C[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@]1(C)CN 708494050 DINGUFQURIYXTA-XPTSAGLGSA-N 270.323 2.087 10 10 CECE CNCc1ccc(N(C)Cc2nccn2C)cc1C 62254998 WLRWLDMDOAKOCT-UHFFFAOYSA-N 258.369 2.084 10 10 CECE NCc1cc(F)c(N2C[C@@H]3CSC[C@H]3C2)c(F)c1 711602568 XOCIIPGZUXDOPU-NXEZZACHSA-N 270.348 2.223 10 10 CECE C[C@H]1CN(c2ccc(CO)cc2Cl)C[C@@H](C)[C@@H]1O 688083434 IGHGHUACURCTKY-MSRIBSCDSA-N 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262.397 2.408 10 10 CECE C[C@]1(C(F)(F)F)C[C@@H]1C(=O)NCCCN=[N+]=[N-] 1906300017 MAHHQQJUWMBWOF-SVRRBLITSA-N 250.224 2.392 10 10 CECE COC[C@@H]1C[C@H]1CN1CCc2cc([C@H](C)N)ccc21 2133591608 HTAQRTSGHHOAMD-CQDKDKBSSA-N 260.381 2.351 10 10 CECE CCN(Cc1cccc(OC)c1O)C[C@@H]1CCCNC1 233544315 UGAFNAVMRANZCJ-CYBMUJFWSA-N 278.396 2.222 10 10 CECE C[C@H]1[C@H](O)CCN1c1ccc([C@@H](C)N)cc1Cl 1908491163 WHLPGDUUGFFRTH-VYUIOLGVSA-N 254.761 2.319 10 10 CECE CC1(C)SCC[C@@H]1[C@@H](NCCCN=[N+]=[N-])C(=O)O 1912178744 OSUGDJXDAYKTTI-RKDXNWHRSA-N 272.374 2.261 10 10 CECE CC(C)NC(=O)[C@H](C)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912175124 IIIRPUOROGUEFG-RYUDHWBXSA-N 267.377 2.312 10 10 CECE CCCN(C)c1cnn(CCCCN=[N+]=[N-])c(=O)c1 1912175715 PFCVHKXSWSEMKZ-UHFFFAOYSA-N 264.333 2.180 10 10 CECE [N-]=[N+]=N[C@H]1CCN(S(=O)(=O)CCCC(F)(F)F)C1 1912169646 NATFQHZJTPFYIT-ZETCQYMHSA-N 286.279 2.043 10 10 CECE CC(=O)Nc1ccc(C(=O)N(C)CCN=[N+]=[N-])cc1 1912202630 KGAODSMIKSHVNZ-UHFFFAOYSA-N 261.285 2.027 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)C[C@@H]2CCCO2)C1 1912200374 GSMGXWQKLLWMAX-QWRGUYRKSA-N 252.318 2.104 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1O 1914311851 RXVALTIZQACVLG-LALPHHSUSA-N 278.396 2.412 10 10 CECE CON1CCN(c2ccc([C@@H](C)N)c(Cl)c2)CC1 1915797099 LUIXGRJEVUIYAD-SNVBAGLBSA-N 269.776 2.043 10 10 CECE CCNCc1ccc(N2CCC3(COC3)C2)c(C)c1 1915801536 KOAHBJKTFZIIQL-UHFFFAOYSA-N 260.381 2.331 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2F)CCN1C 110729948 JTYUOUODEPHMFZ-GFCCVEGCSA-N 277.387 2.218 10 10 CECE Cc1nscc1CNCCc1ccc(O)c(O)c1 1918231578 CZKPWUXYVZPPOH-UHFFFAOYSA-N 264.350 2.195 10 10 CECE COc1cc(OC)cc(N2C(=O)CSC2=S)c1 113837571 XPXLYJJWKJVTSX-UHFFFAOYSA-N 269.347 2.069 10 10 CECE CC[C@H]1CC[C@H](C(=O)N(C)Cc2ccc(N)cc2)O1 2136706059 LKTYKJGLYAQMAE-UONOGXRCSA-N 262.353 2.185 10 10 CECE COc1ccc(CNC[C@@]2(C)CSCCO2)c(O)c1 2136548489 RVWAQHGYQLQWFR-AWEZNQCLSA-N 283.393 2.013 10 10 CECE CCOc1cccc(CN2C[C@@H](C)CN[C@@H](C)C2)c1O 1921448694 MLPGQOHZEDXMJX-STQMWFEESA-N 278.396 2.221 10 10 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CSc1cc(N2CC[C@@H](C)[C@H](O)C2)ccc1CN 2328548556 HGWXMQSAFGAFSJ-ZWNOBZJWSA-N 266.410 2.074 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@@H]2NCc1cccc(O)c1O 2329224357 UXZLXTDRSBHLFJ-NRWUCQMLSA-N 263.337 2.001 10 10 CECE CO[C@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1cc(F)ccc1O 2329221394 AGFQMUBYINGJOS-ACGQPVHCSA-N 265.328 2.434 10 10 CECE CO[C@H]1C[C@@H]2[C@H]1CCN2c1ccc2c(c1)CC[C@H]2N 2331550595 IOIVSKHKQJCSLV-FPCVCCKLSA-N 258.365 2.246 10 10 CECE C[C@H](N[C@@H]1CC[C@@H]2C[C@H]1CO2)c1ccc(O)cc1O 2334122066 DKPZBPREACNWHY-BQSGVUBFSA-N 263.337 2.316 10 10 CECE Cc1cc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)ccc1[C@@H](C)N 2334468557 AHABXDCHAKOIPQ-HLSYRSCKSA-N 260.381 2.364 10 10 CECE CN[C@H]1CN(Cc2ccc(N(C)C)cc2)CC1(C)C 2336379297 YXFHJKSLGMKQBF-HNNXBMFYSA-N 261.413 2.182 10 10 CECE CO[C@H]1CN(c2ccc([C@@H](C)N)c(C)c2C)C[C@H]1F 2341069855 LEHHAFUBIHWCLZ-KYOSRNDESA-N 266.360 2.496 10 10 CECE Cc1scnc1CN1CCc2cc(O)c(O)cc2C1 2341214805 PDHAKOSQFPIREZ-UHFFFAOYSA-N 276.361 2.421 10 10 CECE Nc1ncccc1OCc1cnn(CC(F)(F)F)c1 2343065515 STFSPICRYAIZTA-UHFFFAOYSA-N 272.230 2.002 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H](CC1CC1)C1CC1 2343640878 PVXDEOPFRVCEBV-ZDUSSCGKSA-N 259.353 2.358 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)c2ncccn2)C1 2353037624 IPJSJDXJEQQPDZ-SNVBAGLBSA-N 260.301 2.029 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@@H]1O2)c1c(F)cc(CN)cc1F 2354999466 VDKDVXJFXYMIGR-WDMOLILDSA-N 282.334 2.427 10 10 CECE NC[C@@H]1C[C@H]2CC[C@@H]1N2c1ccc2c(c1)OCCCO2 2355417112 DMPXKBAWAVNOIT-SCRDCRAPSA-N 274.364 2.164 10 10 CECE Cc1cc(N(CC(N)=O)CC(C)C)ccc1CNC1CC1 50584505 AWVBRGXUHZPNMQ-UHFFFAOYSA-N 289.423 2.195 10 10 CECE CC(=O)N1CCN(c2ccc(CNC(C)C)cc2C)CC1 50559915 ZAXHHVRIARWEPT-UHFFFAOYSA-N 289.423 2.162 10 10 CECE CC(=O)c1cc(F)cc(CN(C)[C@H]2CCCN(C)C2)c1O 53246284 XQUKSQADBWYZDN-AWEZNQCLSA-N 294.370 2.260 10 10 CECE CNCc1ccc(OC)c(CN(C)Cc2ccncc2)c1 50124841 MKUKJWTULPQSJW-UHFFFAOYSA-N 285.391 2.442 10 10 CECE c1cc2c(cc1CN[C@@H]1CC[C@@H]3CO[C@H]1O3)CCCO2 2357469400 BVCLPEPWGHTBIR-FMKPAKJESA-N 275.348 2.005 10 10 CECE COc1ccc(N2CCCC[C@@H]2CC(=O)O)c([N+](=O)[O-])c1 38027304 HHVMMHWCGYOYTL-SNVBAGLBSA-N 294.307 2.437 10 10 CECE Oc1c(Br)cccc1[C@H]1NCCCC[C@@H]1O 1952073863 ZQGZLVJOOYFHLL-WDEREUQCSA-N 286.169 2.330 10 10 CECE CCN(CC)c1ccc([C@H]2NCCCC[C@@H]2O)c(O)c1 1952081778 SRMXRWFTDBHEPK-GOEBONIOSA-N 278.396 2.414 10 10 CECE Nc1ccc([N+](=O)[O-])c(Sc2nccs2)n1 87851087 VPGKKRPXSXXHEF-UHFFFAOYSA-N 254.296 2.180 10 10 CECE CC1(CNCc2cc(F)ccc2O)CCOCC1 226613572 ISEZWDHOCUFFAG-UHFFFAOYSA-N 253.317 2.438 10 10 CECE CN(C)c1ccc(/C=C\CN2CCC[C@@H](O)C2)cc1 229474851 PMTNCRHDKNOHNZ-OICCZTGUSA-N 260.381 2.223 10 10 CECE CCN[C@@](C)(C[C@@H](C)Sc1nccs1)C(=O)O 84351533 DNPAKYWNDYTZOO-KCJUWKMLSA-N 274.411 2.467 10 10 CECE CCCN(C(=O)COc1ccc(N)cc1)C(C)C 40302710 FSAJCZCAOCCZIX-UHFFFAOYSA-N 250.342 2.295 10 10 CECE CC(=O)Oc1cccc2c1C(=O)c1c(O)cccc1C2=O 137711349 BSSOWGKQINNSBC-UHFFFAOYSA-N 282.251 2.093 10 10 CECE O=C(N[C@@H]1CC[C@H](O)C(=S)C1)OCc1ccccc1 514278334 ZZPMBBVJXVKARQ-NEPJUHHUSA-N 279.361 2.196 10 10 CECE CC(C)[C@H](CNCc1ccc2c(c1)CCN2C)N(C)C 50286205 HRYLTORVVSKMPO-KRWDZBQOSA-N 275.440 2.355 10 10 CECE CC1(C)CCC[C@](NCCCN=[N+]=[N-])(C(N)=O)CC1 90260589 CLDCFDZHEUDXOA-CYBMUJFWSA-N 267.377 2.491 10 10 CECE CCN(C)c1ccc([C@@H](C)N[C@H]2CCc3ncnn3C2)cc1 246283494 BRTHUKSORQKLJK-HIFRSBDPSA-N 299.422 2.400 10 10 CECE CC1(C)COc2ccc(N3C[C@H]4CNC[C@@]4(C)C3)cc21 2162670555 AVTOJVRBVJEASC-PXAZEXFGSA-N 272.392 2.402 10 10 CECE COc1ccc(N2C[C@@H](N)[C@H](C(F)(F)F)C2)c(OC)c1 2162674024 WQAJYUPPBRRKOG-NXEZZACHSA-N 290.285 2.030 10 10 CECE CCN1CCc2cc([C@]3(O)CCNC(C)(C)C3)ccc21 2163072230 WLYZZAMIBMAJST-KRWDZBQOSA-N 274.408 2.419 10 10 CECE CC[C@H]1CC[C@](O)(c2ccc3c(c2)CCCN3C)CN1 2163102551 LRVJFJNHKCCYBX-DOTOQJQBSA-N 274.408 2.419 10 10 CECE NN[C@@H](C[C@@H]1CCCO1)c1ccc(N2CCCC2)cc1 2163104662 FVUYIGMTRYDFTI-HOTGVXAUSA-N 275.396 2.360 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)c2ncccc2F)cc1 2163131822 VKGBKRGRLPNRQI-DZGCQCFKSA-N 275.327 2.020 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3[C@@H]4CC[C@@H](O4)[C@H]3C2)c(F)c1 718312403 ZWSUXMKQYNCCSD-DBXOSMHCSA-N 277.339 2.493 10 10 CECE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CC12CC2 823114546 DHMVOOAUZZCTOV-OAHLLOKOSA-N 283.375 2.415 10 10 CECE CN(C)c1ccc(CNC(=O)NC2C[C@H]3C[C@@H]3C2)cc1F 824265690 LYOQTENJLNVCGE-VXGBXAGGSA-N 291.370 2.489 10 10 CECE Cc1nc(C)c(CNCc2ccc3c(c2)CCN3C)[nH]1 724672824 NUPIBWTYFKDQSW-UHFFFAOYSA-N 270.380 2.309 10 10 CECE F[C@H]1OCCC[C@@H]1NCc1ccc2c(c1)CCO2 585384324 NWOKDFWNXCUGMN-JSGCOSHPSA-N 251.301 2.186 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@@H]2CCCCN21 901055243 LBVBMYVLINBUME-GJZGRUSLSA-N 288.391 2.368 10 10 CECE N[C@@H]1CN(Cc2cccc(F)c2O)CC[C@@H]1C(F)(F)F 903984283 SBXOOXKQWAIJKI-GXSJLCMTSA-N 292.276 2.243 10 10 CECE CC1(C)C(C)(C)C1(C(=O)O)C(=O)NCc1ccccc1O 901608023 IEDHPNMJZGQHMS-UHFFFAOYSA-N 291.347 2.145 10 10 CECE CC(C)[C@@H]1C[C@@]1(N)[C@H](O)c1ccc2c(c1)CCN2C 1896017018 KLVDNDSAUYGUOT-IMJJTQAJSA-N 260.381 2.086 10 10 CECE O=C(NCc1ccccc1O)c1onc2c1CCCC2 830526530 NCUQQRWSIULEMV-UHFFFAOYSA-N 272.304 2.189 10 10 CECE COCCOCCN(C)C/C=C/c1ccc(N(C)C)cc1 835057001 XLDHZFJDFAOZGM-AATRIKPKSA-N 292.423 2.361 10 10 CECE COCCCOC1CN(Cc2ccc(N(C)C)cc2C)C1 840953317 POPAXLCCTWPENX-UHFFFAOYSA-N 292.423 2.298 10 10 CECE CCOc1cccc(CN2CC[C@@H]3COC[C@H]32)c1O 1899148039 KMRBIOMRMZUOLO-CHWSQXEVSA-N 263.337 2.012 10 10 CECE Cc1cc(C)c([C@H](C)NCC23CC(CN2)C3)c(O)c1 854228296 UNQVEHNQUCELTH-FUJMWEONSA-N 260.381 2.412 10 10 CECE CC1(C)[C@H]2NCCC[C@H]2[C@@H]1NCCc1ccc(N)cc1 925692529 MAPKCRSOUYYAKX-PMPSAXMXSA-N 273.424 2.178 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1[C@@H](N)c1ccccc1O 1954297801 ZVNNQZWBJKRPNE-WZRBSPASSA-N 278.352 2.305 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H](C)[C@@H](C)OC)C2)cc1 850488941 PQABYAIENUNRKE-MJBXVCDLSA-N 278.396 2.287 10 10 CECE CCN(c1ccc(/C=C/C(=O)O)cc1)[C@H]1CCN(C)C1 693438430 BPTPGCCHURUOJD-PPYMECGQSA-N 274.364 2.315 10 10 CECE CC(C)(C)CS(=O)(=O)N1Cc2cccc(O)c2C1 867690942 OMCQIKYRNGLDAU-UHFFFAOYSA-N 269.366 2.084 10 10 CECE CCOc1ccc(CN2CCN(C3CC3)CC2)c(O)c1 768244421 KUHGHXPYQXVFDQ-UHFFFAOYSA-N 276.380 2.071 10 10 CECE CCOC(=O)C1=CC[C@@H](NCc2c(O)cccc2OC)C1 862487686 UMSVMODSGGNUJR-GFCCVEGCSA-N 291.347 2.142 10 10 CECE C[C@H]1C[C@H]1NC(=N)NCc1ccc2c(c1)CCCN2C 864457814 UZCSHDRFYJGLAO-SMDDNHRTSA-N 272.396 2.091 10 10 CECE CC[C@@H]1CC[C@@H](C(=O)N2Cc3cccc(O)c3C2)O1 871202774 FUOFXNSPUJGRNP-RISCZKNCSA-N 261.321 2.192 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Cl)CC[C@@H]1O 779199547 DZALXAZLAWQBBJ-SKDRFNHKSA-N 255.745 2.248 10 10 CECE Oc1cccc(C[C@H]2NCCc3c2ccc(O)c3O)c1 75793214 QCKPFCGPVIIUJK-CQSZACIVSA-N 271.316 2.233 10 10 CECE C[C@@H](C(=O)O)c1nc2cccnc2n1Cc1ccc(N)cc1 76009601 ODUIPMXYEOHWFR-SNVBAGLBSA-N 296.330 2.250 10 10 CECE Oc1c(F)cc(F)cc1CN1CCc2nccnc2C1 895333480 CFNFEIZMIULXLI-UHFFFAOYSA-N 277.274 2.019 10 10 CECE Oc1ccc([C@@H]2NCCc3ccc(O)cc32)c(O)c1 83595364 SPYMIUGPCLOPJX-HNNXBMFYSA-N 257.289 2.039 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1CCCC[C@H]1O 83599846 CUFIQJSEGLBEST-WCQYABFASA-N 255.745 2.439 10 10 CECE CC(C)CCNCc1ccc(N2CCNCC2)cc1F 84846876 YWFFNVVVNPCCTD-UHFFFAOYSA-N 279.403 2.371 10 10 CECE CN(CCC1CCC1)C[C@H](O)COc1ccc(N)cc1 701498120 YIXKSASMRITLKE-HNNXBMFYSA-N 278.396 2.131 10 10 CECE C[C@H]1CN[C@@H](C2CC2)CN1c1ccc2c(c1)CN(C)C2 689489654 CHHRIYKLVNPOMM-YVEFUNNKSA-N 271.408 2.209 10 10 CECE C[C@H]1CCCCN(CC(=O)N(C)c2ccc(N)cc2)C1 703240508 JWWBHNCHOVNSTE-ZDUSSCGKSA-N 275.396 2.354 10 10 CECE CCOc1cccc(CN2C[C@H](N)CC[C@H]2C)c1O 690927451 OMRXMJFAYFMQSF-DGCLKSJQSA-N 264.369 2.103 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2CN(C)CCO2)cc1Cl 707791370 RDJOUPVXTYAQTE-YPMHNXCESA-N 298.814 2.160 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@H]2COC[C@@H]2O)c(Cl)c1 709229275 XIZIFKUXPSKVBF-ONERCXAPSA-N 298.814 2.206 10 10 CECE CN(C[C@@H]1CCSC1)c1cc2c(cc1N)NC(=O)CC2 718459609 TWYWKZLRBYMXCX-JTQLQIEISA-N 291.420 2.343 10 10 CECE COc1ccc(O)c(CNC[C@]2(OC)CCSC2)c1 719276123 MWGGKNUJWKVLGY-CQSZACIVSA-N 283.393 2.013 10 10 CECE CC(C)(O)[C@H]1CCCN(c2ccc(CO)cc2F)C1 719676362 OTTPSYCIPUVESU-LBPRGKRZSA-N 267.344 2.305 10 10 CECE c1cc2c(cc1N1CCN[C@@H](C3CC3)C1)OCCCO2 86122794 KZFGRQJLUSGKGJ-CQSZACIVSA-N 274.364 2.036 10 10 CECE [N-]=[N+]=NCCN[C@@]1(C(=O)O)CCCC[C@H]1C1CC1 696014323 AYEFPNLTTSPYCN-JQWIXIFHSA-N 252.318 2.310 10 10 CECE C[C@@H](CCO)N(C)c1ccc(CN)cc1Br 1917028201 PDGHZUQTVKOPHE-VIFPVBQESA-N 287.201 2.115 10 10 CECE CCCNCc1ccc(N2CCO[C@H]3C[C@H]32)c(C)c1 2115163688 KIKDQTDMQZHCER-CVEARBPZSA-N 260.381 2.472 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCCCNC1 2116661953 KMGUVBVOSFBGNM-MRXNPFEDSA-N 260.381 2.248 10 10 CECE CN[C@@H](c1ccccc1O)c1cnn2c1CCCC2 2126832614 VTEFGWGPPWWBKS-HNNXBMFYSA-N 257.337 2.234 10 10 CECE O[C@H]1C[C@H]2C[C@H]1N(c1ccc3c(c1)CCC[C@H]3O)C2 2128273135 UULXHOOFRSJSQS-KCXZSRPNSA-N 259.349 2.016 10 10 CECE Nc1ccc(CCCN2CC[C@@H]3CCO[C@H]3C2)cc1 2128429523 FCVJKEVAPKOZBG-ZBFHGGJFSA-N 260.381 2.312 10 10 CECE O=C(NCc1cc(O)ccc1O)c1cccnc1C(F)F 1176756077 WIHDQYDRWAOWBS-UHFFFAOYSA-N 294.257 2.360 10 10 CECE CN1CCC[C@H](N(C)c2ccc3c(c2)CC[C@H]3N)C1 2128325133 OQQSUNPJCCZDEG-GOEBONIOSA-N 259.397 2.163 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)CC[C@@H]1CO 2128322997 RLNZJFUPFLNKTC-AXAPSJFSSA-N 261.365 2.121 10 10 CECE CCCNCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)cc1 2121686961 PIVSCBOOKIJDCT-XHSDSOJGSA-N 260.381 2.146 10 10 CECE C[C@H](O)[C@@H]1CCCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128317443 FAFMSWFGWKMOKA-GHJWDPDVSA-N 260.381 2.230 10 10 CECE CNCc1cc(F)c(N2CC=C[C@@H]2COC)c(F)c1 2125987868 VQMXNSIGAXLSQN-LLVKDONJSA-N 268.307 2.075 10 10 CECE Cc1ncncc1CNCc1ccc(N(C)C)cc1 2122296001 CZLMYCJQDMPCSP-UHFFFAOYSA-N 256.353 2.141 10 10 CECE CC[C@@H](N)c1ccc(N2CC3(CCCN3C)C2)cc1 2129977578 NIPQKQYBNUJUSE-OAHLLOKOSA-N 259.397 2.381 10 10 CECE CN1C[C@H](N(C)Cc2c(O)cccc2Cl)CCC1=O 2131936251 OQFMTIUFTXOXIQ-SNVBAGLBSA-N 282.771 2.098 10 10 CECE COc1ccc(O)c([C@H](C)N(C)[C@@H]2CCCNC2)c1 104352902 AHHHYTUSECEYPG-NWDGAFQWSA-N 264.369 2.146 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3ccc(O)c(O)c3)[C@@H]2C1 2133985076 RBXIUCSFIXSQDK-FDYHWXHSSA-N 263.337 2.001 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3C2)C1 1912144734 XMRMEZRQPONZKJ-NWDGAFQWSA-N 272.308 2.149 10 10 CECE CC[C@@H](COC)CC(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1912152755 AZLABASQAQJNHZ-MNOVXSKESA-N 254.334 2.208 10 10 CECE Cc1ccc([C@](C)(NCCCN=[N+]=[N-])C(N)=O)s1 1912178053 JYNGQXZHIZUBLF-NSHDSACASA-N 267.358 2.047 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cc(Cl)c3c(c2)OCO3)C1 1912171754 OZUMIZQJJXHPJS-UHFFFAOYSA-N 280.671 2.203 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)CCOCC(F)F)CC1 1912191894 XZZPCBBDGGTJFF-UHFFFAOYSA-N 276.287 2.207 10 10 CECE [N-]=[N+]=NC1CCN(C[C@H](O)COCc2ccccc2)CC1 1912156282 SQYPJFSGTMCLIB-HNNXBMFYSA-N 290.367 2.339 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)[C@@H]2CC23CCOCC3)C1 1912163789 NRVJGHDKISEMRL-NEPJUHHUSA-N 278.356 2.352 10 10 CECE C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CC[C@H](N=[N+]=[N-])C1 1912180688 DZBMDAOYCZCIRZ-UTUOFQBUSA-N 265.361 2.161 10 10 CECE CC(C)S(=O)(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912203750 SCRHXNLBKMTZLH-JTQLQIEISA-N 260.363 2.137 10 10 CECE Cc1cnc2cc(C(=O)NCc3ccccc3O)ccn12 1445972987 UYPHHGATPAPGPN-UHFFFAOYSA-N 281.315 2.278 10 10 CECE Cc1ncc(/C=C/C(=O)NCc2cccc(O)c2O)s1 1455313483 BMKQNJRGOSUOIL-AATRIKPKSA-N 290.344 2.192 10 10 CECE Cc1ccc(-c2nnnn2Cc2ccc(N)cc2)cc1 213321045 JYOZVOYJJFRLDP-UHFFFAOYSA-N 265.320 2.279 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC[C@@H](CCN)C1 226325045 GRHLZLADSKSZEF-RYUDHWBXSA-N 264.369 2.220 10 10 CECE Oc1c(F)cccc1CNC[C@H]1CCC[C@H](O)C1 226611484 AJGMROSGFLAFOA-JQWIXIFHSA-N 253.317 2.172 10 10 CECE O=C(NCc1c(O)cccc1F)c1cc(C(F)F)ncn1 1471976456 ZPVMSESFVBHBFN-UHFFFAOYSA-N 297.236 2.189 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H](C)CN[C@H](C)C2)c1 1921444694 HMKTZOYAYAEDPU-XQQFMLRXSA-N 278.396 2.392 10 10 CECE Cc1ccc(CNC(=O)c2cc(O)cs2)nc1C 1626115679 KZINTSCGWPMUQV-UHFFFAOYSA-N 262.334 2.396 10 10 CECE CC(=O)NC1CCN(c2ccc([C@H](C)N)cc2Cl)CC1 228279548 JNWJWGWQCOIZSL-JTQLQIEISA-N 295.814 2.465 10 10 CECE CC(C)(C)c1nc([C@H](NCCCN=[N+]=[N-])C(N)=O)cs1 229259798 IJHBGRNNRCCVIV-VIFPVBQESA-N 296.400 2.257 10 10 CECE C[C@@H](NC(=O)NCc1c(O)cccc1F)c1ccc[nH]1 1681061162 DRVYCIRVFCOJFN-SECBINFHSA-N 277.299 2.420 10 10 CECE CC[C@H]1CCOCCN1c1ccc(CN)c(OC)c1 2139698329 HHWYLVZRLQFGOA-ZDUSSCGKSA-N 264.369 2.159 10 10 CECE COCC1(CN(C)c2ccc(CN)c(OC)c2)CC1 2139704861 RLOSVDLLSZMGLH-UHFFFAOYSA-N 264.369 2.017 10 10 CECE Cc1cccc(CNC(=O)[C@H](C)[C@H]2CCCO2)c1O 2139742073 AKOVIMZTMLVRMO-DGCLKSJQSA-N 263.337 2.132 10 10 CECE CN(C)CCCN1C(=O)/C(=C\c2ccco2)SC1=S 14171034 PCBXPXIMFKTMHF-PKNBQFBNSA-N 296.417 2.433 10 10 CECE Cc1cc(OC[C@@H]2CCCO2)ccc1N1CCC[C@H](N)C1 161704834 QDGOPGUQISMXCG-HOCLYGCPSA-N 290.407 2.480 10 10 CECE COc1ccc([C@H](C)NC[C@@H](O)C(C)C)c(O)c1 168775622 ZFTXKGGSAQMYNL-IINYFYTJSA-N 253.342 2.068 10 10 CECE CCN1CC[C@@H](CN[C@@H](C)c2c(O)cccc2O)C1 233504638 BWPJUQDOYIKLRB-RYUDHWBXSA-N 264.369 2.090 10 10 CECE CC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc[nH]2)SC1=S 8325777 PGJVLHLSUAIKLM-CYXIBPNKSA-N 296.373 2.079 10 10 CECE COc1ccc([N+](=O)[O-])cc1NN=NCCc1cnc[nH]1 1860492506 WHKZWMLGDSSGMN-UHFFFAOYSA-N 290.283 2.348 10 10 CECE COc1cc(C)c(N(C)C(C)(C)CN)cc1OC 258826047 LXLHEZDDDLCHSV-UHFFFAOYSA-N 252.358 2.186 10 10 CECE C[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1O 827978670 ZZGDCVFPWQVXEH-UZWIWUQPSA-N 261.321 2.137 10 10 CECE CC(C)CNC(=O)CN(C)[C@@H](C)c1ccccc1O 134961916 ISPQQBKNBQISCX-LBPRGKRZSA-N 264.369 2.157 10 10 CECE CC(C)(C)OC(=O)CNCc1ccc2c(c1)CCCO2 2143827743 AUCKCECOPVZGHO-UHFFFAOYSA-N 277.364 2.443 10 10 CECE CCN[C@](CSc1nccs1)(CC1(C)CC1)C(N)=O 2142882172 HQWCATJVKBPWPY-ZDUSSCGKSA-N 299.465 2.259 10 10 CECE Oc1ccc(F)cc1CNC[C@@H]1C[C@H](O)C12CCC2 1875445244 QTKAINXZEULZES-FZMZJTMJSA-N 265.328 2.172 10 10 CECE COC[C@H]1C[C@@H]1NCc1ccc(Br)cc1O 1875845082 MFYBEMZQUWPLIA-KOLCDFICSA-N 286.169 2.279 10 10 CECE CCN(CC)[S@@](C)(=O)=NC(=O)Nc1ccc(N)cc1 1876166326 ZTDOCCIJAKFLHV-IBGZPJMESA-N 284.385 2.155 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1CCC[C@H](N)CC1 1876509372 OAIAQLCINYRFBW-UWVGGRQHSA-N 263.341 2.039 10 10 CECE C[C@@H](NCC12CCC(CC1)O2)c1ccc(O)cc1O 1876695734 DDOWEXQMPIEDAT-CKQAKLJMSA-N 263.337 2.460 10 10 CECE O=C(O)C12CC(CCN1Cc1ccc(Cl)cc1O)C2 1877352347 QKLPPMXOHDFGHS-UHFFFAOYSA-N 281.739 2.485 10 10 CECE C[C@@H]1CC[C@H](C2OCCO2)N(Cc2ccc(N)cc2)C1 1946677455 LYTBJDAAIJEBAY-IUODEOHRSA-N 276.380 2.242 10 10 CECE C[C@H](O)[C@H]1CCCN1c1ccc2c(c1)CCC[C@H]2N 1879182125 KTVWMVDKPNDXAQ-IUIKQTSFSA-N 260.381 2.372 10 10 CECE C[C@H](c1ccccc1O)N(C)CCn1ccccc1=O 2143444681 XLYVYYDFEPCXDQ-CYBMUJFWSA-N 272.348 2.247 10 10 CECE C[C@@H]1CC[C@@](CO)(NCc2ccc3c(c2)CCO3)C1 1880889773 MQFPNLSLUOONED-MLGOLLRUSA-N 261.365 2.262 10 10 CECE CCOc1ccc(N2CC(C)(C)OC[C@@H]2CN)cc1 1880843685 VPPRCXDSCXBFCJ-ZDUSSCGKSA-N 264.369 2.028 10 10 CECE C[C@@H](O)c1ccc(N2CC(c3ccn(C)n3)C2)cc1 1882897031 JVUGBHJCUOABLI-LLVKDONJSA-N 257.337 2.077 10 10 CECE CCNCc1ccc(N(C)C[C@@H]2COCCO2)cc1Cl 2143686830 MNJMLKJVSIVONC-CQSZACIVSA-N 298.814 2.301 10 10 CECE CCc1onc(C)c1C(=O)N(C)Cc1ccc(N)cc1 2143632018 ZDOYPMGYSUAAAJ-UHFFFAOYSA-N 273.336 2.400 10 10 CECE CN(C)c1ccc([C@@H](N)c2cc(F)ncc2F)cc1 1886702936 QQJPVZBYRLMKNH-CQSZACIVSA-N 263.291 2.474 10 10 CECE c1cc(N2CC([C@@H]3CCNC3)C2)ccc1OC1CC1 1886853900 LKRFZLMZPMWQSN-GFCCVEGCSA-N 258.365 2.274 10 10 CECE COc1ccc(CNC[C@H]2CC[C@H]3C[C@H]2CO3)c(O)c1 2144233851 IYCPYVIYVCPSNM-ZLDLUXBVSA-N 277.364 2.306 10 10 CECE CCN[C@H](COC(C)C)[C@@H](O)c1ccc(N(C)C)cc1 2148019573 KSZBWLUEJHFSGL-CVEARBPZSA-N 280.412 2.189 10 10 CECE C[C@H](NC[C@@H](CO)C(F)(F)F)c1ccc(F)cc1O 1967500670 LIRYDXDFGRORPC-YUMQZZPRSA-N 281.249 2.353 10 10 CECE COc1ccc(N2C[C@@H]3CCCN3C[C@H]2C)cc1OC 251526261 ADJFNTIIXFSFAN-OCCSQVGLSA-N 276.380 2.377 10 10 CECE CCc1cccc(CN[C@H]2C[C@H]3C[C@H]2C[C@@H]3O)c1O 1967760474 UJRWQXXSJKIYAR-XGUBFFRZSA-N 261.365 2.204 10 10 CECE COc1cccc(O)c1CNC[C@@]12CCC[C@@H](C1)OC2 1967872811 VLVXYHYSNYAYOJ-BLLLJJGKSA-N 277.364 2.450 10 10 CECE Cc1ccc(CNC[C@H]2CCS(=O)(=O)[C@H](C)C2)c(O)c1 1967900924 HEFHAJCCRCCNSK-OLZOCXBDSA-N 297.420 2.004 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1F 148933098 VDDJHRXWOHDRIF-NXEZZACHSA-N 262.284 2.088 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H](O)[C@H](C)C2)cc1 253194244 PGWRGKUISFIRKM-CZUORRHYSA-N 262.397 2.392 10 10 CECE COC[C@H](NCc1cc(C)ccc1O)C(F)(F)F 1973152816 WMRBQKQEQJLMIS-NSHDSACASA-N 263.259 2.368 10 10 CECE CN1C[C@@H](CN)C[C@@H]1c1cc(C(F)F)ccc1O 258426399 QKRCMXRSZJLJOY-LDYMZIIASA-N 256.296 2.281 10 10 CECE CCN1CCC(N(C)CCOc2ccc(N)cc2)CC1 42614184 HRMIBEZZUCQCDT-UHFFFAOYSA-N 277.412 2.064 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)NC[C@H](C)O)c1 35601728 DLVAAQXAZBVESK-QWRGUYRKSA-N 280.368 2.162 10 10 CECE CN(c1ccc(CN)cc1C(F)(F)F)[C@@H]1CCOC1 160103083 MORDPAUSOWRZFZ-SNVBAGLBSA-N 274.286 2.389 10 10 CECE Nc1ccc(OCCCSc2nnnn2C2CC2)cc1 36672153 ATLDYVPONRZSKA-UHFFFAOYSA-N 291.380 2.151 10 10 CECE COC[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1COC 2149237625 BAZIQWJHERDXJL-CHWSQXEVSA-N 299.798 2.386 10 10 CECE COc1ccc(N(CCCN)C[C@@H]2CCCO2)cc1 37298593 BVLMKRIQLJWXLH-HNNXBMFYSA-N 264.369 2.029 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@@H]3C[C@H]32)c(Cl)c1 2004447812 VGMZSKFXVRHBKA-BZHVJNSISA-N 253.729 2.371 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2C[C@@H]1CCOC1 162161659 AADCYFPRNIIXMB-OLZOCXBDSA-N 260.381 2.366 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1CCS[C@H]2CC[C@H]21 2152206318 LDUBPSIWERYLLF-HONMWMINSA-N 291.420 2.176 10 10 CECE CC(C)(C)[C@@H]1CCN1c1cc2c(cc1F)[C@H](O)C(=O)N2 2152272910 MMQOXWSFKSIYGW-STQMWFEESA-N 278.327 2.436 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@@](C)(F)C3)c(Cl)cc21 2152316955 GAQPCXUNWSXBAD-TZMCWYRMSA-N 297.761 2.491 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)[C@H]1CCOC1 40941412 ZJMNOKBXWWWWMG-ZDUSSCGKSA-N 262.353 2.042 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@@H]2CCN(C)[C@H]2C1 2158542592 RYBZITJNQHZAAQ-AGIUHOORSA-N 276.380 2.185 10 10 CECE CNCc1ccc(N(C)C[C@H]2COCCCO2)cc1Cl 2153999920 GNEWAMAMRMZBTO-AWEZNQCLSA-N 298.814 2.301 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCOC[C@@H]2C)c1 278555457 OVWIJGXDULEESA-MJVIPROJSA-N 265.353 2.476 10 10 CECE CCOC(=O)C1=NN(c2ccc(CC)cc2)C(=O)[C@H]1C 2154698500 AFKQWLJWGSGNHQ-JTQLQIEISA-N 274.320 2.151 10 10 CECE COc1ccc([C@@H](N)c2ccc3c(c2)CCN3C)cn1 2154684062 DRIVXSIMKWKIOU-INIZCTEOSA-N 269.348 2.131 10 10 CECE CS(=O)(=O)[C@@H]1CCC[C@H](Nc2ccccc2N)C1 2028730714 FNZSFTDAMVYYHW-WDEREUQCSA-N 268.382 2.037 10 10 CECE NCc1ccc(N2CCC[C@@H](C3OCCO3)C2)c(F)c1F 2029144831 NUKABRZFLMLMEJ-LLVKDONJSA-N 298.333 2.013 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)[C@@H]1CCSC1 2031154239 OZOYDEIJFWKLIR-HONMWMINSA-N 267.394 2.157 10 10 CECE CCCn1nncc1CN(C)c1ccc(CO)cc1Cl 2156487336 GMQKTDDMHZQAQW-UHFFFAOYSA-N 294.786 2.470 10 10 CECE C[C@@H](N)c1ccc(N2CCOCC[C@H]2C)c(F)c1 2031628865 ZHZQXSWFYQJTFR-GHMZBOCLSA-N 252.333 2.461 10 10 CECE CO[C@@H]1CCN(c2ccc(CN)cc2F)C[C@@H]1C 2031977354 KFDHCBMDQUBBBV-IINYFYTJSA-N 252.333 2.146 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)CC2CCC2)cc1 61455257 JHOOIPQSWMUSAP-INIZCTEOSA-N 261.413 2.484 10 10 CECE CCc1nocc1CNCc1cccc(F)c1O 2035202982 UMOOBIKYEROFJR-UHFFFAOYSA-N 250.273 2.372 10 10 CECE N[C@H](c1ccccc1O)C1(O)CC(C(F)(F)F)C1 2035698772 YVQVXQCXHONNJK-DCKZXCDOSA-N 261.243 2.095 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCN2CCCCCC2)C1 2037533518 KFQDFGWSPJWVJV-ZDUSSCGKSA-N 251.378 2.495 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)C[C@H]1CCN(C)C1 300443550 XBTOWJNVNNMAEJ-RYUDHWBXSA-N 264.369 2.042 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@H](CO)C2)cc1C 700385320 ZTNJXUSEKHJHDD-WFASDCNBSA-N 262.397 2.169 10 10 CECE C[C@H](O)[C@@H](C)NCc1cccc(Br)c1O 309033951 GWBVUUFWRLJTLW-SFYZADRCSA-N 274.158 2.014 10 10 CECE CO[C@]1(C)CCN(c2ccc([C@@H](C)N)c(O)c2)C1 311167865 RIUGWSDQQPDHFA-QMTHXVAHSA-N 250.342 2.027 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H]2NCC[C@H]2C1 312110933 YYDOJKLNQABDGC-UHIISALHSA-N 264.344 2.276 10 10 CECE Cc1cc(C(=O)N(C)[C@@H](C)c2ccccc2O)nn1C 312173733 WMDACRORYYRCHZ-NSHDSACASA-N 273.336 2.267 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H]1C[C@H]2CC[C@H]1C2 313515307 LJAYRDXIJJZDQQ-YFKTTZPYSA-N 266.345 2.254 10 10 CECE CO[C@H](C(=O)N1CCC[C@H](N=[N+]=[N-])C1)C1CCC1 701403807 UNAFKPKOTXRQQA-QWRGUYRKSA-N 252.318 2.103 10 10 CECE COc1cccc(O)c1CN1CCC[C@]2(C)COC[C@H]12 2160721700 BWWGDGBMECMEAQ-JKSUJKDBSA-N 277.364 2.402 10 10 CECE Cc1ccc([C@H](C)NC[C@]2(CO)CCCOC2)c(O)c1 700934682 KSXMAOOCOBYBMO-BBRMVZONSA-N 279.380 2.140 10 10 CECE Cc1cc(N2CCS[C@@H]3COCC[C@H]32)ccc1CCN 2170505999 PJDGDHHJABAJCL-HZPDHXFCSA-N 292.448 2.207 10 10 CECE CCCNCc1cc(F)c(N2CC=C[C@@H]2CO)c(F)c1 2176341911 FPIVACCGMDPKMM-GFCCVEGCSA-N 282.334 2.202 10 10 CECE C[C@@H]1CC[C@@H](NCc2cc3c(cc2O)OCO3)CS1 689563425 WCFNQPGBTVWXBQ-MWLCHTKSSA-N 281.377 2.495 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](O)CC2)c(F)c1 378798135 RSNBGRWYRXVJOE-ZYHUDNBSSA-N 252.333 2.197 10 10 CECE Nc1ccc(OCCCN2CCC[C@H]3COC[C@@H]32)cc1 690377244 TWIJLDUQSGGXDJ-BBRMVZONSA-N 276.380 2.149 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](CC(N)=O)C2)c(Cl)c1 690712027 YWGBYSWPQRSPNA-NXEZZACHSA-N 282.771 2.095 10 10 CECE C[C@@H]1C[C@H](N)CCN1Cc1ccc(Br)cc1O 691488601 RJDKEHASLVMDRU-BXKDBHETSA-N 299.212 2.466 10 10 CECE CN(C)c1ccc([C@@]2(C)CNC(=N)N2C2CCC2)cc1 712349607 ZNPGFIDFONSABS-MRXNPFEDSA-N 272.396 2.360 10 10 CECE O=C(O)[C@@H]1CC(F)(F)CN1Cc1cc(Cl)ccc1O 713600261 CZAPLMZAPCXBAE-VIFPVBQESA-N 291.681 2.340 10 10 CECE CC(C)NCc1ccc(N2CCN3CC[C@H]2C3)c(F)c1 381680495 JPMGZNBWYPSHDZ-AWEZNQCLSA-N 277.387 2.218 10 10 CECE COCCNCc1ccc(N2C[C@@H]3[C@H](C2)C3(F)F)cc1 715493372 BRTSZRQABHXISX-OKILXGFUSA-N 282.334 2.124 10 10 CECE CCOC1([C@H](N)c2ccc(N(C)C)cc2)CCOCC1 2163071341 NVJOSRRPOQCKQS-OAHLLOKOSA-N 278.396 2.338 10 10 CECE CN1CCCc2cc([C@@]3(O)CCN(C)C3(C)C)ccc21 2163097168 LQMSMMCYBZYQBR-KRWDZBQOSA-N 274.408 2.371 10 10 CECE N[C@@H]1CN(Cc2ccccc2O)CC[C@@H]1C(F)(F)F 717091494 LBXXKNPNABLBFF-WDEREUQCSA-N 274.286 2.104 10 10 CECE C[C@@H](N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N)C1(C)CC1 385441633 RHRXJIGOSXHBJT-QMTHXVAHSA-N 273.380 2.288 10 10 CECE OCc1ccc(N2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1Cl 718311534 UAGBDMCJJJZGTH-AYRXBEOTSA-N 279.767 2.446 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@@H](O)C2)cc1Cl 388009593 CGUGAYJHODOXHI-RBZYPMLTSA-N 268.788 2.437 10 10 CECE C[C@@H]1CN(C)C[C@H]1NCc1cccc(Br)c1O 722270025 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2.029 10 10 CECE C[C@@H](F)CN(C)c1ccc(OCCN(C)C)cc1 2075248654 DQNXVWSDJUGJKR-GFCCVEGCSA-N 254.349 2.421 10 10 CECE OCc1cc(F)c(N2[C@H]3CC[C@@H]2[C@H]2CC[C@H]3O2)c(F)c1 2198645705 KAZZQMWPHRWFKF-XJFOESAGSA-N 281.302 2.356 10 10 CECE Nc1ccc(OC[C@@H]2CNC[C@@H]2C(F)(F)F)cc1 2078165724 QADDJEVNVUXWOU-KWQFWETISA-N 260.259 2.046 10 10 CECE CO[C@@H]1C[C@@H](CNCCc2ccc(N)cc2)C1(C)C 2100397629 RWYFICFQBXBGLP-DZGCQCFKSA-N 262.397 2.462 10 10 CECE COc1cccc(O)c1CN1CC(CC(C)(C)CN)C1 2199519273 CJYIKPSYQNQNMM-UHFFFAOYSA-N 278.396 2.208 10 10 CECE Oc1ccc(CNCc2ncoc2C2CC2)c(O)c1 2104111966 TZIOZRIICLIAGR-UHFFFAOYSA-N 260.293 2.253 10 10 CECE NC[C@@H]1C[C@H](F)CN1c1ccc(OC2CCC2)cc1 2106354617 UNPNBZNCMJWUIG-AAEUAGOBSA-N 264.344 2.493 10 10 CECE CCC[C@](CSc1nccs1)(NC1CC1)C(N)=O 2086567319 CGAARSIIUQJQMU-GFCCVEGCSA-N 285.438 2.011 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H]2CNCCC2(F)F)cc1 2106797998 GONGJDHYZIDRQL-CHWSQXEVSA-N 270.323 2.031 10 10 CECE CN1CCCc2cc([C@H](O)[C@](C)(N)C3CC3)ccc21 2106823307 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10 10 CECE CCCNCc1ccc(N2CC(N3CCCC3)C2)cc1 697756986 VJCYUEAFAJGGIO-UHFFFAOYSA-N 273.424 2.471 10 10 CECE CC[C@@H]1COC[C@H]1N[C@@H](C)c1c(O)cccc1O 699524424 HESFDPFQHURWFY-HBNTYKKESA-N 251.326 2.173 10 10 CECE CN(C(=O)/C=C/c1cnc2ccccc2n1)c1cnn(C)c1 173197059 RFYUZZRINSZGSO-BQYQJAHWSA-N 293.330 2.040 10 10 CECE CN(Cc1nncs1)c1ccc(CN)cc1Cl 2247601261 PIWSEWJFGJADCJ-UHFFFAOYSA-N 268.773 2.287 10 10 CECE O=C(O)[C@@H]1C[C@]12CC[C@@H]2NCc1c(O)cccc1Cl 2115877442 JQEOZWSVTSOGKM-DUFXMDAXSA-N 281.739 2.389 10 10 CECE CNCc1ccc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)c(Cl)c1 2117679888 DKMFEHZSXBPACO-AVGNSLFASA-N 280.799 2.124 10 10 CECE CCc1cc(CNCc2ccc3c(c2)CCO3)on1 1655691106 XPUATDUMSTWUEX-UHFFFAOYSA-N 258.321 2.462 10 10 CECE N[C@@H]1CCc2cc(N3[C@H]4CC[C@H]3CC(O)C4)ccc21 2128311797 ZOMIKWTWOPYZAY-HEHGZKQESA-N 258.365 2.125 10 10 CECE CCO[C@H]1CC[C@H](CNCc2cccc(O)c2O)C1 2118255092 COIPDYKONLIHFL-AAEUAGOBSA-N 265.353 2.393 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CC[C@H]2CCC[C@@H]2C1 2128300855 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263.301 2.400 10 10 CECE COc1nsc(OC)c1[C@H](O)c1ccc(N(C)C)cc1 2144252977 VXVYETJIUNFKRV-GFCCVEGCSA-N 294.376 2.308 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H](C)CNC(=O)OC(C)(C)C 1887717290 IIOPANHUMWPEDX-SNVBAGLBSA-N 299.375 2.306 10 10 CECE Oc1cccc(F)c1CN1CC[C@@H]([C@@H]2CCOC2)C1 1964587210 GCBUBAVJLGKEAM-VXGBXAGGSA-N 265.328 2.390 10 10 CECE CC(C)OC(C)(C)CNCc1cc2c(cc1O)OCO2 1964607034 RUWDMXKSEZDMFV-UHFFFAOYSA-N 281.352 2.414 10 10 CECE OCC[C@H]1CCC[C@@H]1NCc1c(O)cccc1F 1964605251 GCFNZTYXODJTEZ-MFKMUULPSA-N 253.317 2.172 10 10 CECE CC(=O)C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 1951515671 CFILSZAQAVPCJO-JTQLQIEISA-N 257.330 2.084 10 10 CECE O=S(=O)(NCc1ccccc1O)[C@@H]1[C@H]2CCCC[C@H]21 1965758960 QJUVHSZXLNCXTM-IMRBUKKESA-N 281.377 2.000 10 10 CECE Nc1ccc(CCN=c2ccnc(C3CCC3)[nH]2)cc1 2145056359 ZORPTPFXWUXLMF-UHFFFAOYSA-N 268.364 2.403 10 10 CECE Nc1ccc(CNC(=O)[C@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 1966805970 DWUMJSNBZNATJB-WLLOZRIZSA-N 266.291 2.176 10 10 CECE 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CCNCc1ccc(N2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1 124052314 BNBSCYNKNUAGSM-IMJJTQAJSA-N 260.381 2.003 10 10 CECE C[C@@H]1CN(Cc2ccc(F)cc2O)CC[C@@H]1N(C)C 2139789798 FELCWYFHCWLCRN-RISCZKNCSA-N 266.360 2.303 10 10 CECE COc1cc(N(C)C[C@@]2(C)CCOC2)ccc1CO 2139684633 LUKQONHLWBISOO-OAHLLOKOSA-N 265.353 2.050 10 10 CECE CCN[C@@H](C)c1ccc2c(c1)CCN2Cc1ncnn1C 162183804 GKSVAKQPQJOSBM-LBPRGKRZSA-N 285.395 2.048 10 10 CECE Nc1ccc(CCC(=O)N(CC(=O)O)C2CCCC2)cc1 158138349 GCDGYUGGHPONKZ-UHFFFAOYSA-N 290.363 2.057 10 10 CECE CCNCc1ccc(OC)c(CN(C)[C@H]2CCO[C@@H]2C)c1 158737318 YIFKMDSWVCFGSQ-CJNGLKHVSA-N 292.423 2.414 10 10 CECE CNCc1ccc(N2CCC[C@@H](CO)C2)c(Cl)c1 163977253 WLYONAVVFQZMOL-GFCCVEGCSA-N 268.788 2.268 10 10 CECE CCNCc1ccc(N(CC)CCCO)c(F)c1 165258597 JPPSCBDUMUWQBR-UHFFFAOYSA-N 254.349 2.144 10 10 CECE CCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])o2)SC1=S 2697649 CLWLYALISAAAPE-ALCCZGGFSA-N 284.318 2.409 10 10 CECE CC(C)OCCN(C)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 157286164 SXECLRYJRGAHQV-CYBMUJFWSA-N 297.786 2.153 10 10 CECE CCn1nccc1CN1CCc2cc(OC)ccc21 156624548 QVBBCXSZKRVNSA-UHFFFAOYSA-N 257.337 2.474 10 10 CECE Nc1ccc(CC(=O)Nc2c(O)cccc2[N+](=O)[O-])cc1 232400742 LGRSPFNMXCGNPT-UHFFFAOYSA-N 287.275 2.064 10 10 CECE CC(=O)N1CCc2cc(C(=O)Nc3ccc(N)cc3)ccc21 236592276 RAQHBENMJJYUBW-UHFFFAOYSA-N 295.342 2.430 10 10 CECE CCN(Cc1cc(F)ccc1O)C[C@H]1CCCCN1 233485638 DGKRFWKYEAXEJA-CQSZACIVSA-N 266.360 2.495 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CCO[C@H]1C1CC1 234611031 TWPYLNIHIIYQGM-JSGCOSHPSA-N 276.336 2.035 10 10 CECE COC(C)(C)CCO[C@H](C)C(=O)Nc1ccc(N)cc1 234690515 AQMPODKQDVMOCQ-LLVKDONJSA-N 280.368 2.428 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1C[C@H]2CCC[C@H]1C2 2142366806 PZIMZVWAAZKSDD-OUJBWJOFSA-N 259.353 2.358 10 10 CECE COc1ccc(N2CCNC[C@@H]2CC(F)F)cc1C 2141637157 WMWXXLGPDPKHNQ-LBPRGKRZSA-N 270.323 2.437 10 10 CECE CN(CC1(O)CCCC1)c1ccc(CN)c(F)c1F 234262610 QDZICIHXVHJBCJ-UHFFFAOYSA-N 270.323 2.165 10 10 CECE CN1CCC(NCc2ccc(Cl)cc2O)CC1 1942491435 KUBZDRPTTRPCNL-UHFFFAOYSA-N 254.761 2.229 10 10 CECE 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COc1ccccc1NC[C@@H](O)COC1CCCC1 37874544 KOSNZSPZHKAZQJ-GFCCVEGCSA-N 265.353 2.427 10 10 CECE CCCN[C@H](C)c1cnc(Sc2nc[nH]n2)s1 1997406098 TUTPFOJMARDDAV-SSDOTTSWSA-N 269.399 2.473 10 10 CECE COc1ccc(O)c(C(=O)N(C)c2ccc(N)cc2)c1 43327721 CJSCMVRYSDKKCX-UHFFFAOYSA-N 272.304 2.260 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@@]1(C)CCOC1 2006845288 YHUSYOMWQDNGDD-ZDUSSCGKSA-N 255.745 2.448 10 10 CECE CC(=O)c1ccc(O)c(CN2[C@H]3CC[C@@H]2C[C@H](O)C3)c1 2154911936 UCJAGRMJZLOLRQ-FICVDOATSA-N 275.348 2.083 10 10 CECE CNCc1ccc(N2CCN(CC(C)C)CC2)c(C)c1 55080246 GIVGWFGGOHMBFY-UHFFFAOYSA-N 275.440 2.492 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3C(CO)[C@@H]3C2)cc1Cl 2030271990 DHLGBOVVNGSCDN-XXILOJSOSA-N 267.756 2.068 10 10 CECE CCCOC1CN(c2ccc([C@H](C)O)cc2F)C1 2040859442 BJQOKCOJISCOOX-JTQLQIEISA-N 253.317 2.494 10 10 CECE Nc1ccc(CCN2CC([C@@H]3CC3(F)F)C2)cc1 2036151167 CLPFTQOEEMYYAE-ZDUSSCGKSA-N 252.308 2.398 10 10 CECE CN(C[C@@H]1CC[C@@H]2C[C@@H]21)c1ccc2c(c1)NC(=O)[C@H]2O 2157961333 RKIDHETUSIPTNX-BILRFKGYSA-N 272.348 2.154 10 10 CECE C[C@H]1C[C@H](O)CN(c2ccc(CN)c(Cl)c2)C1 401684150 BAXMXBFIDPFTQJ-CABZTGNLSA-N 254.761 2.006 10 10 CECE CC(C)C[C@H]1CCN(S(=O)(=O)Cc2ccc(N)cc2)C1 307804262 JZJQKXCJPMLHEM-CQSZACIVSA-N 296.436 2.467 10 10 CECE [N-]=[N+]=NCCN1C[C@H]2C[C@H]1CN2Cc1ccccc1 309861476 DJKBQWLBFUWHME-UONOGXRCSA-N 257.341 2.255 10 10 CECE CC(C)SCCNC(=O)Cc1ccc(N)cc1 310419793 OADTXBOYRSKIDR-UHFFFAOYSA-N 252.383 2.069 10 10 CECE C[C@@H]1CCCC[C@H]1S(=O)(=O)NCc1ccc(N)cc1 407465835 VNGUQSWVPNNWEU-BXUZGUMPSA-N 282.409 2.267 10 10 CECE CNC1CCN([C@H](C)c2cc(OC)ccc2O)CC1 311968960 ATTAOQRHLDPNGX-LLVKDONJSA-N 264.369 2.146 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)CCN 312722107 FTSSOFNXABDHEH-UHFFFAOYSA-N 277.412 2.086 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1occc1N 313189782 XENHGLSOUQKMRX-VIFPVBQESA-N 260.293 2.401 10 10 CECE Nc1ccc(NC(=O)CCCN2CC(CCF)C2)cc1 2159106582 FKRWRBDKTWMTPV-UHFFFAOYSA-N 279.359 2.279 10 10 CECE Nc1ccc(Cc2nc(-c3cncc(F)c3)no2)cc1 700325484 WFWKLIUQDGWQPZ-UHFFFAOYSA-N 270.267 2.444 10 10 CECE CO[C@H]1CC[C@H](NCc2cc3c(cc2O)OCO3)CC1 2160666990 FIFAOUDWTUREBB-HAQNSBGRSA-N 279.336 2.168 10 10 CECE C[C@@H](N[C@H]1CCOC1(C)C)c1c(O)cccc1O 328207799 IUXDYJRBFPWNAU-SKDRFNHKSA-N 251.326 2.316 10 10 CECE COc1ccc([C@H](C)NC[C@@H](CO)C(F)(F)F)c(O)c1 2161575793 QAKMTJBYYYFPCJ-IUCAKERBSA-N 293.285 2.222 10 10 CECE O=C(O)[C@H]1CCC[C@@H](NCc2ccc3c(c2)CCO3)C1 86787502 WHAVRKQYZOIVSV-UONOGXRCSA-N 275.348 2.355 10 10 CECE CNCC[C@@H]1CCCCN1c1ccc2c(c1)OCCO2 2162624775 UYHXSMCHBNMMNC-ZDUSSCGKSA-N 276.380 2.426 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@@H](O)C[C@H]2C3)cc1C 709848842 HSKOJZMPAIBDBF-KBRIMQKVSA-N 274.408 2.454 10 10 CECE CN1CCCc2cc([C@@H](O)c3cncc(N)c3)ccc21 2163109194 WWOBTDNVZZAEOJ-MRXNPFEDSA-N 269.348 2.128 10 10 CECE CCCOc1cc(N(C)CCn2cccn2)ccc1N 707407686 DJBSAAHTEKRKCP-UHFFFAOYSA-N 274.368 2.391 10 10 CECE C[C@H](N[C@H](C)c1cn(C)cn1)c1ccc(O)cc1O 710132264 ZSPRJVLZRVJNFD-VHSXEESVSA-N 261.325 2.243 10 10 CECE COC1(OC)CC[C@@H]1NCc1c(O)cccc1Cl 710992067 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CCNC(=O)c1cc(CC)nn1Cc1ccc(C)cc1O 2070143945 AKDWALQFTFCDHZ-UHFFFAOYSA-N 287.363 2.258 10 10 CECE CCCNCc1ccc(N2CC=CC[C@@H]2CO)c(F)c1 2176345859 ZUUOCUZQBARKFY-CQSZACIVSA-N 278.371 2.453 10 10 CECE CC(C)NCc1cc(F)c(N2CC=C[C@@H]2CO)c(F)c1 2176346400 ZEJNDYHZVLSUKT-GFCCVEGCSA-N 282.334 2.200 10 10 CECE N[C@@H]1CCCN(Cc2c(O)cccc2Cl)CC1 1205110324 SERHOYPVGSGJKQ-SNVBAGLBSA-N 254.761 2.359 10 10 CECE NCc1cc(F)c(N2CCC[C@H]3COCC[C@@H]32)c(F)c1 2170284288 SMFYHTLGNSSSOG-FZMZJTMJSA-N 282.334 2.429 10 10 CECE COc1ccc(N(C)[C@]2(CN)C[C@@H]3CC[C@H](C2)O3)cc1 2181308157 DVNBESOSFDXXQF-ZSHCYNCHSA-N 276.380 2.170 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]3CC[C@H](C2)O3)C1 2181341374 PIBGPQOEWRWWPU-ZDEQEGDKSA-N 278.356 2.493 10 10 CECE Nc1ccc(OCCN2CCC3(CCC2=O)CC3)cc1 2171348246 MAEHXJMLYSPCLI-UHFFFAOYSA-N 274.364 2.440 10 10 CECE CN(C(=O)c1cc(O)c(O)c(O)c1)[C@@H]1C[C@H]2CC[C@H]1C2 2188875630 SHRAKPLONXQBFW-ATZCPNFKSA-N 277.320 2.064 10 10 CECE COC[C@](C)(CN(C)[C@@H](C)c1c(O)cccc1O)OC 2198138174 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2.285 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCSC[C@H]1CCO 2232028086 MIYSQXXLPCWMNG-GXTWGEPZSA-N 280.437 2.319 10 10 CECE Cc1cc([C@H](C)N)ccc1N1[C@H]2CC[C@H]1[C@@H](CO)C2 2232033830 QSRROICXRQGUNP-AEIGPULVSA-N 260.381 2.364 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]3C2)cc1 2232878964 HIEVKNUGMATBDY-XIRDDKMYSA-N 274.408 2.392 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@@H](C)C[S@@](C)=O 2223933252 PYAPRYKCUGPIME-OAVHHTNSSA-N 268.426 2.218 10 10 CECE C[C@H](CC(=O)O)CC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2234166916 ROTJPVPDBBICIM-QWRGUYRKSA-N 282.344 2.426 10 10 CECE COCCn1cccc1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2234168189 HCHIYZJDLIDLIF-MNOVXSKESA-N 277.328 2.096 10 10 CECE CC(C)NCc1ccc(N2C[C@@H](O)C[C@H](F)C2)c(F)c1 2234679785 QZFCWKZWIVGUNY-STQMWFEESA-N 284.350 2.233 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2CO[C@H]3C[C@@H]2C3)c(O)c1 2234713957 GUGHVMXXNMUWJJ-CIQGVGRVSA-N 277.364 2.476 10 10 CECE COc1cc(Cl)cc(CN2CCCN[C@H](C)C2)c1O 2224767473 CUKQHHGPDPROHV-SNVBAGLBSA-N 284.787 2.238 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1OC[C@H]2CCC[C@@H]21 2224951699 ZPCQZPXLGJVVIS-NOOOWODRSA-N 264.329 2.103 10 10 CECE OC[C@H]1CCC2(CC2)CN1c1ccc2c(c1)OCCO2 2235096519 LXYGBEYAQAAZDV-CYBMUJFWSA-N 275.348 2.199 10 10 CECE OC[C@H]1CC2(CC2)CN1c1ccc2c(c1)OC(F)(F)O2 2235066433 ZHOVLMGFJGDKML-SNVBAGLBSA-N 283.274 2.359 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H](O)[C@@H]3CC3(F)F)ccc21 2235309810 DDYWKABFPGTQMN-UBHSHLNASA-N 282.334 2.085 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@H]1C[C@]12CCCOC2 2225792991 RROMYGZFSVGGFN-XZUYRWCXSA-N 264.329 2.151 10 10 CECE Cc1cccnc1CC(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2225796867 AXVGZXNJOLWGLS-QWRGUYRKSA-N 259.313 2.280 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)[C@H](O)c1ccccc1 2225793821 AAQDKNYWPQARMY-IJLUTSLNSA-N 260.297 2.068 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)C(F)(F)[C@H]1CCOC1 2225791688 GRAKVFJIZFFHAT-XHNCKOQMSA-N 274.271 2.006 10 10 CECE COc1ccc(N2CC[C@H](c3nncs3)C2)c(CO)c1 2235958008 IJKYXVXXPADBFO-JTQLQIEISA-N 291.376 2.033 10 10 CECE COc1ccc(N2CCC[C@@H]3OCC[C@H]3C2)c(CN)c1 2235953443 AXQREVKJJNJVOZ-LRDDRELGSA-N 276.380 2.159 10 10 CECE COC[C@]1(C)CCN(c2ccc(OC)cc2CCN)C1 2235972380 ANBXISJXZAZIMJ-MRXNPFEDSA-N 278.396 2.059 10 10 CECE COc1ccc(N2CC[C@](O)(C(C)(C)C)C2)c(C=O)c1 2235989190 SIRSZBZSIZOTLZ-MRXNPFEDSA-N 277.364 2.495 10 10 CECE C[C@H](N)c1ccc(N(C)CC23COCC(C2)C3)cc1O 2236426307 SWLPFRPWAYGDFN-FZWSLVFFSA-N 276.380 2.275 10 10 CECE COc1ccc(N2CCC[C@@H](CO)CC2)cc1OC 2226797706 FUWVVIZFEJTKQN-GFCCVEGCSA-N 265.353 2.303 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@]4(C3)C[C@@H](O)C4)ccc2O1 2226703165 KPUPDBHJBJYROQ-XFJVYGCCSA-N 259.349 2.361 10 10 CECE OC[C@H]1CCCN(c2ccc3c(c2)OC(F)(F)O3)C1 2226700118 KIQIZDGVZNKXEA-VIFPVBQESA-N 271.263 2.217 10 10 CECE C[C@@H](O)[C@H]1CCCN(c2ccc3c(c2)OCCO3)C1 2226771425 WBQKGWKEVCTKNC-NEPJUHHUSA-N 263.337 2.055 10 10 CECE C[C@H](O)C[C@H]1CCCN1c1ccc2c(c1)COCC2 2226713467 OGRDJRKZMMYFGJ-SWLSCSKDSA-N 261.365 2.499 10 10 CECE COc1ccc(N2C[C@H]3CCC[C@]3(CO)C2)cc1F 2226795700 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10 10 CECE CN[C@H](C)c1cc(F)c(N2CC[C@]3(O)C[C@H]3C2)c(F)c1 2280015105 AVSXGMKCIKSGIU-VPJDZLOFSA-N 282.334 2.206 10 10 CECE COC[C@@]1(C)COCCN1c1ccc([C@@H](C)O)cc1C 2240840668 WQQLQHPANGEUQI-CJNGLKHVSA-N 279.380 2.290 10 10 CECE CCN(CC)C(=O)NCc1cnc(SC)s1 2243812044 SYUXSFVZKSIMRB-UHFFFAOYSA-N 259.400 2.416 10 10 CECE CSc1ncc(CN[C@@H]2C[C@H]3CO[C@H]2C3)s1 2244337112 KASCWWXLJKUKRV-QNSHHTMESA-N 256.396 2.132 10 10 CECE CSc1ncc(CNC(=O)CC(C)(C)[C@@H](C)N)s1 2257089125 YVVCOGXJEWIZJZ-MRVPVSSYSA-N 287.454 2.245 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](O)[C@H]2C)c(F)c1 2260452312 QJPQSFZWQJKMRI-RBZYPMLTSA-N 252.333 2.066 10 10 CECE CC1CC([C@@H](O)c2ccc(N3CCNCC3)cc2)C1 2270556837 LNUYLGRNMIHBJE-PXCJXSSVSA-N 260.381 2.176 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c(Cl)c1 2270683011 GBODZGRAWNZKHZ-APAOZMKASA-N 280.799 2.437 10 10 CECE CCCN[C@@H](CNC)c1ccc2c(c1)CCN2CC 2271954345 WYSCGLKIYRZCIP-HNNXBMFYSA-N 261.413 2.329 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2cccnc2O)cc1 2272835508 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COc1ccc(O)c(CN2CCCC[C@@H]2CCO)c1 183502877 OWIJSMVVVYMJOR-CYBMUJFWSA-N 265.353 2.138 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H]2CCO[C@@H]2C)c1 226437330 BPCQPYGYXPKMLB-GIPNMCIBSA-N 251.326 2.229 10 10 CECE C[C@@H](O)CCCNC(=O)/C=C/c1ccc(N(C)C)cc1 228649121 DZQGGVQXIVEMJO-RUNBWSAHSA-N 276.380 2.043 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CCNCC1(C)C 88138514 MRMVQIPKMMBNMU-ZDUSSCGKSA-N 261.413 2.497 10 10 CECE C[C@@H]1CC(O)C[C@@H](C)N1Cc1ccc(N(C)C)cc1 193570434 BZCXGRFCWDDKLE-CHWSQXEVSA-N 262.397 2.486 10 10 CECE CN1CCNC[C@@H]1c1cc(Cl)cc(Cl)c1O 83443001 MKPTVYXPHMQHRW-SNVBAGLBSA-N 261.152 2.275 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CCCO2)c(F)c1 42465070 FABGLYNJGUXHGL-LBPRGKRZSA-N 252.333 2.160 10 10 CECE C[C@@H]1CN([C@@H](C)c2ccc(F)cc2O)C[C@H]1C(=O)O 227818540 PPPMSMLACLJTGJ-VDDIYKPWSA-N 267.300 2.245 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1ncc(Cl)s1 223091968 BYTCQXCVXCXADY-SSDOTTSWSA-N 289.748 2.301 10 10 CECE CC1(C)OCCC[C@@H]1C(=O)NCc1ccccc1O 2130468329 TYUWYHSUBDXSBA-GFCCVEGCSA-N 263.337 2.214 10 10 CECE CCCN1C(=O)N/C(=C\c2ccc(N(C)C)cc2)C1=O 96838630 GFAOZZHNTUGNMU-RAXLEYEMSA-N 273.336 2.055 10 10 CECE CCc1ccc([C@@H](NCCCN=[N+]=[N-])C(N)=O)cc1 90260396 HGMIUNATTQZRKA-GFCCVEGCSA-N 261.329 2.065 10 10 CECE CCCN(CCC(=O)NC(C)C)Cc1ccc(N)cc1 54048592 RAQGVTHPLBOBSN-UHFFFAOYSA-N 277.412 2.396 10 10 CECE COC[C@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1952545748 OSAQPJCESTXZKU-ZDUSSCGKSA-N 280.368 2.351 10 10 CECE C[C@@H](N[C@H]1CCc2nc[nH]c2C1)c1ccccc1O 377409038 HIJMHBPETGSBGM-MNOVXSKESA-N 257.337 2.323 10 10 CECE CCN1CCC(N(C)c2ccc([C@H](C)N)c(O)c2)CC1 93671188 MRJDKDGYLLVMJZ-LBPRGKRZSA-N 277.412 2.332 10 10 CECE CO[C@H]([C@@H]1CCCOC1)[C@H](N)c1ccc(N(C)C)cc1 2163071666 QIGPIYWHQMMXGB-FVQBIDKESA-N 278.396 2.194 10 10 CECE CN(C)c1ccc([C@@H](N)C[C@@H]2CN3CCC2CC3)cc1 2163072377 ADIQPYVOCWVJHK-WBVHZDCISA-N 273.424 2.484 10 10 CECE Cc1sc(CCN)nc1[C@@H](O)c1ccc(N(C)C)cc1 2163077671 XJHVDFFUHUUIRV-HNNXBMFYSA-N 291.420 2.100 10 10 CECE Cn1ccc(C[C@@H](O)c2ccc(N3CCCC3)cc2)n1 2163094648 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Oc1cccc(Cl)c1CN1CC[C@H](Cn2ccnn2)C1 826846399 UNNQAZGECMLCIA-NSHDSACASA-N 292.770 2.159 10 10 CECE Nc1ccc(CS(=O)(=O)NCCC2CC=CC2)cc1 724193074 HVYDCWVFALDTJZ-UHFFFAOYSA-N 280.393 2.045 10 10 CECE COC(=O)[C@H]1CCN[C@H](c2ccc(N(C)C)c(F)c2)C1 1952536130 DVLUNFQYZVSJFJ-AAEUAGOBSA-N 280.343 2.105 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@H](N)[C@H](C(F)(F)F)C1 720869844 GAUPKRSUGSOXJJ-WHGOUJPWSA-N 292.276 2.414 10 10 CECE FC1(F)CN[C@@H](c2ccc(N3CCOCC3)cc2)C1 1952690566 HYWWXPGRKMXYDP-CYBMUJFWSA-N 268.307 2.193 10 10 CECE CCCCN(c1ccc2c(c1)N(C)C(=O)[C@@H]2N)C1CC1 131363224 IGGJGXOXFOCJDC-OAHLLOKOSA-N 273.380 2.432 10 10 CECE COC[C@](C)(NC(=O)OC(C)(C)C)c1cc(N)ccc1O 1952849065 CWIVSZHTFMVMAQ-HNNXBMFYSA-N 296.367 2.361 10 10 CECE CC(C)(C)OC(=O)N1CC(=O)C[C@@H]1c1cccc(N)c1O 1953014223 YPTGZDHZHVCJDN-GFCCVEGCSA-N 292.335 2.225 10 10 CECE CCN(C(=O)/C(C)=C/c1cccnc1)c1cnn(C)c1 848344861 PNHOYXQNFKROMS-XYOKQWHBSA-N 270.336 2.272 10 10 CECE Cc1cc(O)c(CNC[C@@]2(O)CCSC2)c(Cl)c1 840902674 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CO[C@@H](CNCc1cc(C)c(C)cc1O)[C@@H]1CCOC1 850343951 YKOCYOGEFYMXFM-CJNGLKHVSA-N 279.380 2.150 10 10 CECE CCCCN(CCO)c1ccc(CNC)c(C)c1 50583746 FQXINMIBNNGFDK-UHFFFAOYSA-N 250.386 2.313 10 10 CECE CCCCCN1CC(=O)N[C@@H]1c1ccc(F)c(F)c1O 864386621 GJFGTVDPGYAIAO-AWEZNQCLSA-N 284.306 2.291 10 10 CECE C[C@]1(C(=O)NCc2ccc3cccnc3c2O)CCCO1 862026908 COUJOAWFFMJXBC-MRXNPFEDSA-N 286.331 2.126 10 10 CECE CCOc1ccc(O)c(CN[C@H]2CC=C(C(=O)OC)C2)c1 862464689 GEUWQAZYSHCHET-ZDUSSCGKSA-N 291.347 2.142 10 10 CECE CCCCN(CC(N)=O)[C@H](C)c1ccc(OC)cc1O 132863713 ZZXALPWCUSNJRL-LLVKDONJSA-N 280.368 2.049 10 10 CECE CNC(=O)C1CCN([C@H](C)c2ccc(F)cc2O)CC1 133338192 KNKJGFSOUCUYTC-SNVBAGLBSA-N 280.343 2.050 10 10 CECE CCCC[C@H](N)c1nnc(-c2cccc(O)c2O)o1 83458812 ABZDYFSINBLLJZ-VIFPVBQESA-N 263.297 2.338 10 10 CECE Oc1ccc([C@@H]2NCCc3ccc(F)cc32)cc1O 83596021 KLXKSWFSTYSGFE-HNNXBMFYSA-N 259.280 2.472 10 10 CECE COc1cc([C@@H]2NCCc3cccc(O)c32)ccc1O 83593780 IHEOQAVSZSIUSS-INIZCTEOSA-N 271.316 2.342 10 10 CECE Cc1cc(O)ccc1[C@H]1NCCc2cc(O)c(O)cc21 83724490 GKYBLLLWGNNGMG-MRXNPFEDSA-N 271.316 2.347 10 10 CECE CC(=O)c1ccc(-n2nnnc2Cc2ccc(N)cc2)cc1 84888666 ZGEFFFXVDRFBNF-UHFFFAOYSA-N 293.330 2.038 10 10 CECE Nc1ccc(CC(=O)c2cc(Cl)cnc2N)cc1 166812899 CFRJUNFBZAMKPF-UHFFFAOYSA-N 261.712 2.325 10 10 CECE CC1(C)[C@H]2CNC[C@H]2CN1Cc1cc(F)cc(F)c1O 708494430 JHMMBTKGYDKLQD-JQWIXIFHSA-N 282.334 2.100 10 10 CECE C[C@H]1CN(c2ccc(CN)c(C(F)(F)F)c2)C[C@H]1CO 709374669 MLXZGAZLNVLPJZ-ONGXEEELSA-N 288.313 2.229 10 10 CECE CN(C[C@H]1CCC(C)(C)O1)C(=O)c1cccc(O)c1O 691893172 MBZBOXCTLVJKDK-SNVBAGLBSA-N 279.336 2.127 10 10 CECE CNC[C@H]1CCN([C@H](C)c2ccc(N(C)C)cc2)C1 71141753 LCCFFGMMMDCHNG-ZIAGYGMSSA-N 261.413 2.355 10 10 CECE Nc1ccc(OCCC(=O)NC2(C3CCC3)CC2)cc1 697391502 AGZRJCRZFVDAOO-UHFFFAOYSA-N 274.364 2.487 10 10 CECE Nc1ccc(Cc2nc([C@@H]3CSCCO3)no2)cc1 94501625 BHWPLLYXWYIORK-NSHDSACASA-N 277.349 2.047 10 10 CECE O=C(/C=C/c1ccco1)NCc1c(O)cccc1F 1156163778 FBVYKWRQAAOOJH-VOTSOKGWSA-N 261.252 2.454 10 10 CECE 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C[C@@H](c1cc(O)ccc1O)N1C[C@@H](CN)C(C)(C)C1 1913116416 CERATIJOSCNOGY-WDEREUQCSA-N 264.369 2.076 10 10 CECE O=C(CS[C@H]1CCC[C@@H](O)C1)c1ccc(O)c(O)c1 2133404890 KMZLJFDYYGWUOS-MNOVXSKESA-N 282.361 2.317 10 10 CECE COC[C@H]1C[C@@H]1CN1CCCc2cc(CN)ccc21 2133589365 LAOZSFOKEVCOHW-HUUCEWRRSA-N 260.381 2.180 10 10 CECE CCNCc1ccc(N2CCCC[C@H]2C(N)=O)cc1Cl 233520415 OKNGBDKHPVTKMF-AWEZNQCLSA-N 295.814 2.294 10 10 CECE CC[S@@](=O)(=NC(=O)Cc1ccc(N)cc1)C(C)C 1913863989 WUBRJGXWKFSEQR-SFHVURJKSA-N 268.382 2.234 10 10 CECE O=C(O)C=Cc1ccc(N2CCN3CC[C@H]2C3)cc1Cl 1911894576 STMSUBHBFOXUTJ-ZDUSSCGKSA-N 292.766 2.332 10 10 CECE Cn1cncc1CCCN1CCC[C@H](CN=[N+]=[N-])C1 1912148588 VKEIAAHNYSLUHV-GFCCVEGCSA-N 262.361 2.375 10 10 CECE CCN(C(=O)CN1CC[C@H](N=[N+]=[N-])C1)C1=CCCC1 1912150234 QROLCSXZWXTQAO-NSHDSACASA-N 263.345 2.287 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(-n3cccn3)cc2)C1 1912150502 UNZYYWOAAVNJSH-UHFFFAOYSA-N 268.280 2.007 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@@H]2COC3(CCCC3)O2)C1 1912163094 FLCUBBWKTBDNIM-NWDGAFQWSA-N 266.345 2.447 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)CC[C@@H]2CCOC2)CC1 1912183531 QIRHEAFWPHSJQU-SNVBAGLBSA-N 252.318 2.104 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2nccnc2Cl)C1 1912185333 OKJFHYCARQXEHA-MRVPVSSYSA-N 252.709 2.405 10 10 CECE CN(C)c1ncc(CN2CC[C@H](CN=[N+]=[N-])C2)s1 1912206358 JLCLLNPCRIXMOJ-SECBINFHSA-N 266.374 2.341 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(S(=O)(=O)C2(Cl)CC2)C1 1912207603 XTUVFWBMMBMWBM-SECBINFHSA-N 292.792 2.458 10 10 CECE NCc1ccc(N2CC3(C2)CC3(F)F)c(F)c1F 1914926008 MWDJOKAJBWYFTK-UHFFFAOYSA-N 260.234 2.269 10 10 CECE COC(=O)c1[nH]c(C)cc1NC(=O)c1cc(O)cs1 1443497622 RXTBWOXQRKLSDH-UHFFFAOYSA-N 280.305 2.129 10 10 CECE CN(Cc1cccc(F)c1)C(=O)Cc1ccc(O)c(O)c1 1289983364 ZOQIKTQERSRYRM-UHFFFAOYSA-N 289.306 2.438 10 10 CECE CNCc1ccc(N2CC3(CCOC3)C2)c(Cl)c1 1915839383 FQNNHSVLQXJNER-UHFFFAOYSA-N 266.772 2.286 10 10 CECE Cc1nc2ccccn2c1CNC(=O)c1cc(O)cs1 1456933619 FWNTXKBUNCLOEN-UHFFFAOYSA-N 287.344 2.340 10 10 CECE CCOc1cccc(CN(CC)[C@H]2CCCNC2)c1O 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10 10 CECE COC[C@@](C)(CN(C)Cc1cccc(C)c1O)OC 1894309346 XOSAMIAYGWZLQZ-OAHLLOKOSA-N 267.369 2.184 10 10 CECE Oc1c(Br)cc2c(c1[C@@H]1CCCN1)OCO2 258599417 QTXUIFUEHPVADW-ZETCQYMHSA-N 286.125 2.308 10 10 CECE CC(C)C(=O)N1CCN(Cc2ccc(N(C)C)cc2)CC1 264839335 JINYUUCENOAKQI-UHFFFAOYSA-N 289.423 2.053 10 10 CECE COc1cc(Cl)cc(CN2CCO[C@H]3C[C@@H]32)c1O 366563127 XHSHXXSBITUYPK-QWRGUYRKSA-N 269.728 2.027 10 10 CECE C[C@H](N)c1ccc(N2CCC(N3CCC3)CC2)cc1 700394371 LXNBLQJANVMFTG-ZDUSSCGKSA-N 259.397 2.381 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)[C@@H](C)OC)c1 276138369 NADAONSQBZDQHE-HBNTYKKESA-N 281.352 2.253 10 10 CECE Oc1c(Cl)cccc1CNCc1cn2c(n1)COCC2 2166145639 BFWMDCRESJIHTI-UHFFFAOYSA-N 293.754 2.062 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@](C)(O)C1CCC1 2163128937 YSXHPEZOODIOQV-IAGOWNOFSA-N 274.408 2.491 10 10 CECE CC[C@@H](CCOC)[C@@H](NN)c1ccc2c(c1)CCN2C 2163143805 OCKQBKYVRVFLEQ-BLLLJJGKSA-N 277.412 2.246 10 10 CECE COc1cc(N2CC(F)(F)C3(CC3)C2)ccc1CN 2277439706 QCKVVURONNKDKX-UHFFFAOYSA-N 268.307 2.389 10 10 CECE COc1ccc([C@@H](C)N[C@H]2C[C@@H](CN(C)C)C2)c(O)c1 2165837555 ZFRBSDDMJUCFRF-UPJWGTAASA-N 278.396 2.392 10 10 CECE COc1ccc(O)c(CNC(=O)C[C@@H](O)CC(C)(C)C)c1 813489218 SHQKFNLUWDJJOC-GFCCVEGCSA-N 295.379 2.204 10 10 CECE COc1ccc(CNCc2nn(C)c(C)c2Cl)c(O)c1 817409191 CXVKQAFYYXVRPB-UHFFFAOYSA-N 295.770 2.386 10 10 CECE COCC[C@@H](COC)NCc1cc(Cl)c(C)cc1O 825948873 LTUJQVYOTDLCIL-LBPRGKRZSA-N 287.787 2.495 10 10 CECE Cc1ncccc1CNCc1cc([N+](=O)[O-])ccc1O 728774444 BPXSCFXDFSTBLH-UHFFFAOYSA-N 273.292 2.294 10 10 CECE CNCc1ccc(N2CCCC[C@]2(C)CO)c(F)c1 722978981 CWOKJIJRULPOSJ-OAHLLOKOSA-N 266.360 2.286 10 10 CECE O=C(OCCC[C@@H]1CCOC1)c1cc(O)cs1 828841817 HRRDVLYTMBJLDG-SECBINFHSA-N 256.323 2.427 10 10 CECE CCC[C@@H](CCO)CNC(=O)/C=C\c1ccc(O)c(O)c1 588407415 CUBXJPRZAUTNEQ-VGVVRCBHSA-N 293.363 2.026 10 10 CECE CCCCNC(=S)NCc1c(O)cccc1F 905662706 YJRAHMLVFWOZSL-UHFFFAOYSA-N 256.346 2.296 10 10 CECE O=C(O)[C@@H]1CCC[C@H](NCc2ccc(F)cc2O)C1 1964687318 LQZAUCXLLFUOSD-SKDRFNHKSA-N 267.300 2.264 10 10 CECE COc1cc([C@H]2NCCCC2(F)F)cc(O)c1O 1952889523 GGOUJIWYIOZCFX-LLVKDONJSA-N 259.252 2.166 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N(C)C3CCCCC3)cc21 131338736 VOAOCXNSQPIZOK-OAHLLOKOSA-N 273.380 2.432 10 10 CECE CN(Cc1ccsc1)c1ccc2c(c1)N(C)C(=O)[C@H]2N 131345771 YIIODTPXFIQHAH-AWEZNQCLSA-N 287.388 2.361 10 10 CECE C[C@H]1CNCC[C@H]1NCc1cc(Cl)cc(F)c1O 841064880 VMOPNNGJTDHWOV-QPUJVOFHSA-N 272.751 2.272 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CCNC23CCCC3)c1 843127195 BKVZKINRLGGXRK-OAHLLOKOSA-N 260.381 2.465 10 10 CECE Cc1cc(C)c(O)c(CN2CC[C@@H](Nc3ncccn3)C2)c1 842614732 CSGBIBUDUACTHX-OAHLLOKOSA-N 298.390 2.485 10 10 CECE COc1ccc(CNCC(C)(C)[C@@]2(O)CCOC2)cc1C 842759571 XRKPXRJWJCTBTQ-QGZVFWFLSA-N 293.407 2.271 10 10 CECE CCc1cccc(CN[C@H](CC)[C@H](O)C(F)F)c1O 848916712 WZPWTFZLKMPMFP-YPMHNXCESA-N 273.323 2.449 10 10 CECE CCO[C@@H](CN[C@@H](C)c1cc(OC)ccc1O)CN(C)C 926958932 IPKLUTDXCPWPNN-JSGCOSHPSA-N 296.411 2.018 10 10 CECE Cc1ccc(OCc2csc(N(C)C)n2)c(N)n1 699258296 JBNXMSQOVKQXDN-UHFFFAOYSA-N 264.354 2.074 10 10 CECE Cc1cc(CO)cc(N2Cc3cccc(O)c3C2)n1 866117292 KCMZIWYBEDJEGG-UHFFFAOYSA-N 256.305 2.108 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=N)N[C@H]1C[C@H]1C 864459782 CEKYLSRKEYHOKS-RISCZKNCSA-N 260.385 2.083 10 10 CECE CC(C)(C)OC(=O)N1C[C@@H]2CN(CCN=[N+]=[N-])C[C@@]2(C)C1 1957244206 NSWPZODLFQAULM-FZMZJTMJSA-N 295.387 2.486 10 10 CECE Nc1ccc(Cn2nnc3cc(F)c(F)cc32)cc1 57837825 IUOANYWKTOTVDK-UHFFFAOYSA-N 260.247 2.340 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@H]3C[C@@H](O)C[C@H]2C3)c1O 879390056 RPSDZCDCBBBKDZ-LERXQTSPSA-N 293.338 2.079 10 10 CECE O=C(NCCCc1ccccn1)c1cc(O)cs1 772530956 MJGUCQHQAHIDJK-UHFFFAOYSA-N 262.334 2.211 10 10 CECE NCCCc1nc2cc(O)ccc2n1Cc1ccc(N)cc1 76004149 CTGBRYSKHHNPKQ-UHFFFAOYSA-N 296.374 2.264 10 10 CECE CC[C@@H]1CNc2cc(OC)c(OC)cc2N1CCOC 76972989 JIIVVUYGEKTTBS-LLVKDONJSA-N 280.368 2.361 10 10 CECE O=C(c1cc(O)cs1)N1CC[C@@H]([C@@H]2CCCO2)C1 899627250 GYLJIDHSLZWMNO-KOLCDFICSA-N 267.350 2.095 10 10 CECE Oc1cc2c(cc1O)[C@H](c1cccnc1Cl)NCC2 83621077 OZAKJFRIKUUINS-ZDUSSCGKSA-N 276.723 2.381 10 10 CECE COc1cc(OC)c(N2CCN[C@H](C)C2)cc1Cl 86129532 WPRQAGICOIYYKF-SECBINFHSA-N 270.760 2.155 10 10 CECE CC[C@@]1(C)CCN(C[C@@H](O)COc2ccc(N)cc2)C1 399455330 ZZKXAUXJFUCCMH-ZBFHGGJFSA-N 278.396 2.131 10 10 CECE [N-]=[N+]=NCCNC(=O)CSCCc1ccccc1 706393329 RCCZQVYLWSXAQL-UHFFFAOYSA-N 264.354 2.389 10 10 CECE CCCNCc1cc(F)c(N2CCC[C@H]2CO)c(F)c1 62711731 RBOTXUILGRDREG-LBPRGKRZSA-N 284.350 2.426 10 10 CECE O=C(c1cccc(O)c1O)N1CCC=C(c2ccccn2)C1 1141387174 HBAMMPKUUSAOJD-UHFFFAOYSA-N 296.326 2.422 10 10 CECE CCN1CC[C@@H](N(C)c2ccc([C@H](C)N)cc2F)C1 688568437 ITDMJIQCRYVCMS-WCQYABFASA-N 265.376 2.376 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H](C)[C@H]2CO)c(F)c1 688663023 PYQCATRJXIOWDX-ZIBATOQPSA-N 267.344 2.476 10 10 CECE C[C@H]1C[C@H](N(C)C(=O)Nc2ccc(N)cc2)CCO1 721440399 WTJHHGCKCLZJMZ-GXFFZTMASA-N 263.341 2.300 10 10 CECE CCOC(=O)[C@H](CC)N[C@@H](C)c1ccccc1O 879651095 HVPRPEQDYVEUCG-JQWIXIFHSA-N 251.326 2.385 10 10 CECE C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1cc(O)ccc1O 698651413 JJQLAYDUFZMESO-RDDDGLTNSA-N 279.258 2.062 10 10 CECE CCN(CCCO[C@@H]1CCOC1)c1ccc(CN)cc1 699577396 GIYIPMAQPHFJED-MRXNPFEDSA-N 278.396 2.167 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H]2CCCCO2)cc1O 93670820 OANHJMFJDSTKDH-YPMHNXCESA-N 264.369 2.417 10 10 CECE C[C@@H](NC(=O)c1ccc2nonc2c1)c1ccccc1O 1151886006 QMRPCBMHKRVDQO-SECBINFHSA-N 283.287 2.419 10 10 CECE O=C(NCc1cc(O)ccc1O)c1ccc(F)s1 1303225164 AEFGRXBEWHCRQT-UHFFFAOYSA-N 267.281 2.228 10 10 CECE O=C(c1cccc2nc(O)[nH]c12)N1Cc2cccc(O)c2C1 1302788053 SEKXUUUUKGEWIN-UHFFFAOYSA-N 295.298 2.130 10 10 CECE COC(=O)c1ccoc1CN1CCC[C@H]1CN=[N+]=[N-] 2123017315 GKIWBGGEOUGCCS-VIFPVBQESA-N 264.285 2.341 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)CCc2cccnc2)CC1 2117725981 XJXKGVNLDHYEEB-UHFFFAOYSA-N 259.313 2.221 10 10 CECE OC[C@H]1CC(F)(F)CN1Cc1ccc(N2CCCC2)cc1 1321635808 JSGVSXUUOGGHQY-OAHLLOKOSA-N 296.361 2.489 10 10 CECE Nc1ccc(CCO[C@H]2CCCC(F)(F)[C@@H]2O)cc1 2119738171 GCKXRNSWDKQBHL-QWHCGFSZSA-N 271.307 2.377 10 10 CECE Oc1ccc(CNc2cccn3ccnc23)c(O)c1 2120557846 FSDGBMXZWIWBED-UHFFFAOYSA-N 255.277 2.358 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCC[C@H]3N)[C@H]1CO 2128269874 XBFVUCUKCKKPKI-CABCVRRESA-N 260.381 2.230 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C[C@@H]1O 2128278289 WRFXFYWCGJXLFY-LYRGGWFBSA-N 261.365 2.263 10 10 CECE C[C@H]1CN(C)CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128319416 SUDVWTANCCDUJO-LRDDRELGSA-N 259.397 2.021 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3CCO[C@@H]3C2)c(F)c1 2128307991 YIJMKIVHVJLSQI-UEKVPHQBSA-N 265.328 2.494 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@@H]2CCO[C@H]2C1 2128438164 UILGQTWUZANTIV-GYSYKLTISA-N 263.337 2.270 10 10 CECE CO[C@]1(CN(C)Cc2cc(Cl)ccc2O)CCOC1 2129737948 UMFCEUIUDDOCSF-AWEZNQCLSA-N 285.771 2.283 10 10 CECE OC[C@H]1C[C@H]2CC[C@H]1N2Cc1cc(F)cc(F)c1O 1332707832 NQTCRGYEJHFNCB-IRUJWGPZSA-N 269.291 2.016 10 10 CECE CC[C@H](N)c1ccc(N(C)CCC(=O)N(C)C)cc1 2131959185 XWROVECUUCULOA-AWEZNQCLSA-N 263.385 2.011 10 10 CECE Cc1ccc(CN[C@@H](C)[C@H](C)N)c(O)c1Br 1905145408 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CCC[C@@H]1COCCN1c1ccc(OC)cc1CO 2227711188 MXLMMFRQPAASDQ-CYBMUJFWSA-N 265.353 2.193 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H](O)[C@H]2CC3)c([N+](=O)[O-])c1 2238218873 NVGJOZCLJNUXGG-GAJTVXKRSA-N 278.308 2.096 10 10 CECE CNCc1ccc(OC)c(CN2CC[C@H]3C[C@]3(F)C2)c1 2239004790 KFWNHCXUYATDHE-HOCLYGCPSA-N 278.371 2.349 10 10 CECE C[C@H](N[C@H](C(F)F)[C@@H]1CCOC1)c1ccc(O)cc1O 2239519460 YUHMGIOVBQSVGD-RWEMILLDSA-N 287.306 2.419 10 10 CECE CC[C@H](C)NCc1ccc(N2CC([N+](=O)[O-])C2)cc1C 2240051477 BFUUZSXZSHOEDO-LBPRGKRZSA-N 277.368 2.348 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC(C(N)=O)C2)cc1Cl 2240011370 RSHPWDCRLRVZBE-SNVBAGLBSA-N 295.814 2.150 10 10 CECE CCCN1CCN(c2ccc([C@H](C)N)cc2C)CC1=O 2240836789 QEEZXIVHMOQQOH-ZDUSSCGKSA-N 275.396 2.073 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCO[C@@]2(CCOC2)C1 2240835629 KKPZXOXDGUZEKC-CJNGLKHVSA-N 277.364 2.044 10 10 CECE CSCC[C@H](N)CNCc1cnc(SC)s1 2243844400 MNNSXMKZRNJVDT-QMMMGPOBSA-N 277.484 2.035 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@H](C)C(=O)NC)cc1C 2285141566 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10 CECE NCc1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c2ccccc12 2355621228 CLOJWBOFSSZLCE-YMRXKLBXSA-N 268.360 2.258 10 10 CECE CCCOc1cc(N(CCC)CCO)ccc1N 111051415 MXOGRESKGPYEPV-UHFFFAOYSA-N 252.358 2.266 10 10 CECE CN1CCc2cc([C@@H](CN)N(C)Cc3ccoc3)ccc21 50287250 CBGMHAVSOGFTAY-QGZVFWFLSA-N 285.391 2.404 10 10 CECE CC1=NN(c2cccc3ccccc23)C(=O)/C1=C/NO 108693653 PBEDRRMIFPCVSC-UKTHLTGXSA-N 267.288 2.425 10 10 CECE CC[C@H]1CN(c2ccc(CN)cc2Cl)CCN1C 110699165 ZZDVKYRMGZPKRA-LBPRGKRZSA-N 267.804 2.329 10 10 CECE CNCc1cc(F)c(N2CCC(CN(C)C)CC2)c(F)c1 62713000 MMNBLCWPYSYDOA-UHFFFAOYSA-N 297.393 2.462 10 10 CECE CNCc1ccc(N(C)C(C)(C)CO)c(Cl)c1 126816522 NHCUDKYTFREVQH-UHFFFAOYSA-N 256.777 2.267 10 10 CECE COCCN1[C@@H](C)CN(Cc2cc(F)ccc2O)C[C@@H]1C 180168423 WGJKMNBNNLIAAX-STQMWFEESA-N 296.386 2.072 10 10 CECE Cc1cc(O)c([C@@H](N)CC(=O)O)c(C)c1Br 219140895 JAHAOLBJQUWWJM-ZETCQYMHSA-N 288.141 2.246 10 10 CECE O=C1c2ccccc2CCN1CCNCc1ccccc1O 189045490 QYHCOEGMGXBFHD-UHFFFAOYSA-N 296.370 2.180 10 10 CECE COc1cc(Br)c(C)c([C@@H](C)N)c1O 218381328 PXHLENQXFUVCHG-ZCFIWIBFSA-N 260.131 2.491 10 10 CECE C[C@@H](O)[C@H](N)c1cc(NC(=O)OC(C)(C)C)ccc1O 1952101722 PKKLCCRCRRJIDT-PELKAZGASA-N 282.340 2.120 10 10 CECE CC(C)[C@@H]1C[C@H](NCc2ccc3c(c2)CCCO3)CN1 1964685810 REGGGGINVTUTFM-HOTGVXAUSA-N 274.408 2.488 10 10 CECE CC(C)(C)OC(=O)N1C[C@H](N)C[C@@H]1c1cccc(O)c1O 1952447383 FRGRQVJBLQGFND-MWLCHTKSSA-N 294.351 2.107 10 10 CECE CCOc1cccc(CN[C@@H]2CCC[C@@H]2OC)c1O 50369639 NSVIXGKFKRYYFW-OLZOCXBDSA-N 265.353 2.448 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@](C)(O)C2)cc1Br 235221769 GVTNLHPRRONCHI-RNCFNFMXSA-N 299.212 2.430 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])C1CCCCC1 90257131 JDWVOXJWOCCJLW-LBPRGKRZSA-N 254.334 2.398 10 10 CECE Cc1ccc(Br)c([C@H](N)C(F)(F)CO)c1O 95715925 JQFKJHMNHULINQ-VIFPVBQESA-N 296.111 2.091 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCSC2)cc1O 93670386 OJKSLASKSDSPNR-MWLCHTKSSA-N 252.383 2.354 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC12CC2 335544285 NFRRDIBDQBZIMS-LBPRGKRZSA-N 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COc1ccc(N(C)[C@H](C)CO)c(CNCC(C)C)c1 2235966402 SEAXJWJYEAHVQN-CYBMUJFWSA-N 280.412 2.258 10 10 CECE CCNCc1cc(OC)ccc1N(C)[C@@H]1CO[C@@H](C)C1 2235955919 WAKJKSXDLNPRJY-JSGCOSHPSA-N 278.396 2.418 10 10 CECE COCCNCc1cc(OC)ccc1N1C[C@@H](C)[C@H]1C 2235953819 GVOWKKUVFGKCTO-CHWSQXEVSA-N 278.396 2.276 10 10 CECE CCN1[C@H](C)CN(c2ccc(OC)cc2CN)C[C@H]1C 2235958315 JVXUIPPSYSSYHS-CHWSQXEVSA-N 277.412 2.073 10 10 CECE CCNCc1cc(OC)ccc1N(CCO)C(C)(C)C 2235966413 SHWGUHVWGJRVEW-UHFFFAOYSA-N 280.412 2.402 10 10 CECE COc1ccc(N2CCC[C@@H](CCO)CC2)c(C=O)c1 2235989484 UDKDJAFNKMQZHN-CYBMUJFWSA-N 277.364 2.497 10 10 CECE COc1ccc(N2C[C@H](C)CC[C@@H]2CO)c(C=O)c1 2227700393 YBVXUMXREFPZEZ-DGCLKSJQSA-N 263.337 2.105 10 10 CECE C[C@@H](NC[C@H]1OC(=O)NC1(C)C)c1ccc(F)cc1O 2239278751 SPXAXXLRVGZVKH-PRHODGIISA-N 282.315 2.069 10 10 CECE COc1ccc(CN2CCC=C[C@]2(C)C(=O)O)c(O)c1 2239428431 BPOUIJCDKKIIMD-OAHLLOKOSA-N 277.320 2.006 10 10 CECE CC[C@H](C)NCc1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)cc1 2240053280 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Cc1cc(N2CCN(C)[C@@H]3CC[C@H]32)ccc1[C@H](C)O 2269675559 WJDOUFMJENPNNG-APHBMKBZSA-N 260.381 2.331 10 10 CECE CCCNC(=O)CN(C)c1ccc([C@H](C)O)c(C)c1 2269676079 GZTNOLVESJMDKL-LBPRGKRZSA-N 264.369 2.011 10 10 CECE COc1ccc(N2CC=CCC23CNC3)c(OC)c1C 2295437572 OOMGNXUFJULEFQ-UHFFFAOYSA-N 274.364 2.121 10 10 CECE C[C@@H]1CSCCN1Cc1ccc(N2CCNCC2)cc1 2286065323 ICWSIDINQWTOMQ-CQSZACIVSA-N 291.464 2.034 10 10 CECE CCC(=O)Oc1ccc(C=C2SC(=S)NC2=O)cc1 2296827787 MGVLTKPGJZDTMD-UHFFFAOYSA-N 293.369 2.491 10 10 CECE COc1ccc(N2C[C@H]3C[C@]3(N)C2)c2ccccc12 1145244697 LADMFIHIHQUWMC-BZNIZROVSA-N 254.333 2.386 10 10 CECE COc1ncc(F)c(NCc2cccc(C)c2O)n1 1160769323 KTKAPICESZXOST-UHFFFAOYSA-N 263.272 2.250 10 10 CECE CCNCc1ccc(N2CCSC2)cc1OC 2303469039 PPYOBPZUPNRCJE-UHFFFAOYSA-N 252.383 2.315 10 10 CECE CC(C)[C@H](CO)N(C)c1ccc(CO)cc1Cl 2302551775 NEJPHOGOSQCBKZ-ZDUSSCGKSA-N 257.761 2.285 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)NCc1ccoc1 2307986568 IYKPDRFVCSZVQW-UHFFFAOYSA-N 259.261 2.020 10 10 CECE CN(Cc1ccccc1O)C(=O)C=Cc1ccc[nH]1 2310786881 IQVZDEYHLVJPAN-UHFFFAOYSA-N 256.305 2.392 10 10 CECE CC(C)[C@@H]1COC[C@@]1(Sc1nccs1)C(=O)O 2307029369 ITRRIUBFJKWAQG-KWQFWETISA-N 273.379 2.361 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H]2[C@H]2C[C@@H]23)c(F)c1F 2308721851 CJYYTCCMHYZONY-WYFGTUCQSA-N 250.292 2.268 10 10 CECE CCC[C@@H](COC)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312334387 UWDPGXWRBKBATI-AXFHLTTASA-N 254.334 2.397 10 10 CECE C[C@@H](O)CCCN(C)c1ccc([C@@H](C)O)cc1F 2314574179 JNHJNYHMHFREKV-GHMZBOCLSA-N 255.333 2.476 10 10 CECE C[C@@H](NC[C@@]1(O)CCCSC1)c1ccccc1O 2320599688 WNCVWIXYHOEAHX-RISCZKNCSA-N 267.394 2.301 10 10 CECE CN(Cc1cc(N)ccc1O)[C@H]1C[C@@H]2C[C@H]1[C@H]1C[C@@H]21 2330313669 DLWQTAJDKDNZQP-IRKCQTEASA-N 258.365 2.451 10 10 CECE COc1cc(N2C[C@@H]3C[C@H]2C(F)(F)C3)ccc1CN 2333188598 QDNLKCJWLATUBN-RNCFNFMXSA-N 268.307 2.388 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](C)C[C@@H](O)C2)c(C)c1 2333979519 ZXHZYGGKCXLGKT-CORIIIEPSA-N 262.397 2.483 10 10 CECE CC[C@H](O)c1ccc(N2CCC3CC2(CO)C3)cc1 2336483000 VOHLUOHIYSGALM-NRAUKZCXSA-N 261.365 2.481 10 10 CECE CCNCc1ccc(N2CC(C)(O)C2)cc1C1CC1 2339149065 XINCKPURNYHGIQ-UHFFFAOYSA-N 260.381 2.245 10 10 CECE CC(C)[C@H]1C[C@@H](O)CN1c1ccc2c(c1)COCC2 2344593732 BMAUUYPEKZNHLE-HZPDHXFCSA-N 261.365 2.355 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@@H]2CC[C@@H]2[C@H]1C(=O)O 2354243402 UMVKVKMYCYKCAG-COPCRZHJSA-N 279.311 2.387 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1C[C@@H]2CC[C@H]1O2 2354253248 NLHRKXRCCZKWTQ-ZWKOPEQDSA-N 276.336 2.177 10 10 CECE CCN1CCc2cc([C@@H](NN)[C@@H]3C[C@@H]3C(F)F)ccc21 2354610099 XMOKLBPDMHTYOF-MBNYWOFBSA-N 281.350 2.475 10 10 CECE CN1CCCc2cc([C@@]3(O)C[C@@H]4C[C@H]3C[C@H]4N)ccc21 2354675383 SUEXHFNEUPLAIC-FAYQHZLMSA-N 272.392 2.014 10 10 CECE COc1ccc(N(C)C[C@H]2CC[C@H](CNC3CC3)O2)cc1 52541870 BYCNAYSHQWLDBY-IAGOWNOFSA-N 290.407 2.431 10 10 CECE COc1ccc(O)c(CN[C@H](C)c2cn[nH]c2C)c1 180900410 KTPJTSNEHOYVSK-SECBINFHSA-N 261.325 2.283 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CC12CCNCC2 70254479 FURPCKNYRKQVIA-TZMCWYRMSA-N 288.391 2.301 10 10 CECE COC[C@H](C)N(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 217143673 QCOPTGRLRFIKMV-BXKUYDPTSA-N 294.307 2.164 10 10 CECE CCOC(=O)CSCCCc1ccc(N)cc1 122886190 LNNFHFRHBOMJHK-UHFFFAOYSA-N 253.367 2.498 10 10 CECE Cc1c(Br)ccc(O)c1[C@@H]1COCCN1 218498882 CRLJDHQXQAZMMI-VIFPVBQESA-N 272.142 2.124 10 10 CECE Cc1nc(CNCc2cccc(O)c2O)cs1 41117961 QLCCSUXCLFANNG-UHFFFAOYSA-N 250.323 2.153 10 10 CECE CCOC(=O)[C@H](CN(C)c1ccc(OC)cc1)NC(C)C 49971989 MJXBUJXHEADJGZ-HNNXBMFYSA-N 294.395 2.061 10 10 CECE CCOC(=O)[C@H]1CCN[C@H](c2c(O)cccc2OC)C1 1952458046 JCRXWPFAELBTQS-QWRGUYRKSA-N 279.336 2.005 10 10 CECE CCN1CCC[C@H](NCc2cc(F)ccc2O)C1 226586130 DFHMLJLFOGBKLJ-ZDUSSCGKSA-N 252.333 2.105 10 10 CECE O=C1CC[C@@H](c2cc(Br)cc(F)c2O)N1 238722540 NRYSIDGZKSWGMV-QMMMGPOBSA-N 274.089 2.245 10 10 CECE CCCCC[S@@](=O)CC(=O)Nc1ccc(N)cc1 232957435 YBYBWTFNXRJVDC-GOSISDBHSA-N 268.382 2.146 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cc(C)ccc1F 234550118 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254.761 2.006 10 10 CECE COc1cccc(CN[C@H]2CCCc3nn(C)cc32)c1O 283061175 TYUVPOQEHTVDCO-ZDUSSCGKSA-N 287.363 2.302 10 10 CECE CC(C)(O)C1CN(Cc2cc(Cl)c(F)cc2O)C1 297370238 IKQZQSIZWFKRQT-UHFFFAOYSA-N 273.735 2.387 10 10 CECE CC[C@@](O)(CN)CCCOc1ccc(N(C)C)cc1 2229382745 XYLMZLIENWXYLE-HNNXBMFYSA-N 266.385 2.011 10 10 CECE CO[C@@H]1C[C@](N)(c2ccc3c(c2)CCN3C)C12CCC2 2163071115 LVBDBOMLYYTGGM-WBVHZDCISA-N 272.392 2.422 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CCCC[C@H]1CO 2165030560 HKUPSTLUNLHVBH-GWCFXTLKSA-N 278.352 2.018 10 10 CECE Cc1nccnc1[C@H](O)c1ccc(N2CCCC2)cc1 2163103759 XNLXXOBPUQAUCY-MRXNPFEDSA-N 269.348 2.467 10 10 CECE C[C@H]1CCN1c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 706818117 LIXCKLCAGIXPJZ-LVCFMKKZSA-N 262.265 2.291 10 10 CECE CN1CCc2cc([C@@H](N)[C@H]3CC34CCOCC4)ccc21 2163138563 ODRQPPSHWMBAON-GDBMZVCRSA-N 272.392 2.495 10 10 CECE CCN(CC)c1ccc([C@H](NN)c2coc(C)n2)cc1 2163146413 TZWCDDVSXDJVOD-HNNXBMFYSA-N 274.368 2.382 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@]2(O)CC[C@H]2OC)cc1 2163150660 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251.326 2.145 10 10 CECE COc1ccc([C@H](N)c2nnc(C=C(C)C)o2)c(O)c1 83544300 QLTLSTQGTFZTGJ-ZDUSSCGKSA-N 275.308 2.255 10 10 CECE Nc1cc(F)ccc1[C@@H]1NCCc2cc(O)c(O)cc21 83621065 OSSOZHRPHDGATC-HNNXBMFYSA-N 274.295 2.054 10 10 CECE Nc1ccc2c(c1)[C@H](c1cc(F)ccc1O)NCC2 83652113 DVFWMMNIUMKXBG-OAHLLOKOSA-N 258.296 2.349 10 10 CECE C[C@@H]1O[C@H](C)[C@@H](CNCCc2ccc(N)cc2)[C@@H]1C 701102660 NRUUQRMNFBITGQ-IATRGZMQSA-N 262.397 2.460 10 10 CECE CCO[C@@H]1CCN(Cc2ccc(F)c(F)c2O)C1 703517066 IFYMMLSOJULWJO-SNVBAGLBSA-N 257.280 2.281 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1ccc(F)cc1O 691690425 UWDACRYPIGZRJZ-VIFPVBQESA-N 264.260 2.446 10 10 CECE C[C@H]([C@H]1CCCCO1)N(C)Cc1cc(N)ccc1O 705950718 KNNZMHCRFLECQI-IAQYHMDHSA-N 264.369 2.364 10 10 CECE COc1ccc(CN[C@H]2CC[C@@H](OC)C2)c(O)c1 190949844 ZEPIDPYQCUCMBS-NWDGAFQWSA-N 251.326 2.058 10 10 CECE C[C@H]1CC[C@H](CN)CN1Cc1cc(F)cc(F)c1O 708485694 MYUIAHDIJNITOH-VHSXEESVSA-N 270.323 2.230 10 10 CECE COCCNCc1ccc(N(C)C[C@@H]2CCCO2)cc1 62737064 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Cc1ccc(CN2CC[C@@H](O)C2)c(O)c1Br 1905118385 RWOYSSYXQSKRCG-SNVBAGLBSA-N 286.169 2.030 10 10 CECE C/C(=C\C(=O)N1CCOc2ccccc21)c1cnccn1 1349920666 KSMAFGIMNZSNJY-ZRDIBKRKSA-N 281.315 2.306 10 10 CECE C[C@@H](N)c1ccc(N(C)C2CC(O)C2)cc1Cl 1914590298 JCQIOJMRLVQGRN-MFAVDMRSSA-N 254.761 2.319 10 10 CECE CO[C@@H]1CCN(c2ccc(CN)cc2Cl)[C@H]1C 1908503375 SDTHKWJTXVBQBW-TVQRCGJNSA-N 254.761 2.412 10 10 CECE COCCN(c1cc(OC)c(OC)cc1N)C(C)C 214178592 HNURPIUYDRJZQB-UHFFFAOYSA-N 268.357 2.147 10 10 CECE COCCNCc1ccc(N2CC[C@H](OC)[C@H]2C)cc1 1914266284 FMGKRWAYLMIEOT-CJNGLKHVSA-N 278.396 2.036 10 10 CECE CP1(=O)CCN(c2ccc3c(c2)CC[C@H](N)C3)CC1 2134914811 PYVZZKWWYMDZSS-AWEZNQCLSA-N 278.336 2.316 10 10 CECE CCOc1ccc(N2CC[C@H](CC(=O)OC)C2)cc1 107946333 ZEWXXNFKHKKLHQ-GFCCVEGCSA-N 263.337 2.475 10 10 CECE C[C@H]1C[C@H](CN)CN1Cc1ccc2c(c1)CCCN2C 216033543 CAOZWNYKMIVRAS-DZGCQCFKSA-N 273.424 2.238 10 10 CECE CNC(=O)CCN(C)c1ccc(C=CC(=O)O)cc1Cl 1911952684 NTVSLSKOKWJAPN-UHFFFAOYSA-N 296.754 2.010 10 10 CECE CN(Cc1ncccn1)c1ccc(C=CC(=O)O)cc1 1911928177 QSOSNCBSAPDCJB-UHFFFAOYSA-N 269.304 2.211 10 10 CECE CN(C)c1ccc([C@H](N)[C@@](C)(O)C2CC=CC2)cc1 2134293001 KFRCQUMATYTKQL-HOTGVXAUSA-N 260.381 2.470 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H]3C[C@H]32)c([N+](=O)[O-])c1 1912075384 PJKSOAVLKPFWMM-CMPLNLGQSA-N 274.276 2.291 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(S(=O)(=O)CC2CCC2)C1 1912186338 CKDIVEBYIUHDTL-LLVKDONJSA-N 272.374 2.139 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CCc2cnccn2)C1 1912198129 CNDMFLXGWSQTIO-GFCCVEGCSA-N 260.345 2.432 10 10 CECE CC(C)[C@@H](C)NC(=O)CN1CCC[C@@H](CN=[N+]=[N-])C1 1912155104 FXLXHKARZUTMND-NEPJUHHUSA-N 267.377 2.169 10 10 CECE [N-]=[N+]=NCCCNS(=O)(=O)c1cccc2cccnc12 1912198091 CETMYHFXOGNASX-UHFFFAOYSA-N 291.336 2.214 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CC(=O)NC2CCCCC2)C1 1912204964 ZQBAEWXPQMICQK-LBPRGKRZSA-N 265.361 2.210 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@]23CCOC3)c(F)c1 1915339704 KUDFOBWLEAUJLB-HZMBPMFUSA-N 251.301 2.248 10 10 CECE Nc1ccc(OCCC(=O)N2CCC[C@H]3C[C@H]32)cc1 1916861147 QYGZLSJRPBUFQO-SMDDNHRTSA-N 260.337 2.049 10 10 CECE Oc1cccc(F)c1CN[C@H]1C[C@@H]1C1CCOCC1 2135446597 JJGRWEDQKJVXMD-RISCZKNCSA-N 265.328 2.436 10 10 CECE C[C@H](NCCOCC(F)(F)F)c1cc(O)ccc1O 111636712 DEUIQRGVBQMCQQ-QMMMGPOBSA-N 279.258 2.327 10 10 CECE COc1ccc(N2C[C@H](C)NC(C)(C)C2)cc1OC 217109096 INMQGUPOWBDFTK-NSHDSACASA-N 264.369 2.281 10 10 CECE C[C@H](NC[C@]1(O)CC[C@@H](C)C1)c1ccc(O)cc1O 2136916564 XJENUDMYGRBNFF-ZETOZRRWSA-N 265.353 2.300 10 10 CECE COc1cccnc1C(=O)NCc1cc(Cl)ccc1O 1628681461 VJWCKRXUPOAXDN-UHFFFAOYSA-N 292.722 2.379 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1C[C@@H](N)CC12CCC2 1925213801 FRLFLDODNWGGBJ-QWRGUYRKSA-N 262.353 2.115 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccc(Cl)nc1 1638352177 KYXKJKRXZUKBMW-UHFFFAOYSA-N 278.695 2.076 10 10 CECE CC(C)CNC[C@H](C)NCc1ccc(N(C)C)cc1 229149379 WSRYHIFNZKMMFJ-AWEZNQCLSA-N 263.429 2.476 10 10 CECE CCCC(=O)N[C@H](C)CNCc1ccc(OC)c(C)c1 1568977837 OIEURBVJZPDUJD-CYBMUJFWSA-N 278.396 2.398 10 10 CECE 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2.025 10 10 CECE Cc1ccnc(N)c1C(=O)CCc1ccc(N)cc1 124604441 JOAJZCXTANLCHW-UHFFFAOYSA-N 255.321 2.370 10 10 CECE Cc1ccc(CN[C@@H]2CCn3nccc3C2)c(O)c1 2139755762 JGUDWDDXDMADLZ-CYBMUJFWSA-N 257.337 2.002 10 10 CECE C[C@H]1[C@H](C)[C@H](NCc2ccc(F)cc2O)CCN1C 2139879190 GJRYUVBSWONMOL-COPLHBTASA-N 266.360 2.350 10 10 CECE CCCCc1n[nH]c(=Nc2cc(C(=O)O)ccc2O)s1 1859857740 HKASZWLUCMJOQX-UHFFFAOYSA-N 293.348 2.450 10 10 CECE CCCC1=NN(C)C(=O)/C1=C/c1ccc(O)c(O)c1 1865649740 BLJMVOXWZLNLDI-JXMROGBWSA-N 260.293 2.109 10 10 CECE Nc1ccc(COCC(=O)Nc2ccccc2)cc1 19967323 ICCFCFPSMQNZIH-UHFFFAOYSA-N 256.305 2.424 10 10 CECE COc1ccc(N2CC[C@@H](CNC[C@H]3CCCO3)C2)cc1 250568720 DBOXDZIYAJIQFP-WMLDXEAASA-N 290.407 2.290 10 10 CECE CCc1cc(CNC[C@@H]2CCCCN2)ccc1OC 258902452 MMXMPGPFAGFAHJ-HNNXBMFYSA-N 262.397 2.489 10 10 CECE CCc1cc(CNC[C@H]2CCCNC2)ccc1OC 259064872 RNMIJLRCQPBKGB-AWEZNQCLSA-N 262.397 2.347 10 10 CECE CCN(Cc1ccc(OC)cc1O)C[C@@H]1CCCNC1 233543861 GUHQURFEGKRZIF-CYBMUJFWSA-N 278.396 2.222 10 10 CECE 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CC[C@@H](COC)N1CCc2cc(OC)c(OC)cc21 1970282160 RLZXGSGYODDYCD-LBPRGKRZSA-N 265.353 2.491 10 10 CECE CO[C@@H]1CCN([C@H](C)c2ccc(F)cc2O)[C@H](CN)C1 252762877 DXWFGDBRAJHQIU-KGYLQXTDSA-N 282.359 2.030 10 10 CECE Oc1cccc2c1[C@@H](NCCN1C[C@H]3CC[C@H]1C3)CC2 1971262607 PIZGKVSYICGYNQ-QEJZJMRPSA-N 272.392 2.453 10 10 CECE Cc1cccc(O)c1CNCCN1C[C@H]2CC[C@H]1C2 1971262118 JFFKBTJXDNDUOG-KBPBESRZSA-N 260.381 2.275 10 10 CECE COc1cccc(O)c1CNCC[C@H]1CCO[C@H]1C 1972158070 LJDLKZUHXAEWIQ-RYUDHWBXSA-N 265.353 2.306 10 10 CECE COc1ccc(O)c(CN(C)C[C@H]2C[C@H](C)CO2)c1 1974385449 PHUHJPLCTJWYNK-SMDDNHRTSA-N 265.353 2.258 10 10 CECE C[C@H]1CO[C@@H](CN(C)Cc2cc(F)ccc2O)C1 1974412243 BQPURWBGVDEWEU-ZWNOBZJWSA-N 253.317 2.388 10 10 CECE C[C@@H](NCC12CCN(CC1)CC2)c1cc(O)ccc1O 2145169448 FEICGTPGILDABU-GFCCVEGCSA-N 276.380 2.234 10 10 CECE CO[C@H]1CN(c2ccc(CNC(C)C)cc2F)C[C@H]1F 2146479023 PVQWBLIIHCYFFM-HIFRSBDPSA-N 284.350 2.497 10 10 CECE Cc1ncccc1[C@@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2147377568 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Cc1cc(CNC(C)C)ccc1OCc1nncn1C 2155011188 QTWFESUOQAIZMR-UHFFFAOYSA-N 274.368 2.201 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC[C@H](N)C2(CCC2)C1 2155074119 FUJZYSTWGLVHDB-NHYWBVRUSA-N 276.380 2.362 10 10 CECE C[C@H](NCc1ccc(O)c(O)c1O)c1cncs1 2027084156 UUOFBMZKVGPHNI-ZETCQYMHSA-N 266.322 2.111 10 10 CECE C[C@@H]1CCC[C@H]1CS(=O)(=O)Nc1ccc(N)cc1 2032608546 VNVOULXNSWSKJX-MNOVXSKESA-N 268.382 2.447 10 10 CECE CCNCCN(C)[C@@H](C)c1cc(OC)ccc1O 2032959572 GUSDTQANTAXQMG-NSHDSACASA-N 252.358 2.003 10 10 CECE O=S(=O)(Nc1ccc(O)c(C(F)(F)F)c1)C(F)F 2035396595 KANYYUQSYUJUMA-UHFFFAOYSA-N 291.197 2.375 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)C[C@@H]1CCNC1 2036982598 RTABEGRZVUHKEO-GHMZBOCLSA-N 252.333 2.134 10 10 CECE C[C@H](NC[C@@H]1CO[C@H](C)C1)c1ccc(O)cc1O 2040302625 PZOODFKUYYDOLQ-OUAUKWLOSA-N 251.326 2.173 10 10 CECE COc1ccc([C@H](C)NCCc2cncn2C)c(O)c1 401883615 RUFOZFGTQZZUOZ-NSHDSACASA-N 275.352 2.028 10 10 CECE CC[C@@H](c1ccccc1O)N1CCN(CCF)CC1 402784257 QFJMQSPLYDHULG-AWEZNQCLSA-N 266.360 2.430 10 10 CECE CCOc1cccc(CN2C[C@@H](C)CNC[C@H]2C)c1O 2159125412 NEKBAHVLNUGUJV-QWHCGFSZSA-N 278.396 2.221 10 10 CECE C[C@H](O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 2157740618 ODINLMNQQTVBBU-JTQLQIEISA-N 293.344 2.246 10 10 CECE Cc1ocnc1CN(C)CCCOc1ccc(N)cc1 2160358611 ZBNOPHBZLQHBIR-UHFFFAOYSA-N 275.352 2.466 10 10 CECE O=C(O)C1[C@H]2CC[C@H]1CN(Cc1c(O)cccc1F)C2 2160792357 FLLUWUAUPWPURG-UWVGGRQHSA-N 279.311 2.074 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)CCCN1 86269384 NCMJKANKKQYJEC-LBPRGKRZSA-N 262.353 2.036 10 10 CECE CN[C@@H](C)c1ccc(N2CCc3ncn(C)c3C2)cc1 2170692783 UMVOLCDZHQPUOD-LBPRGKRZSA-N 270.380 2.263 10 10 CECE CCNCc1ccc(N2C[C@H](N(C)C)[C@H](SC)C2)cc1 2170718354 WQZLMHWUVOXUJH-JKSUJKDBSA-N 293.480 2.278 10 10 CECE c1cc(N2CC3(CCCO3)C2)ccc1CNC1CC1 702942983 CLKKGKNFDXKHRK-UHFFFAOYSA-N 258.365 2.308 10 10 CECE CCCN[C@@H](C)c1ccc(N2CCC[C@@H]2C(N)=O)cc1 703051163 NNCNMFMSZMAUAT-SWLSCSKDSA-N 275.396 2.201 10 10 CECE CNCc1ccc(N(C)Cc2cncnc2C)c(C)c1 2178814469 ANCGZULHXWYXKT-UHFFFAOYSA-N 270.380 2.449 10 10 CECE COc1ccc(N(C)[C@@H]2COC[C@@H]2C(C)C)c(N)c1 688202407 YUZBDAVLRGMNLR-IUODEOHRSA-N 264.369 2.385 10 10 CECE C[C@H](NCc1ccc2c(c1)CCN2C)c1cn(C)cn1 710150520 XGYAPASCKPWBNE-LBPRGKRZSA-N 270.380 2.263 10 10 CECE CNCc1ccc(N2CCN(C3CCC3)CC2)cc1 378769045 WIBIBULSAALTGJ-UHFFFAOYSA-N 259.397 2.081 10 10 CECE Nc1ccc(O)c(CN2CCO[C@H](c3ccco3)C2)c1 2171715121 VSQLNUVQZYNOJB-HNNXBMFYSA-N 274.320 2.141 10 10 CECE C[C@@H](CC(=O)N(C)C)N[C@@H](C)c1ccc(N(C)C)cc1 380611859 FIUUYVLEKHXUPX-STQMWFEESA-N 277.412 2.270 10 10 CECE CCNCc1ccc(N(C)CC2CN(C)C2)c(C)c1 692236794 IJIJINVKAHYETE-UHFFFAOYSA-N 261.413 2.102 10 10 CECE CC[C@@H](C)[C@H](CNCc1ccc(O)cc1O)OC 381205864 NIZFXSAFIPGVRF-YGRLFVJLSA-N 253.342 2.249 10 10 CECE CO[C@H]1C[C@@H](NCc2cccc(O)c2O)C12CCC2 713502238 IIUMGQBJQVFMRF-OLZOCXBDSA-N 263.337 2.145 10 10 CECE CC[C@H](CNC(=O)COc1ccc(N)cc1)C(C)(F)F 2171911259 HDLHERXBPBMLCH-SNVBAGLBSA-N 286.322 2.445 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](SC)C3)ccc21 382890489 PJHZWVYLDYSHGZ-RISCZKNCSA-N 291.420 2.231 10 10 CECE CCN[C@H](C)c1ccc(N2CC(O)(COC)C2)c(Cl)c1 384152149 PNLGAAXTPCHCRK-LLVKDONJSA-N 298.814 2.208 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc(CN)c(Cl)c1 385825857 SJBZAKJNHDIBPH-SMDDNHRTSA-N 268.788 2.396 10 10 CECE CCC[C@H]1COC[C@@H]1NCc1cccc(OC)c1O 699443740 YMBIZIQPEZEMKZ-STQMWFEESA-N 265.353 2.306 10 10 CECE CCCOc1cnc(C(=O)Cc2ccc(N)cc2)nc1 2165656476 UVZPTJHYSZZWMO-UHFFFAOYSA-N 271.320 2.273 10 10 CECE CCOC(=O)c1cnn(Cc2ccc(C)cc2O)c1 2069968199 QDEKUWIJZXRUEU-UHFFFAOYSA-N 260.293 2.122 10 10 CECE CC(C)Cc1cnn(Cc2ccc([N+](=O)[O-])cc2O)c1O 2070310851 WXMUPRCCKHXMND-UHFFFAOYSA-N 291.307 2.449 10 10 CECE COCc1nc(CNCc2c(O)cccc2F)cs1 896642529 ZFQPPLQTASEIJO-UHFFFAOYSA-N 282.340 2.424 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H](N(C)C)C3)cc1 2174943621 QSWAWULNHNANJR-FVQHAEBGSA-N 273.424 2.467 10 10 CECE Nc1ccc(CS(=O)(=O)NCC2CC(C3CC3)C2)cc1 2169275983 PZPGAFPKFSSPRV-UHFFFAOYSA-N 294.420 2.124 10 10 CECE COCCNCc1ccc(N(C)C[C@H]2C[C@H]2F)c(F)c1 2188324362 LDAPQALWCJGUAC-CHWSQXEVSA-N 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C[C@H]1CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 706783333 FJGQQCFVPJPBQS-KGFZYKRKSA-N 297.152 2.033 10 10 CECE Cc1oc(C(=O)O)cc1CN(C)c1ccc(CN)cc1 2162691720 ZVZTWJCLUJEZEG-UHFFFAOYSA-N 274.320 2.381 10 10 CECE CCN(CCN(C)C)Cc1cc(Cl)ccc1O 708351714 ATIKJSBVZFIDSI-UHFFFAOYSA-N 256.777 2.429 10 10 CECE CN(Cc1ccc(N)cc1)c1ncc(Cl)c(C(=O)O)n1 2162824422 ZDEHIDTVMWGATF-UHFFFAOYSA-N 292.726 2.047 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCNC(C)(C)C2)cc1 709266561 QMXGYKBXVVEOOF-CQSZACIVSA-N 261.413 2.373 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C[C@@]12CCC[C@H]1C2 710390446 WTKPSGLLYWJTTD-LRDDRELGSA-N 273.380 2.329 10 10 CECE CCN1CCc2cc([C@H](N)CCOCCOC)ccc21 2163071172 MFBDXZDUCLNDKL-OAHLLOKOSA-N 278.396 2.122 10 10 CECE CNCc1ccc(N(C)C[C@H]2CCC[C@@H]2O)cc1C 689815438 SGEKABGACBLDAA-ZBFHGGJFSA-N 262.397 2.312 10 10 CECE Cc1cnn(C[C@H](O)c2ccc3c(c2)CCCN3C)c1 2163111473 RYMAOPSWEFINFE-INIZCTEOSA-N 271.364 2.308 10 10 CECE C[C@@H]1CSCCN(CCOc2ccc(N)cc2)C1 379521495 HVKLMLZLEOPQOB-LBPRGKRZSA-N 266.410 2.333 10 10 CECE 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278.396 2.363 10 10 CECE CCNCc1ccc(N(C)[C@@H](C)CCO)cc1C 1917006666 LJSMZCXQKHTGMV-ZDUSSCGKSA-N 250.386 2.312 10 10 CECE CN1CCCc2cc(CNCCc3cnc[nH]3)ccc21 87537945 JHASZJWRNUKNDH-UHFFFAOYSA-N 270.380 2.124 10 10 CECE CCN[C@H](C)c1ccc(N(CCF)CCOC)cc1O 697291320 XRQPCCIQJVFSJX-GFCCVEGCSA-N 284.375 2.485 10 10 CECE CC[C@@H]1[C@H]2CNC[C@@H]2CN1Cc1ccc(N(C)C)cc1 90329418 HJVZVHHBSMRYLF-HYVNUMGLSA-N 273.424 2.182 10 10 CECE O=C(O)[C@@H]1C[C@@]12CC[C@@H]2NCc1ccc(Cl)cc1O 2115871797 TZTGITCQHRYUNR-JKOKRWQUSA-N 281.739 2.389 10 10 CECE C[C@@H]1C[C@@H](O)CCN1c1ccc2c(c1)CCC[C@H]2N 2128268800 LFNHUZDRGXSJOC-DIOULYMOSA-N 260.381 2.372 10 10 CECE Nc1ccc(CN[C@@H]2c3ccccc3C[C@@H]2O)cc1 2116553270 BCXCWDYXQHPDQO-JKSUJKDBSA-N 254.333 2.017 10 10 CECE COc1cccc(CNOCC(F)(F)C(F)F)c1O 2117449850 GCJHYJJORWRMJT-UHFFFAOYSA-N 283.221 2.322 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@@]1(C)COCCO1 2117639204 LKQADDSRQPWLCM-AWEZNQCLSA-N 285.771 2.283 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C[C@@H]2CCCOCC2)CC1 2117723973 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CN[C@H](c1ccc(N(C)C)cc1)[C@](C)(O)C(C)(F)F 2122329460 ZYTUBEWKTZRXPR-OLZOCXBDSA-N 272.339 2.419 10 10 CECE CC1(C)C[C@@H](O)CCN1c1ccc2c(c1)CC[C@@H]2N 2128321715 MKBHEKICPTVINH-ZFWWWQNUSA-N 260.381 2.372 10 10 CECE N[C@H]1CCc2cc(N3[C@H]4CC[C@H]3CC(O)C4)ccc21 2128329566 ZOMIKWTWOPYZAY-XEZPLFJOSA-N 258.365 2.125 10 10 CECE CCN(CC)c1ccc([C@@H](O)CS(=O)(=O)CC)cc1 2132916411 SNMIGMPSSWHLFN-AWEZNQCLSA-N 285.409 2.001 10 10 CECE CC[C@@H]1NCC[C@@]1(O)c1ccc2c(c1)CCN2CC 2131687335 LIDJSXHCTVZDKL-JKSUJKDBSA-N 260.381 2.029 10 10 CECE C[C@H](NC[C@@H](C)N(C)C1CC1)c1cc(O)ccc1O 217602111 OXRPFXUQTPCUJP-MNOVXSKESA-N 264.369 2.231 10 10 CECE C/C(=C/C(=O)N1CCSc2ccncc21)c1cnccn1 1435391589 NUDKAJDLTRUKET-FLIBITNWSA-N 298.371 2.414 10 10 CECE CO[C@H]1[C@H](NCc2cc(Cl)ccc2O)COC1(C)C 1911070878 ANRDATLHVSOZSI-YPMHNXCESA-N 285.771 2.328 10 10 CECE CN(C)C[C@@H]1CCN(c2ccc(C=CC(=O)O)cc2)C1 1911885294 JGLADZIUVGRMJM-AWEZNQCLSA-N 274.364 2.172 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(Cc2cn3cccnc3n2)C1 1912150539 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CC1(C)C[C@H](O)CN1c1ccc(CN)c(Br)c1 1949204431 KJJDBRVPYQJOIV-NSHDSACASA-N 299.212 2.257 10 10 CECE C[C@H](NC[C@]1(C)COCCO1)c1ccc(N(C)C)cc1 1967516808 NCVUKNNRDDSOON-XJKSGUPXSA-N 278.396 2.209 10 10 CECE CC(C)(NCc1cc2c(cc1O)OCO2)[C@@H]1CCCO1 1967847787 PISCZPCOTRHLDT-AWEZNQCLSA-N 279.336 2.168 10 10 CECE CN(C)c1ccc(CNCC2=NO[C@@H]3CCC[C@@H]23)cc1 1970497661 JBUVLGLVOLSUOV-GOEBONIOSA-N 273.380 2.397 10 10 CECE Nc1cc(Cl)c(N)c2c1C(=O)c1ccccc1C2=O 168513249 NNXSVNHFDAUPRN-UHFFFAOYSA-N 272.691 2.280 10 10 CECE in-vitro C[C@H](NC[C@]1(F)C[C@@H](CO)C1)c1ccc(F)cc1O 1974382739 FDMKEPSNVHQJPH-PKFCDNJMSA-N 271.307 2.293 10 10 CECE O=Cc1cccc(S(=O)(=O)Nc2ccc(O)c(F)c2)c1 2145648271 FYBBTJZFHHNUNM-UHFFFAOYSA-N 295.291 2.145 10 10 CECE C[C@@H](O)c1ccc(N2CCC(C)(C)[C@@H](CO)C2)cc1O 2148658482 KFPDMMXXZCWSBZ-VXGBXAGGSA-N 279.380 2.290 10 10 CECE CCOC(=O)Cc1ccc(-c2cnoc2CC)n1C 259621112 BLRAOWJBNMGZSB-UHFFFAOYSA-N 262.309 2.348 10 10 CECE CC1(C)CCN(C(=O)CCc2ccc(N)cc2)CCO1 2148829318 IPJXBMMCCGAWDW-UHFFFAOYSA-N 276.380 2.229 10 10 CECE COc1ccc(N2CC[C@H]3CCN(C)C[C@@H]3C2)c(N)c1 2148889546 PVTDOXJOCWCVEX-CHWSQXEVSA-N 275.396 2.055 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H]3C[C@]3(CO)C2)cc1 2146319159 PMLLCQKGOOZDQD-DOTOQJQBSA-N 274.408 2.251 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)N[C@H](C)CO)c1 35602779 KPOYYPMFYCMBLY-MNOVXSKESA-N 280.368 2.162 10 10 CECE Nc1ccc(O)c(CNC(=O)c2ccc(O)c(Cl)c2)c1 36737482 CMKWQDXKRDUXFE-UHFFFAOYSA-N 292.722 2.263 10 10 CECE Cc1cnsc1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2004223114 MDUROSVASWVMHV-MRVPVSSYSA-N 251.315 2.366 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](O)C(F)(F)C2)c(F)c1 2152099255 XPITXYKCUQGURJ-TVQRCGJNSA-N 288.313 2.312 10 10 CECE CN(C[C@H]1CC1(F)F)c1cc2c(cc1N)NC(=O)CC2 2153631231 UBJRJROGBUJPBU-SECBINFHSA-N 281.306 2.245 10 10 CECE CCN(CC)C[C@@H](C)N[C@@H](C)c1ccc(O)cc1O 45690812 AUXWUZNJDHNTOP-NEPJUHHUSA-N 266.385 2.479 10 10 CECE OCc1cc(F)c(N2CCN3CCCC[C@H]2C3)c(F)c1 2154257489 VUOPUTJBQGWHEI-LBPRGKRZSA-N 282.334 2.132 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCOC[C@H]1F 2013769002 HBAHIAHOWOQDPJ-MNOVXSKESA-N 259.708 2.262 10 10 CECE C[C@@H](C(=O)NCC(F)(F)F)N1CCC[C@H](N=[N+]=[N-])CC1 2155560321 IXDSTGHCYFIDMM-IUCAKERBSA-N 293.293 2.218 10 10 CECE CNCc1ccc(N2CC(F)(F)C[C@@]2(C)CO)c(F)c1 2159048825 HZSVBONUUIXGRG-ZDUSSCGKSA-N 288.313 2.142 10 10 CECE C[C@H](N[C@H](C)c1ccc(O)cc1O)C(C)(C)CO 2030085495 YBCINKAQGLYEGK-ZJUUUORDSA-N 253.342 2.155 10 10 CECE C[C@@](O)(Cc1cccs1)[C@H](N)c1ccccc1O 2031163429 YAXMMLDFQXZPNP-ZIAGYGMSSA-N 263.362 2.447 10 10 CECE CN(CC1CC(F)C1)C(=O)Nc1ccc(N)cc1 2031654032 HUHUXKDMDIJJMG-UHFFFAOYSA-N 251.305 2.481 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@H]1[C@H]1CCCN1 300443891 ZUXPWHXYCWHDRX-UPJWGTAASA-N 276.380 2.375 10 10 CECE CNCc1ccc(N2CCCN(C)C[C@H]2C)c(C)c1 300552877 WCMMXZGPNNPLID-CQSZACIVSA-N 261.413 2.245 10 10 CECE C/C(C(=O)O)=C(\C)C(=O)N(C)[C@H](C)c1ccccc1O 71165532 GUZHMHKWAUPLEX-DWOQACPDSA-N 277.320 2.333 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccc(O)cc2F)C1 403869848 YVQJPEKIAGTHAR-MRVPVSSYSA-N 264.260 2.446 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)C[C@@]1(C)CN 312506839 RLWITRFNYLSYCI-BLLLJJGKSA-N 276.380 2.269 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)CC[C@H]1CCCN1 313217059 QHVMTYNXZDBRTF-QWHCGFSZSA-N 276.380 2.444 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC[C@@H]1CCC(=O)O 313526879 MJQOLJPXCNMSDT-WDEREUQCSA-N 279.336 2.488 10 10 CECE CN(C[C@@]12COC[C@H]1C2(F)F)c1ccc(CO)cc1F 2161871894 QSPUVMATVYMOHR-CHWSQXEVSA-N 287.281 2.036 10 10 CECE C[C@@H]1OCC[C@@H]1C(=O)N(C)[C@@H](C)c1ccccc1O 94178589 KIQBYRVAUOPWGD-GVXVVHGQSA-N 263.337 2.337 10 10 CECE CN(c1ccc(CO)cc1Cl)[C@H]1CCC[C@@H]1O 708575365 BTKZCXPHKWFAFM-STQMWFEESA-N 255.745 2.182 10 10 CECE C[C@@H]1CN([C@H](C)c2c(O)cccc2O)C[C@]1(C)C(=O)O 710357252 ZWQQQEDQTBPYAF-FCHSOHFDSA-N 279.336 2.201 10 10 CECE CN(C[C@@H]1C[C@@H]2C[C@H]2CO1)c1c(F)cc(CN)cc1F 2179422655 UQZLQOOLYCKVRS-SRVKXCTJSA-N 282.334 2.285 10 10 CECE CC1(C)CN(c2ccc(CN)c(F)c2F)CCCO1 389080817 AZQWNPHPDZBTKH-UHFFFAOYSA-N 270.323 2.429 10 10 CECE C[C@@H](N)c1ccc(N2CCN(C)C(C)(C)CC2)cc1O 712664967 VHCQLZLQIRUNEF-GFCCVEGCSA-N 277.412 2.332 10 10 CECE C[C@H](N)c1ccc(N(C)CC2CN(C)C2)cc1Cl 692267390 IHZZYOSUQKLRNP-JTQLQIEISA-N 267.804 2.358 10 10 CECE CCN(CCCOc1ccc(N)cc1)C[C@@H](C)OC 383284038 SRURLQUTYDURDD-CYBMUJFWSA-N 266.385 2.395 10 10 CECE Nc1ccc(N2CCN(C[C@H]3CCCS3)C2=O)cc1 715881443 NXDOEGIIKQBUCY-CYBMUJFWSA-N 277.393 2.406 10 10 CECE Nc1ccc(CN=c2ccc(OC(F)F)c[nH]2)cc1 392961546 PICGAGGHGGAJDL-UHFFFAOYSA-N 265.263 2.299 10 10 CECE COc1nc([C@H](O)c2ccc(N3CCCC3)cc2)co1 2172823759 AKFMCLDSSNJHRI-CQSZACIVSA-N 274.320 2.365 10 10 CECE CN(c1cc2c(cc1N)OCCO2)[C@H]1COC(C)(C)C1 396526293 GTTXLBKFAREACH-SNVBAGLBSA-N 278.352 2.044 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2COC(C)(C)C2)c1 396511859 DYWOYVDBVPMVIS-LBPRGKRZSA-N 265.353 2.400 10 10 CECE CC(C)NCc1ccc(N(C)[C@@H](C)C[S@@](C)=O)cc1 399098887 ROTHNZLNOFVJQF-ORAYPTAESA-N 282.453 2.388 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCC(=O)N2CCCCC2)C1 2173768919 XAIIGJITSMBHJU-CYBMUJFWSA-N 279.388 2.411 10 10 CECE CCO[C@@H]1CC[C@@H](C(=O)NCCc2ccc(N)cc2)C1 2174914887 GJDNFSJCYUKATK-UKRRQHHQSA-N 276.380 2.133 10 10 CECE CCOC(=O)c1ccnn1[C@@H](C)c1cc(OC)ccc1O 2069964440 AMEUXHIAFMJTEL-JTQLQIEISA-N 290.319 2.383 10 10 CECE Cc1cc(CN)n(Cc2cccc(C(F)(F)F)c2O)n1 2070032287 IOHVGVCAXBVRNR-UHFFFAOYSA-N 285.269 2.423 10 10 CECE Cc1cc(C(=O)N(C)C)n([C@@H](C)c2ccc(F)cc2O)n1 2070048590 LKGFEMIMZRXIPU-JTQLQIEISA-N 291.326 2.347 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](COC)[C@@H](C)C2)cc1O 2175251867 KODJBYKAEANDEE-XQQFMLRXSA-N 278.396 2.391 10 10 CECE CCNCc1ccc(N2CCOC[C@@]2(C)CO)cc1Cl 2169037209 SQDLRCFVEDPMQP-OAHLLOKOSA-N 298.814 2.037 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2cncnc2)cc1O 2178812024 QODGVHOJZZZOMG-NSHDSACASA-N 272.352 2.099 10 10 CECE CN1C[C@H]2CC[C@H]1CN2Cc1cccc(Cl)c1O 1231913991 WPZZCFAULUGCSV-NWDGAFQWSA-N 266.772 2.324 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@H](O)c1ccco1 2169744037 DMLYHMQYUPIXRU-NHYWBVRUSA-N 272.348 2.395 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC=C[C@H]2CO)cc1O 2176342533 LEZWQJKFMDVDOE-JSGCOSHPSA-N 276.380 2.190 10 10 CECE CN1CCCc2cc(CNC[C@@H]3[C@@H]4CCO[C@H]43)ccc21 2176454322 NDUHLAMFPJSKTO-ZMSDIMECSA-N 272.392 2.194 10 10 CECE CN(C)CC1CCN(Cc2c(O)cccc2F)CC1 1137837699 RDKMJHUAYQPXRA-UHFFFAOYSA-N 266.360 2.305 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCS(=O)(=O)C(C)(C)C2)c1 2170453724 WVMLWZOBZNCRMD-GFCCVEGCSA-N 297.420 2.271 10 10 CECE CC(C)N1CCN(c2ccc([C@H](C)N)c(Cl)c2)CC1=O 2170580453 ZGCRZOLNKYVKBZ-NSHDSACASA-N 295.814 2.417 10 10 CECE C[C@@H](O)c1ccc(N2CCN(C3CC3)C(=O)C2)c(Cl)c1 2170568373 OHLKZMHIJOUDJO-SNVBAGLBSA-N 294.782 2.204 10 10 CECE CN1CCc2cc([C@]3(N)C[C@@H]4[C@H]5CC[C@@H](O5)[C@H]43)ccc21 2188676522 ZSBYVKPOWUYQJY-FYNNLBNCSA-N 270.376 2.030 10 10 CECE COc1ccc(N2C[C@@H](N)CCC2(C)C)c([N+](=O)[O-])c1 2193506307 FXTWJVDDJXYLCJ-JTQLQIEISA-N 279.340 2.310 10 10 CECE COc1ccc([C@H](C)NC[C@@]2(C)CCN(C)C2)c(O)c1 2193724916 JNHLEDSFNVACDZ-BLLLJJGKSA-N 278.396 2.393 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CO[C@](C)(CC)C1 2189436474 GJDFNHCYBNWCID-CHWSQXEVSA-N 284.360 2.167 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)c1ccccc1N 6859118 OQGUYNPWQOMXBL-UHFFFAOYSA-N 278.333 2.084 10 10 CECE Oc1cc(Cl)ccc1CNCC1CC(n2ccnn2)C1 2184105641 ANQDHGAWMNAPKJ-UHFFFAOYSA-N 292.770 2.378 10 10 CECE CN[C@@H]1CCCc2cc(N3CC(C)(C)[C@H]3CO)ccc21 2184692587 DRZRZQPEHYONBG-HZPDHXFCSA-N 274.408 2.491 10 10 CECE CO[C@H]1C[C@H](CNCc2ccc(O)cc2O)C12CCC2 2190402833 INEPSLOEFDBIEO-DOMZBBRYSA-N 277.364 2.393 10 10 CECE CN1CCN(c2ccc3c(c2)CCC[C@H]3N)[C@@H]2CC[C@H]21 2184763378 GDJIHLLHDMCFLP-BRWVUGGUSA-N 271.408 2.306 10 10 CECE CN(c1ccc(CO)cc1F)[C@H]1CC[C@@H](O)CC1 2042107520 ZUFVKWBQIBWMJC-TXEJJXNPSA-N 253.317 2.058 10 10 CECE Oc1cccc(CNC[C@H]2C[C@H](n3ccnc3)C2)c1O 2184873732 SAWBGPFZLPAQKS-AULYBMBSSA-N 273.336 2.035 10 10 CECE Oc1cccc(F)c1CNCc1ccc(F)cn1 2042600366 YRSLCLKFGQVROX-UHFFFAOYSA-N 250.248 2.355 10 10 CECE C[C@@H]1Cc2cc(N(CCN)CC(F)F)ccc2O1 2044346610 HDDIFWNFYLFIOL-SECBINFHSA-N 256.296 2.040 10 10 CECE COc1ccc(N(C)CC[C@H]2CNC(C)(C)CO2)cc1 2185064375 LEAPMHPKNDOJSV-HNNXBMFYSA-N 278.396 2.289 10 10 CECE O=C(O)C=Cc1cc(F)c(N2C[C@@H]3C[C@H](C2)O3)c(F)c1 2198559236 HXONOVSRUNXHRV-AOOOYVTPSA-N 281.258 2.040 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@H]1[C@@H]2[C@@H]1CCCC2(F)F 2051250718 FXZKGGNIWOGUME-HLTSFMKQSA-N 258.272 2.437 10 10 CECE CC[C@H](O)c1ccc(N2CC[S@@](=O)C[C@@H]2C)cc1 2051909613 SVFUHOMPFNWMQU-KQYVJACZSA-N 267.394 2.087 10 10 CECE Oc1cccc2c1[C@H](N1CCO[C@H](CF)C1)CC2 2052037950 ZSIQGWZKODYMOI-VXGBXAGGSA-N 251.301 2.050 10 10 CECE Cc1nccn1[C@H](C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2185981350 YNLLTYWQURWKNW-PWSUYJOCSA-N 276.344 2.444 10 10 CECE Nc1ccc(NC(=O)NC[C@H]2CCC[C@@H](CO)C2)cc1 2191503487 SUSLVNYIOVHOQY-NWDGAFQWSA-N 277.368 2.189 10 10 CECE CCNC(=O)c1ccc(N)c(Oc2ccc(N)cc2)c1 2198887629 YCGMELTXAPSNQJ-UHFFFAOYSA-N 271.320 2.393 10 10 CECE CCCNCc1ccc(N2C[C@H]3CC[C@]3(CO)C2)cc1 2198882481 TULYLDPNPAOKGR-NVXWUHKLSA-N 274.408 2.395 10 10 CECE COC(=O)[C@@H](CC(C)C)N1CCC[C@H]1CN=[N+]=[N-] 2059058428 HXHKYUSMAKQJIU-WDEREUQCSA-N 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10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)C1CCCC1 692806842 PFMMZNFLKJMSAZ-SECBINFHSA-N 258.347 2.034 10 10 CECE CC1(C)[C@@H]2[C@H](CCCN2CCc2ccc(N)cc2)[C@H]1O 693062927 TWBBNMQXYKJSRZ-HRCADAONSA-N 274.408 2.293 10 10 CECE CN(C)C(=O)c1ccc(Oc2ccc(N)cc2)nc1 95012535 GJKFUEPNUMCJDV-UHFFFAOYSA-N 257.293 2.158 10 10 CECE CCO[C@H]1CC[C@H](CNCc2ccc(O)c(O)c2)C1 2118257486 MUCCIBBPDSUCGS-AAEUAGOBSA-N 265.353 2.393 10 10 CECE Cc1cccc(O)c1CN1C[C@@H](CN)CC12CCC2 2118005839 BKDUOGWPPGBBTQ-CYBMUJFWSA-N 260.381 2.404 10 10 CECE Cc1cc(N2CCO[C@@H](CF)C2)ccc1C[C@H](C)N 2115447023 LMZJFQBCZAAZAJ-WFASDCNBSA-N 266.360 2.059 10 10 CECE C[C@H](N[C@H](C)[C@H]1C[C@H]1C(=O)O)c1cc(F)ccc1O 2118316374 PUUCWDFACQZANE-UJYYTQATSA-N 267.300 2.291 10 10 CECE O=C(NCc1cccc(O)c1O)c1ccc(Cl)cc1O 1176566321 VWHLEBVDEXGSQN-UHFFFAOYSA-N 293.706 2.387 10 10 CECE CCC(C)(C)COC[C@H](O)COc1ccc(N)cc1 2125838415 WIGYQQRJKPGRLA-ZDUSSCGKSA-N 267.369 2.461 10 10 CECE N[C@H]1CCCc2cc(N3CCC[C@@H](CO)C3)ccc21 2128273658 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2106340741 JOFIXBVQLNWBGQ-BBRMVZONSA-N 258.365 2.187 10 10 CECE CO[C@H]1CCN(c2ccc3c(c2)CCC3)[C@H](CN)C1 2106361921 JDALPSGTWKBTSJ-HOTGVXAUSA-N 260.381 2.118 10 10 CECE CCN[C@@](CSc1nccs1)(CC1CC1)C(=O)O 2086617317 LMLVABDOSOWVNC-GFCCVEGCSA-N 286.422 2.468 10 10 CECE CCN(CC)c1ccc([C@@H](NN)c2cnco2)cc1 2106873151 ZJHUZPZQKMWAOC-CQSZACIVSA-N 260.341 2.074 10 10 CECE C[C@@H]1CC[C@]1(O)[C@@H](N)c1ccc(N2CCCC2)cc1 2106939546 CEVBKTNJJCVZQI-UHOFOFEASA-N 260.381 2.448 10 10 CECE CN[C@@H](C(=O)OC)c1ccc(N2CCCCC2)cc1 2107826456 LZMYKXYGZSJVPP-CQSZACIVSA-N 262.353 2.110 10 10 CECE C[C@@]12CSC[C@H]1CN(C(=O)Nc1ccc(N)cc1)C2 2088485027 HMEJNBISZOCQAA-QMTHXVAHSA-N 277.393 2.486 10 10 CECE CN(C(=O)C12CCOC(C)(C1)C2)c1ccc(N)cc1 2108694140 HNRDQHUYKMGZAE-UHFFFAOYSA-N 260.337 2.191 10 10 CECE C[C@@H](N[C@@H]1CCn2nccc2C1)c1ccccc1O 2108928065 QZFJSSVGBFFDIV-VXGBXAGGSA-N 257.337 2.254 10 10 CECE Cc1ccc(O)c(CN2CC(CCCC(=O)O)C2)c1 2089119685 QTLSLLXQGGQJQH-UHFFFAOYSA-N 263.337 2.387 10 10 CECE COCC[C@@H](COC)N(C)c1ccc(CN)c(Cl)c1 2109707676 WUPLHPAJMUHQNX-ZDUSSCGKSA-N 286.803 2.286 10 10 CECE C[C@@]12CC[C@@H](CN1c1ccc3c(c1)NC(=O)[C@@H]3N)C2 2089662979 VTGFDEZTBGGTJT-PKPZWWHKSA-N 257.337 2.017 10 10 CECE CCN1CCC[C@H]1CN(C)c1ccc(OC)cc1N 213460468 DFMPHJCJOZPNNT-LBPRGKRZSA-N 263.385 2.198 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@@](C)(O)COCC 2091864320 SNOJRRFDBJDQAG-GJZGRUSLSA-N 267.369 2.220 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1[C@H]2CCC[C@H]21 2094927745 QNIJLBLLVZAVBK-FOLVSLTJSA-N 258.365 2.458 10 10 CECE COc1cccc(CNC2CC3(CCOC3)C2)c1O 2097791925 FIBUGEWWWLPIQH-UHFFFAOYSA-N 263.337 2.060 10 10 CECE C[C@H](N[C@@H]1C[C@]2(C)CCO[C@H]12)c1cc(O)ccc1O 2097842614 OECAVIXVNWZBLV-FFFUXKDYSA-N 263.337 2.316 10 10 CECE COCC1(NCCc2ccc(N)cc2)CC(F)(F)C1 2098733834 DCIZOAUEOWGSIK-UHFFFAOYSA-N 270.323 2.215 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CCC(F)(F)C1 2099842604 HEBMBQJBPMOJTC-VIFPVBQESA-N 271.263 2.358 10 10 CECE Oc1ccc(CNc2cnn(C(F)(F)F)c2)cc1O 2113097380 OSIYSLNPIMICEF-UHFFFAOYSA-N 273.214 2.383 10 10 CECE C[C@H](O)c1ccc(N(C)CCCn2cccn2)cc1 2113660092 MIFYZWHYPLHALE-ZDUSSCGKSA-N 259.353 2.463 10 10 CECE Nc1ccc(N2CCCN(CC(F)(F)F)CC2)cc1 2114231153 MBODKQSODDPVBF-UHFFFAOYSA-N 273.302 2.343 10 10 CECE C[C@H]1CC(C)(C)CN1CC(=O)Nc1ccc(N)cc1 2114461345 LEIDODLWQPYPJF-NSHDSACASA-N 261.369 2.328 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2C[C@H]3O)c(F)c1 2115465718 UGCBBOQJWMARFC-XDYICZGBSA-N 264.344 2.066 10 10 CECE CO[C@H](CN[C@H](C)c1ccccc1O)CSC 2213593235 WCEDVEQPPQQBNN-GHMZBOCLSA-N 255.383 2.421 10 10 CECE CCC[C@H]1COC[C@@H]1N(C)c1ccc(CN)c(OC)c1 2204537987 VUOLPWHSIDESOH-ZFWWWQNUSA-N 278.396 2.405 10 10 CECE Cc1ccc(CNCc2cccc(C(N)=O)c2)c(O)c1 2204639716 PGISPNSWIUEPHH-UHFFFAOYSA-N 270.332 2.089 10 10 CECE Cc1ccc(CN2C[C@H](S(C)(=O)=O)CC2(C)C)c(O)c1 2204653360 KYYNEESRUSMNLY-CYBMUJFWSA-N 297.420 2.098 10 10 CECE COc1ccc(N2C[C@H](N)CC23CCOCC3)cc1C 2206607553 ZYGWVHLSRULLCB-CYBMUJFWSA-N 276.380 2.090 10 10 CECE Cc1cc(N2C[C@H]3C[C@@H](O)C[C@H]2C3)ccc1[C@H](C)O 2269672533 GAQLHRIMVBWOBC-CTHBEMJXSA-N 261.365 2.398 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Cl)nn1 2218741095 MBDFSVRYLLRELA-NKWVEPMBSA-N 266.692 2.091 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@H](O)[C@H]3C2)cc1F 2219618911 HAINGSLXZVIJNS-GAFUQQFSSA-N 251.301 2.041 10 10 CECE Oc1ccc(F)cc1CN[C@H](C(F)F)[C@H]1CCOC1 2231052625 IAORDKJMSSTZAN-UFBFGSQYSA-N 275.270 2.291 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCN(CCF)CC1 2232096367 PODJOTWQCOMEHR-ZDUSSCGKSA-N 266.360 2.140 10 10 CECE OCc1ccc(N2C[C@@H](O)CC23CCCCC3)cc1 2232296814 FZLDQXAJLQAPNX-HNNXBMFYSA-N 261.365 2.453 10 10 CECE NC[C@@H]1N(c2ccc3c(c2)CCC3)CCOC12CCC2 2233081639 QWHYFWZFJNBVLL-INIZCTEOSA-N 272.392 2.262 10 10 CECE CC1(C)[C@@H]2[C@H](CCN2c2ccc3c(c2)COCC3)[C@H]1O 2235075378 CZTWBYKIBQHHSY-HRCADAONSA-N 273.376 2.355 10 10 CECE C[C@@H]1C[C@@H](CO)CN(c2ccc3c(c2)OC(F)(F)O3)C1 2235076538 OZLDWELQDLQVCX-NXEZZACHSA-N 285.290 2.463 10 10 CECE CCNCc1cc(OC)ccc1N(CCOC)C1CC1 2235974014 VMBQJXOUJWPYIY-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(N2CCC[C@@H](C(C)(C)O)C2)c(CN)c1 2235956744 ZPBFSUAJFTUDMT-CYBMUJFWSA-N 278.396 2.141 10 10 CECE COc1ccc(N2CC(COC(C)(C)C)C2)c(CN)c1 2235969036 YUBFXGRMHBMQRA-UHFFFAOYSA-N 278.396 2.405 10 10 CECE COC[C@]1(C)CCN(c2ccc(OC)cc2C(=O)O)C1 2235952227 LXALRZPIKUVWRV-OAHLLOKOSA-N 279.336 2.256 10 10 CECE COc1ccc(N2CCC(C)(C)[C@H](CO)C2)c(C=O)c1 2235984397 UNZPDURFYYVSLJ-ZDUSSCGKSA-N 277.364 2.353 10 10 CECE CCNCc1cc(OC)ccc1N1C[C@@H](O)C(C)(C)C1 2235953570 CLGNVVZNOLBYEA-OAHLLOKOSA-N 278.396 2.012 10 10 CECE CCCOc1ccc(N2CCOC[C@H]2CCO)cc1 2226764512 HHGJVAFXTLPENB-CQSZACIVSA-N 265.353 2.063 10 10 CECE CC[C@H](O)CN(c1ccc2c(c1)COCC2)C1CC1 2226715177 HQMJGAQKXTZKIE-INIZCTEOSA-N 261.365 2.499 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)C[C@@H]1O 2226700122 KKVPAOIJWWJAKF-SCZZXKLOSA-N 271.263 2.215 10 10 CECE O=c1c2c(ccn1C[C@@H]1CC13CCCCC3)CCNC2 2236808185 VGYFVBIUSIRLJS-AWEZNQCLSA-N 272.392 2.464 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@](C)(O)C2)c(OC)c1 2226804347 DCQSFMHUCCZDNK-IAQYHMDHSA-N 265.353 2.301 10 10 CECE Nc1ccc(CC(=O)N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2)cc1 2236980832 SCSCHJXZEQIOPS-XRGAULLZSA-N 268.360 2.092 10 10 CECE C[C@@]1(C2CC2)CCCN1c1ccc2c(c1)NC(=O)[C@H]2N 2238623823 PKPSOHPPOXGDQT-HOCLYGCPSA-N 271.364 2.407 10 10 CECE CN(C)c1ccc(OCc2cccc(CN)n2)cc1 2229381617 OWLSLYJCYIUDDJ-UHFFFAOYSA-N 257.337 2.185 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)N(C)C[C@@H]2C)c(F)c1 2229729964 GINFCYXUQOMHND-SRVKXCTJSA-N 265.376 2.374 10 10 CECE Cc1cc(N2C[C@@H]3COC[C@H]32)ccc1CNC1CCC1 2240050289 VOCAZNVAVSBTCE-RHSMWYFYSA-N 272.392 2.472 10 10 CECE CCNCc1ccc(N(C)Cc2nncs2)cc1 2255252459 AEPDWNFQKZAAKU-UHFFFAOYSA-N 262.382 2.284 10 10 CECE CSc1ncc(CN[C@@H]2C[C@H]3CC[C@@H](N3)[C@@H]2F)s1 2257098517 XCULTJSZSLADSI-WKJUBOCMSA-N 287.429 2.186 10 10 CECE CSc1ncc(CN[C@H]2CCN(C)C[C@@H]2C)s1 2248704343 YLNKOBUMCPDRAH-ONGXEEELSA-N 271.455 2.295 10 10 CECE CSc1ncc(CN[C@@H]2CC[C@H](CCN)C2)s1 2248718791 ZVUUYQXFSOLSEV-NXEZZACHSA-N 271.455 2.472 10 10 CECE CN(C)CCCCCNC(=O)Nc1ccc(N)cc1 2272964988 CRPGIAKTFBWKLK-UHFFFAOYSA-N 264.373 2.122 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@]3(O)C[C@H]3C2)c(C)c1 2265250116 STQDDGZIXZCCTG-IVMMDQJWSA-N 260.381 2.237 10 10 CECE COC1(CN2CCC[C@@H](CN=[N+]=[N-])C2)CCOCC1 2265563891 KAZOHCNURQIQFM-LBPRGKRZSA-N 268.361 2.204 10 10 CECE Cc1cc(N2Cc3cnn(C)c3C2)ccc1[C@@H](C)N 2269667806 QVUAQZJYUBCKEG-LLVKDONJSA-N 256.353 2.268 10 10 CECE CO[C@@H](CSCCOc1ccc(N)cc1)[C@H]1CCOC1 2290418220 ILBHMNAUAZYGBW-WFASDCNBSA-N 297.420 2.432 10 10 CECE CC(C)[C@@H]1CNCC[C@@]1(O)c1ccc2c(c1)CCN2C 2282802743 AXBMSENVKLGRIH-DOTOQJQBSA-N 274.408 2.132 10 10 CECE C[C@@H](N)c1ccc(N2CCOC(C)(C)[C@H]2CO)c(Cl)c1 2282815537 BCGBKDMREJQTDY-QMTHXVAHSA-N 298.814 2.336 10 10 CECE COC[C@]1(C)[C@H]2C[C@H]2CN1c1ccc(OC)cc1CN 2284630725 QFZLYFPZBNUOTC-DUVNUKRYSA-N 276.380 2.015 10 10 CECE CCn1nncc1CN(C)c1ccc([C@H](C)O)c(C)c1 2285148615 LDJMUGDWBYIBDZ-LBPRGKRZSA-N 274.368 2.296 10 10 CECE COc1ccc(C(=O)N2CCC[C@H]2CN=[N+]=[N-])c(N)c1 2286938357 FHICQORQTFSNDG-VIFPVBQESA-N 275.312 2.192 10 10 CECE O=C(C=Cc1ccccc1)NCCc1ccc(O)c(O)c1 2296807079 OICMBMJTQCLGNP-UHFFFAOYSA-N 283.327 2.470 10 10 CECE CSc1ncc(CNC[C@H]2CNC23CCC3)s1 2301388115 RYLZKQIFGSVPIG-VIFPVBQESA-N 269.439 2.097 10 10 CECE CCOc1cccc(CN2C[C@@H](C)CC[C@H]2CN)c1O 1205805352 QFFFYABYAVENMD-JSGCOSHPSA-N 278.396 2.350 10 10 CECE C[C@@H](N[C@@H]1CC[C@H](CO)C1)c1ccc(F)cc1O 2308203078 YGXGQQFJQOJEOM-JFGNBEQYSA-N 253.317 2.343 10 10 CECE CNCc1cc(F)c(N(CCF)CCF)c(F)c1 2317593535 ATOBFYPOJCVUND-UHFFFAOYSA-N 264.266 2.430 10 10 CECE CC(F)(F)c1ccnc(CN2CC(N=[N+]=[N-])C2)n1 2318862117 AEZJDGCWEQHOMN-UHFFFAOYSA-N 254.244 2.083 10 10 CECE COc1cc(Cl)c(N2CC[C@@H](CO)C2)c(OC)c1 2319566179 YHFDMLDYWWLLKI-SECBINFHSA-N 271.744 2.176 10 10 CECE COc1ccc(N2CC[C@@H]3CC[C@@H](O)[C@H]2C3)c(N)c1 2330958461 RQZCYMBFRYCAPN-COLVAYQJSA-N 262.353 2.017 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H]3C[C@H]3COC)ccc21 2331904885 UTUCZHODMQTHOZ-SQWLQELKSA-N 260.381 2.351 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H]2C[C@H]3CO)ccc1[C@H](C)N 2334467850 DSXXOFUHIDUGSJ-GMZLATJGSA-N 260.381 2.364 10 10 CECE Cc1cnnc(NCCOc2ccc(N)cc2)c1C 2336851580 GHTZCPIDIHYOMB-UHFFFAOYSA-N 258.325 2.167 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@H]2COC3(CCC3)CO2)C1 2338093487 SFXBLCBJARCVMF-RYUDHWBXSA-N 266.345 2.099 10 10 CECE CCc1cnn(CCN(C)c2ccc(CN)cc2)c1 2346174058 IOBUQUYKRPAQAV-UHFFFAOYSA-N 258.369 2.041 10 10 CECE C[C@H](O)c1cc(F)c(N(C)[C@H](C)CN(C)C)c(F)c1 2351786150 NMWVMJXJZDNNET-ZJUUUORDSA-N 272.339 2.404 10 10 CECE COc1ccc(N(C)[C@@]2(CN)C[C@@]3(C)CCO[C@H]32)cc1 2354141541 FVQQOWBEDPJVCT-BZUAXINKSA-N 276.380 2.028 10 10 CECE CCCN(C(=O)[C@@]12C[C@@H](OC)[C@@H]1C2)c1ccc(N)cc1 2354276172 OJNLLLIBWGSIAH-LZWOXQAQSA-N 274.364 2.437 10 10 CECE Cc1occc1C(=O)NC1=NN(c2ccccc2)C(=O)C1 8906587 LXESSIXHUGMHKK-UHFFFAOYSA-N 283.287 2.068 10 10 CECE CS[C@H](C)CCNCc1cc2c(cc1O)OCO2 134251891 XLSNUVCLNZBVNT-SECBINFHSA-N 269.366 2.352 10 10 CECE CC1=NN(c2ccccc2)C(=O)/C1=C/NN1CCCCC1 103740066 MHNDRIZMPHIINP-NTCAYCPXSA-N 284.363 2.284 10 10 CECE CCCN(c1ccc(N)cc1)[C@H](C)C(=O)NCCCOC 63115826 FRJHNKNKUGFTOB-CYBMUJFWSA-N 293.411 2.026 10 10 CECE CCc1cc(Br)c(O)c([C@H](N)CCCO)c1 309343557 IHWJCBABGHDITL-LLVKDONJSA-N 288.185 2.489 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](C)[C@](C)(O)C2)cc1O 2357194592 RYJFMSDFFMACQJ-BFQNTYOBSA-N 278.396 2.270 10 10 CECE CCCN[C@@H](C)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1 34837089 GEKJXFNMEGSQLZ-ZFWWWQNUSA-N 289.423 2.449 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2C[C@@]12CCOC[C@@H]1C2 2357376650 CRHIWYWZEGRODG-PVUWLOKVSA-N 272.392 2.495 10 10 CECE Cc1cnc(CCNC(=O)c2ccc(C)c(O)c2O)s1 182433330 JLGDQCGFDRQSCF-UHFFFAOYSA-N 292.360 2.144 10 10 CECE Nc1ccc(CCC(=O)[C@H]2CCO[C@@]3(CCOC3)C2)cc1 124618423 UESQABFBKUZTRA-YOEHRIQHSA-N 289.375 2.356 10 10 CECE C[C@@H](C(=O)NC1CCCCC1)N(C)c1ccc(CN)cc1 34653807 KNFHUMNZKNATNZ-ZDUSSCGKSA-N 289.423 2.419 10 10 CECE CC(C)(O)c1cc(Br)c(F)c(O)c1O 218541383 IEEPWZKNLXODCY-UHFFFAOYSA-N 265.078 2.227 10 10 CECE Cc1cc(C2(N)CC2)c(O)c(Br)c1O 217943836 JSIOKSYIPBVDOF-UHFFFAOYSA-N 258.115 2.117 10 10 CECE CCCC[S@](=O)CCC(=O)Nc1ccc(N)cc1 40971004 RRYOBHAOBOVZRS-GOSISDBHSA-N 268.382 2.146 10 10 CECE C[C@H]1C[C@@H](C)CN(c2cc3c(cc2N)OCC(=O)N3)[C@@H]1C 229356806 OKQJDFAXROYFTK-OUAUKWLOSA-N 289.379 2.471 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1CCC[C@@H]1C(=O)O 132972437 CDVFOGSTRLHIKC-RTXFEEFZSA-N 291.347 2.413 10 10 CECE CCNCc1ccc(N(C)CC(=O)N(CC)CC)c(F)c1 49038352 ZYOLJSNCCOZWPY-UHFFFAOYSA-N 295.402 2.240 10 10 CECE CC(C)N(C)c1cc2c(cc1Br)[C@@H](N)C(=O)N2 92774886 RZCFESFNGJRRTJ-LLVKDONJSA-N 298.184 2.246 10 10 CECE C[C@@H](N[C@@H](C(=O)O)C1CC1)c1cc(F)ccc1O 94622231 ZYBVJNXUOGAKGL-JMCQJSRRSA-N 253.273 2.045 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@](C)(O)C2)cc1Cl 235220997 XHZWFYRYACFASC-NOZJJQNGSA-N 254.761 2.321 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)c1ccc(O)c(Cl)c1 90259184 STQJYCATSPJAOL-JTQLQIEISA-N 284.703 2.461 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1ccccc1C 90259542 LQOFRVCOWAWOAV-GFCCVEGCSA-N 262.313 2.499 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H]2CO)cc1Br 235216527 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10 10 CECE Nc1ccc(NC(=O)NCCC2(O)CCCC2)cc1 1876153487 ULWKDTQZPYVXID-UHFFFAOYSA-N 263.341 2.086 10 10 CECE CN(CCC(=O)NC(C)(C)C)Cc1ccccc1O 1877524209 QCXBBNODBLTLPJ-UHFFFAOYSA-N 264.369 2.129 10 10 CECE Oc1cccc2c1[C@@H](N[C@H]1CCN3CC[C@H]1C3)CC2 1877892123 GUQYAIWUYYRFPX-IHRRRGAJSA-N 258.365 2.063 10 10 CECE COc1cccc(O)c1CN(CC(=O)O)CC(C)(C)C 1963442928 ZXTDLRDAFUGMMT-UHFFFAOYSA-N 281.352 2.334 10 10 CECE C[C@H]1CSCCCN1c1ccc2c(c1)N(C)C(=O)[C@H]2O 2143613141 DRBWURBPOBBVNV-HZMBPMFUSA-N 292.404 2.028 10 10 CECE C[C@H]1CSCCCN1[C@H](C)C(=O)Nc1ccc(N)cc1 2143619412 NWFDHIKWGLJBHX-NWDGAFQWSA-N 293.436 2.423 10 10 CECE C[C@@H]1CSCCCN1[C@H](C)C(=O)Nc1ccc(N)cc1 2143619414 NWFDHIKWGLJBHX-VXGBXAGGSA-N 293.436 2.423 10 10 CECE Oc1c(F)cccc1CNC1([C@@H]2CCCO2)CC1 1963624514 LUXXMEYTRPCOMM-LBPRGKRZSA-N 251.301 2.333 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)/C=C/CNC(=O)OC(C)(C)C 1885560528 DQGMHOAKQNJMGS-FNORWQNLSA-N 297.359 2.226 10 10 CECE CNCc1ccc(N2CCC[C@H](O)C2(C)C)c(F)c1 1887813260 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2145744482 YVBYUBJSMWDOSA-LBPRGKRZSA-N 282.334 2.429 10 10 CECE Cc1nc(CN2CCCc3cc([C@@H](C)N)ccc32)n[nH]1 2145825710 GOOUOALBXRAZKW-SNVBAGLBSA-N 271.368 2.086 10 10 CECE Cc1nccc(CN2CCc3cc([C@H](C)N)ccc32)n1 2145853140 LGSFQZANULYXHA-NSHDSACASA-N 268.364 2.367 10 10 CECE COC(=O)CC[C@H](N)c1cc(O)cc(C(F)(F)F)c1O 260354618 CESPNBJLQFMMRV-VIFPVBQESA-N 293.241 2.070 10 10 CECE CCOC(=O)CC[C@@H](N)c1c(C)ccc(F)c1O 260712044 BQIAMAXUPZZPDY-SNVBAGLBSA-N 255.289 2.183 10 10 CECE C[C@H](O)[C@@H]1C[C@H]1NCc1ccc(Br)cc1O 1985622425 JNLPGNPSJHYKQY-BKDNQFJXSA-N 286.169 2.014 10 10 CECE Cc1ncccc1C(=O)[C@@H](O)c1ccc(N(C)C)cc1 2147006744 ULTDRYCZECVRML-HNNXBMFYSA-N 270.332 2.372 10 10 CECE COc1ccc([N+](=O)[O-])c(NCc2ccccc2O)n1 163772468 SXENSZZONSIVDH-UHFFFAOYSA-N 275.264 2.316 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@H](N)CC2(CCC2)C1 2151126569 XSJMFKNEJXOQNI-VXGBXAGGSA-N 276.380 2.362 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCCC[C@@H](F)C3)cc21 2152284593 XMTHTLHLDXJSLB-QMTHXVAHSA-N 278.327 2.025 10 10 CECE Oc1ccc(Br)cc1CNC[C@@H]1[C@@H]2CCO[C@H]21 2007576928 MLVYEVHVGAIGIZ-DMDPSCGWSA-N 298.180 2.279 10 10 CECE COc1ccc(O)c([C@H](C)N2CCC(CN)CC2)c1 44511614 ZPJWUAILGQTYCM-NSHDSACASA-N 264.369 2.133 10 10 CECE Nc1ccc(CN(C(=O)c2ccon2)C2CC2)cc1 44584823 WGKAIUYZUGSSKV-UHFFFAOYSA-N 257.293 2.062 10 10 CECE COCCO[C@@H]1CCN([C@@H](C)c2cc(F)ccc2O)C1 2158827450 DOCIOUOYGIVUNT-WCQYABFASA-N 283.343 2.330 10 10 CECE CP(C)(=O)C1([C@H](NN)c2ccccc2O)CC1 2024679417 AFMNDTOQZBFXDM-LLVKDONJSA-N 254.270 2.052 10 10 CECE CCN(Cc1ccc(N)cc1)c1ccnc2ccnn12 2156000515 GNUMAKUUUOBUDR-UHFFFAOYSA-N 267.336 2.338 10 10 CECE CC[C@@H](CNCc1ccc(OC)cc1O)COC 2027331728 NGOWPWIMNPQENR-NSHDSACASA-N 253.342 2.163 10 10 CECE NN[C@@H](c1ccccc1O)c1cccc(F)c1F 2029556081 OUSYACWTILLLSI-ZDUSSCGKSA-N 250.248 2.223 10 10 CECE C[C@@H]1[C@H]2CNC[C@@H]2CN1Cc1ccc(Cl)cc1O 2029649009 RGHQZSCRSPJEAU-IRUJWGPZSA-N 266.772 2.085 10 10 CECE CCOC1=NN(c2ccc(Cl)cc2)C(=O)C1=CN(C)C 2040744303 CHAFHCJWKKGSFV-UHFFFAOYSA-N 293.754 2.482 10 10 CECE C[C@@H]1CCOC[C@H]1N(C)c1ccc(CN)cc1F 2035131186 HQAZRFNVNLKMJT-QMTHXVAHSA-N 252.333 2.146 10 10 CECE C[C@H](N[C@@H]1CCCC[C@H]1CO)c1cc(O)ccc1O 300416247 HLAISRFBAINVFT-COPLHBTASA-N 265.353 2.300 10 10 CECE CN(CCNCc1ccc(O)c(O)c1)C1CCCC1 71376619 AJGWQHDQZHYDLZ-UHFFFAOYSA-N 264.369 2.062 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)NCC(F)(F)F)C1 403791514 UXZPZXHJIHKRDP-ZCFIWIBFSA-N 251.212 2.033 10 10 CECE CO[C@@H]1COCC[C@@H]1N[C@@H](C)c1ccc(C)cc1O 311607533 DVCSMJFWZLYWQB-CORIIIEPSA-N 265.353 2.155 10 10 CECE Nc1cc2c(cc1N1CC3CCC1CC3)OCCO2 311715084 OLARPXHBSBXAEN-UHFFFAOYSA-N 260.337 2.419 10 10 CECE CC[C@@H]1CN(C(=O)CCc2ccc(N)cc2)CCCO1 312178863 CMJQPFVPCPDLOW-OAHLLOKOSA-N 276.380 2.229 10 10 CECE Nc1ccc(-n2nccc2NC(=O)[C@@H]2[C@H]3CC[C@H]32)cc1 2160058171 PILGGPCXIZSIHS-IMRBUKKESA-N 268.320 2.049 10 10 CECE CO[C@H]1CC[C@H](N(C)C(=O)Cc2ccc(N)cc2)CC1 2160162216 QOIMYMYIIREBTC-SHTZXODSSA-N 276.380 2.227 10 10 CECE Cc1cc(C=O)c(C)n1-c1ccc(NS(C)(=O)=O)cc1 2160434398 YDFGUVHXWPRBNY-UHFFFAOYSA-N 292.360 2.278 10 10 CECE CC[C@@H](C1CC1)N(C)c1ccc2c(c1)NC(=O)[C@H]2N 324405149 UIEGOINDGQKWSS-KBPBESRZSA-N 259.353 2.263 10 10 CECE CC[C@H](c1ccccc1O)N1CCO[C@@H](C)[C@@H]1C(=O)O 328071198 BSALSHDLZXZUJP-ZKYQVNSYSA-N 279.336 2.017 10 10 CECE COc1cccc(O)c1CN[C@H]1CC[C@H]2CC[C@H]1OC2 2160737536 YYWVXNPNQBGICC-DETPVDSQSA-N 277.364 2.448 10 10 CECE CCO[C@@H]1CCCC[C@H]1NCc1ccc(O)c(O)c1O 2162073982 KMOVJFWCLAZBEA-DGCLKSJQSA-N 281.352 2.241 10 10 CECE CCN(Cc1c(O)cccc1F)[C@@H]1CCCCNC1=O 2171196820 NWOZPKNHDOQXHA-CYBMUJFWSA-N 280.343 2.022 10 10 CECE C[C@@H](NCC1(O)CCSCC1)c1c(O)cccc1O 702238746 FVWIXKKUZRSXHE-SNVBAGLBSA-N 283.393 2.007 10 10 CECE CNCc1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)cc1C 702400764 LGZFDTOXSCMEOH-WBVHZDCISA-N 273.424 2.102 10 10 CECE CC(C)[C@H](CN(C)C)NCc1ccc(F)c(F)c1O 703230927 YDUVXVAJDCIGAC-LBPRGKRZSA-N 272.339 2.346 10 10 CECE CC[C@@H](C)N(C)CCNCc1ccc(F)c(F)c1O 703212587 GEIFDKHBNOJGQL-SNVBAGLBSA-N 272.339 2.490 10 10 CECE CCNCc1ccc(OC)c(CN2CC[C@@H]3C[C@H]32)c1 707079577 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CC1=C(C)CN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)CC1 382939355 UGEOOIGIFOLQJZ-OAHLLOKOSA-N 271.364 2.209 10 10 CECE c1cc2c(cc1N1CCCN3CCC[C@@H]3C1)CCO2 383823705 MAGJDWPWYDONFI-OAHLLOKOSA-N 258.365 2.296 10 10 CECE C[C@H](N(C)C(=O)COc1ccc(N)cc1)C1(C)CC1 385324733 ILXBODIRTKRSAX-NSHDSACASA-N 262.353 2.295 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2CO3)c(Cl)c1 387134683 BIMXBRQTUVOVIF-DVVUODLYSA-N 252.745 2.337 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1cncn1C 697902649 DTDJFJANTNYTKC-HNNXBMFYSA-N 258.369 2.185 10 10 CECE CNCc1ccc(N2CCO[C@@H](C(F)(F)F)C2)c(C)c1 698819067 CUNJIHVUJAJABA-CYBMUJFWSA-N 288.313 2.482 10 10 CECE CCC[C@@H]1COC[C@H]1NCc1ccc(O)c(O)c1 699558886 UXPVXTSVBCQPRZ-VXGBXAGGSA-N 251.326 2.003 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CC[S@@](C)=O)cc1 399016241 KXXKHGAPFLPQIG-KPZWWZAWSA-N 268.426 2.172 10 10 CECE COc1ccc(N2CCN[C@@H](CC(F)F)C2)cc1OC 2177315829 UPWAMFWIRSKMQF-JTQLQIEISA-N 286.322 2.137 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)Nc1ccc(N)cc1 2168069426 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260.381 2.494 10 10 CECE CCN(CC)CCN(C)c1ccc2c(c1)CC[C@H]2N 2128326803 KHVYVTMWXUKKAF-MRXNPFEDSA-N 261.413 2.411 10 10 CECE CCCN[C@@H]1CCc2cc(N3CC[C@H](O)C3)ccc21 2128328580 OYVASWDKQHJRMX-GOEBONIOSA-N 260.381 2.245 10 10 CECE CC(C)[C@@H]1[C@@H](O)CCN1c1ccc2c(c1)CC[C@H]2O 2128317323 NYWDQKOCBSZPPZ-OWCLPIDISA-N 261.365 2.262 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H](C)[C@H]2C[C@@H]2C(=O)O)c1 2118312193 COVFGJCYNHBLQZ-XZUYRWCXSA-N 263.337 2.460 10 10 CECE C[C@@]1(C(=O)Nc2c(Cl)ccc3nonc23)CCCO1 1327168217 YWUFLGVUWBCTQA-LBPRGKRZSA-N 281.699 2.384 10 10 CECE CP(C)(=O)CCc1noc(Cc2ccc(N)cc2)n1 2120683241 WQBNFRAQARDMCJ-UHFFFAOYSA-N 279.280 2.408 10 10 CECE NCc1cc(F)c(N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1Cl 2120881814 PMAWLVGIAJFQAA-IEBDPFPHSA-N 284.762 2.287 10 10 CECE Nc1ccc(N2CC[C@](O)(c3ccccc3)C2)cc1 2120975051 RCHWYLAMHBCJLL-MRXNPFEDSA-N 254.333 2.367 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@@H](CCO)C(F)F)c(F)c1 2122010638 CYKNLNLTKOULBP-PELKAZGASA-N 277.286 2.331 10 10 CECE CO[C@H](C)c1noc(CN2CCC[C@H]2CN=[N+]=[N-])n1 2123020406 VHESRXVUYPKWEJ-BDAKNGLRSA-N 266.305 2.052 10 10 CECE CN[C@@H]1CCc2cc(N3CC4(CCCO4)C3)ccc21 2128297116 VNOQVLCSMGTOAQ-OAHLLOKOSA-N 258.365 2.263 10 10 CECE O[C@H]1CCCc2cc(N3CCOC[C@H]3CF)ccc21 2128275811 WUOAOWVTYNPWEY-HIFRSBDPSA-N 265.328 2.231 10 10 CECE COc1ccc(N(C)Cc2sc(NN)nc2C)cc1 2126817281 WGUSMIZDWAMDNV-UHFFFAOYSA-N 278.381 2.382 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NC1CC2(C1)CC2(F)F 1331264970 OERNPTSMOOWIJR-RQOWECAXSA-N 295.285 2.415 10 10 CECE Cc1cc(N2CCC[C@]3(CC[C@@H]3O)C2)ccc1CO 2129553368 YZXNOCYOJJXGML-HOTGVXAUSA-N 261.365 2.229 10 10 CECE CCc1nn(C)c(C(=O)NCc2ccc(N)cc2)c1Cl 103194828 OFRMLHDLSIRKMH-UHFFFAOYSA-N 292.770 2.148 10 10 CECE CC(C)CC1(O)CN(c2ccc3c(c2)CC[C@@H]3N)C1 2131839424 ROSBIHXGPGGLFM-HNNXBMFYSA-N 260.381 2.230 10 10 CECE COC(=O)c1cccc(Oc2ccc(N)cc2)c1N 1905737951 JICGILOAYAYOAQ-UHFFFAOYSA-N 258.277 2.430 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CC[C@@]3(CO)C2)c(F)c1 1903839011 RYOGDKPCWHIPEI-WBIUFABUSA-N 264.344 2.054 10 10 CECE Oc1cccc(Cl)c1CNC[C@@H]1[C@@H]2CCO[C@@H]21 1907559796 IECZKPUHCVOUSO-RWEMILLDSA-N 253.729 2.170 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3cccc(O)c3O)C[C@H]21 2133894953 JBHKBOXLIMFJQG-FMCLSXCISA-N 263.337 2.001 10 10 CECE CCOC(CNCc1ccc(N(C)C)cc1)OCC 105762485 IOONPBMVATVEKP-UHFFFAOYSA-N 266.385 2.241 10 10 CECE C[C@@H]1[C@H](O)CCN1c1ccc(CNC2CC2)cc1F 1914236352 MRXRBHRSVVPLPC-MEBBXXQBSA-N 264.344 2.037 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)[C@@H]1C[C@@H]2CC[C@@H]2C1 2134957255 PWMRTJJMGTVZEL-APCWTUGXSA-N 261.365 2.450 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1Cl 1914423114 HCHWFNUZPIOOPW-JRKPZEMJSA-N 255.745 2.353 10 10 CECE CC(C)(C(=O)N1CC[C@@H](N=[N+]=[N-])C1)[C@@H]1CCCO1 1912192247 CFZFKVUKPHHJJL-ZJUUUORDSA-N 252.318 2.103 10 10 CECE CC[C@@]1(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)CCCO1 1912166292 VPGKUWWDWSAFIR-AAEUAGOBSA-N 266.345 2.495 10 10 CECE Cn1cc(CN2CCC(N=[N+]=[N-])CC2)c(Br)n1 1912171274 INSKDSYOLUSUQX-UHFFFAOYSA-N 299.176 2.457 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CO2)C1 1912159535 JAYYYUIQTNUJNY-OLZOCXBDSA-N 272.308 2.039 10 10 CECE CC1(C)[C@H]2CC([C@@](C)(NCCCN=[N+]=[N-])C(N)=O)C[C@@H]21 1912179033 QRIQPFHWYLFEDR-COPLHBTASA-N 279.388 2.203 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cc(O)nc3ccccc23)C1 1912184061 BRTYZXQJJOFOKM-UHFFFAOYSA-N 269.264 2.075 10 10 CECE C[C@@H](Cc1ccco1)C(=O)NCc1cccc(O)c1O 1352670929 OZZGWORRNPMKLB-JTQLQIEISA-N 275.304 2.186 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)Cc2ccncc2)CC1 1912211650 ZBJKBLRATAAYPZ-UHFFFAOYSA-N 259.313 2.173 10 10 CECE CNC(=O)[C@@H]1CCCN1[C@@H](C)c1cc(Cl)ccc1O 217829443 JHSFFCMBCWNAAO-CABZTGNLSA-N 282.771 2.317 10 10 CECE CNCc1ccc(N(C)[C@H](C)CCO)cc1Cl 1916978662 AVVCTQFQNCPNDG-SNVBAGLBSA-N 256.777 2.267 10 10 CECE O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)c1ccc(O)c(O)c1 1917485634 BAHYKONUJMSDRM-WJTVCTBASA-N 273.332 2.120 10 10 CECE CC(C)N1CCC[C@@H](C(=O)N(C)Cc2ccccc2O)C1 1465844724 UMZNHNUSIJNTCD-OAHLLOKOSA-N 290.407 2.471 10 10 CECE C[C@@H]1[C@@H](C)N(Cc2ccc(N(C)C)cc2)[C@H](C)C(=O)N1C 1460300946 AELFBKXOQVMXEI-MGPQQGTHSA-N 289.423 2.192 10 10 CECE CC1(C)CCC[C@H]1NCc1ccc(O)c(O)c1O 226759777 SVNYVIVMCWJQHX-LLVKDONJSA-N 251.326 2.472 10 10 CECE Cc1noc(C)c1[C@H](C)NCc1ccc(O)c(O)c1O 226756662 HZIHYFORRQYSEH-ZETCQYMHSA-N 278.308 2.259 10 10 CECE CC1(C)C[C@@H](O)CN(c2ccc(CO)cc2Cl)C1 1923167354 MUOWCGZNCMBKIO-LLVKDONJSA-N 269.772 2.430 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C23CCC3)cc1 2136740483 ZBGWYSZNPKVSJP-OAHLLOKOSA-N 260.381 2.290 10 10 CECE Cc1nc2c(s1)CN(CCOc1ccc(N)cc1)C2 2136717660 ZXOCOUKJKYJYCI-UHFFFAOYSA-N 275.377 2.428 10 10 CECE COc1ccc(CNC(=O)/C=C\c2cccnc2C)c(O)c1 1556354681 QVGUHXPQYOMWDU-VURMDHGXSA-N 298.342 2.434 10 10 CECE CC(C)(C)c1nc([C@@H](NCCN=[N+]=[N-])C(=O)O)cs1 229259354 HVLFKUDEHWLLGM-MRVPVSSYSA-N 283.357 2.466 10 10 CECE Cc1ccc(C(=O)NCc2ccc(O)cc2O)s1 1639441396 SVEJISGVHUWGLD-UHFFFAOYSA-N 263.318 2.398 10 10 CECE COc1ccc(N2CCC(C)(C)[C@H](N)C2)cc1OC 259307587 QBFCUEBLCUQDKR-CQSZACIVSA-N 264.369 2.267 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)c1cncnc1 229797152 URXLHZSHRDSYFS-UHFFFAOYSA-N 270.336 2.111 10 10 CECE Cc1nccnc1[C@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 1637429965 NWXFUBSYHQNPIU-QZPNVGJNSA-N 299.330 2.087 10 10 CECE Cc1cc(N2CC[C@@H](C)[C@@H](O)C2)ccc1CNC1CC1 230281418 PAPADXHNSBEKJR-PXAZEXFGSA-N 274.408 2.454 10 10 CECE CC(C)[C@]1(C)C[C@@H]1C(=O)NCc1c(O)cccc1O 1647268823 DYUFRNRBUQCFRM-ABAIWWIYSA-N 263.337 2.396 10 10 CECE Cc1ccncc1CC(=O)NCc1c(O)cccc1F 1646035256 UMXRSWKDTWDVFI-UHFFFAOYSA-N 274.295 2.094 10 10 CECE CC(C)N(CCc1cnn(C)c1)Cc1ccc(N)cc1 230764851 QURGSLAZCZQNIK-UHFFFAOYSA-N 272.396 2.455 10 10 CECE Cc1nc(Sc2nccs2)ncc1[N+](=O)[O-] 1650660923 FMCPWPUXZPHZBW-UHFFFAOYSA-N 254.296 2.301 10 10 CECE CCN(CC(N)=O)[C@H](C)c1ccc2ccccc2c1O 231830059 PCQCASSQMGVLMK-LLVKDONJSA-N 272.348 2.414 10 10 CECE CC(=O)N1CCC(NCc2cccc(Cl)c2O)CC1 124671164 DQCAUGRJKMMJRA-UHFFFAOYSA-N 282.771 2.146 10 10 CECE COC[C@H]1C[C@@H]1Nc1c(N)cccc1Br 1962225500 PGOGERWZJFDSLV-XCBNKYQSSA-N 271.158 2.478 10 10 CECE CCc1nnsc1CN1CCC(N=[N+]=[N-])CC1 2299459033 BHSLSQBCGWDCJP-UHFFFAOYSA-N 252.347 2.375 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC(=O)[C@H](C)C2)c1 169147070 DPYZIOVXXQJPJX-SNVBAGLBSA-N 261.321 2.006 10 10 CECE COc1ccc(N(C)[C@H](CN)c2ccc(OC)nc2)cc1 158198190 ZZNHIYTXKDYNQM-OAHLLOKOSA-N 287.363 2.235 10 10 CECE C[C@H](O)CN(C)c1ccc(CNC2CC2)cc1Cl 164014478 VXBJXFLQDMKRRU-JTQLQIEISA-N 268.788 2.409 10 10 CECE COc1cc(C)cc(CN2CC[C@@]3(CCOC3)C2)c1O 164483072 KJVCQMJFQGKSBU-MRXNPFEDSA-N 277.364 2.322 10 10 CECE CCN1N=C(C)/C(=C\c2ccccc2C(=O)O)C1=O 1865674297 XUPANEMVWTVBKM-XYOKQWHBSA-N 258.277 2.006 10 10 CECE C[C@]1(CC(=O)O)CCN(c2ccc3c(c2)OCO3)C1 259354287 JVJMVPJPYXDOCR-CQSZACIVSA-N 263.293 2.106 10 10 CECE COc1ccc(O)c(CNC2C[C@H](C)O[C@@H](C)C2)c1 126531851 CKNANUCSQRQEMG-QWRGUYRKSA-N 265.353 2.446 10 10 CECE CC[C@](N)(CO)CCCN(C)c1ccc(OC)cc1 234177175 OIGIMRCIBQKCBC-OAHLLOKOSA-N 266.385 2.011 10 10 CECE COc1ccc(N(C)C(=O)c2cccc(O)c2O)cc1 126369277 BTQXWBPCSZHMDO-UHFFFAOYSA-N 273.288 2.383 10 10 CECE COc1cccc(O)c1CNC[C@H]1CCOC1(C)C 850409071 JPCFJLSGEFTJJG-LLVKDONJSA-N 265.353 2.306 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1[C@H]2CC[C@H]1CC(F)(F)C2 1148106602 CDCDTUUVFKCPCD-QWRGUYRKSA-N 297.301 2.429 10 10 CECE COC[C@@H]1CC[C@@]1(N)c1ccc2c(c1)CCCN2C 2142415987 FURSEEPWYSUGGK-GOEBONIOSA-N 260.381 2.279 10 10 CECE C[C@@H]1CCc2cc(N(C)C[C@@H]3COCCO3)ccc2N1 2143680189 SVQBBTABJZTQGL-IUODEOHRSA-N 276.380 2.285 10 10 CECE CNCc1ccc(N2CCC[C@@H]2C(=O)N(C)C)c(Cl)c1 2143707314 QXVUZFOXOKMDIE-CQSZACIVSA-N 295.814 2.116 10 10 CECE Nc1ccc(OCCNc2cccc(F)c2N)cc1 1876231443 ZDGYUJMURHTXLH-UHFFFAOYSA-N 261.300 2.481 10 10 CECE CN(Cc1ccccc1O)c1nncc2ncsc12 1877544124 XTCDIPIQGLVHTJ-UHFFFAOYSA-N 272.333 2.428 10 10 CECE C[C@@H](NC(=O)C12CCC(CC1)O2)c1ccccc1O 1877584280 CBIKPXXVBQRPQB-RWWNRMGGSA-N 261.321 2.281 10 10 CECE CN[C@@H]1C[C@H]2C[C@H]1C[C@H]2N(C)Cc1ccccc1O 1877522968 CKIYOYIKBRWEDR-GBJTYRQASA-N 260.381 2.211 10 10 CECE Nc1ccc(NC(=O)N2CCSCC(F)(F)C2)cc1 1878909091 XVJDNJOKEILATM-UHFFFAOYSA-N 287.335 2.485 10 10 CECE COC[C@H]1C=CCN1c1c(F)cc([C@H](C)O)cc1F 1880486371 NVUIGPPYYGUVCN-GXSJLCMTSA-N 269.291 2.409 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](CO)C[C@@H]2C)c(F)c1 1880478213 CYGPOIVQWVRILV-GUBZILKMSA-N 271.307 2.225 10 10 CECE CCN(C)[C@@H]1CCN(Cc2cccc(F)c2O)C1 1308990084 OJOKLSPJGFNUDD-GFCCVEGCSA-N 252.333 2.057 10 10 CECE Oc1cccc(F)c1CNCCCOC[C@H]1CCCO1 1964022988 ZZJAPXTUZOXZPN-GFCCVEGCSA-N 283.343 2.207 10 10 CECE C[C@@]1(CNCc2ccc(F)cc2O)CCCOC1 1964580438 VMYNSKVOXLCFKK-AWEZNQCLSA-N 253.317 2.438 10 10 CECE CN(C(=O)Cc1ccc(O)c(O)c1)c1ccc(O)cc1 2144027199 VLNNZVWFEVANOM-UHFFFAOYSA-N 273.288 2.009 10 10 CECE CC(C)[C@@H]1[C@H](C(=O)O)CCN1Cc1cc(F)ccc1O 1964731642 ATYDBXMSUZWJPD-TZMCWYRMSA-N 281.327 2.462 10 10 CECE Oc1c(F)cccc1CNC1(C(F)F)CCOCC1 1967805086 JSCKMBFDOMPHHM-UHFFFAOYSA-N 275.270 2.435 10 10 CECE N[C@H]1CCN(Cc2cc(F)ccc2O)CC12CCC2 1968001520 NDXXNRZRRTXURC-AWEZNQCLSA-N 264.344 2.235 10 10 CECE CN(C)c1ccc(CN=c2[nH]nc(C(C)(F)F)o2)cc1 1968439094 TVNVNVLSTMPPPU-UHFFFAOYSA-N 282.294 2.281 10 10 CECE C[C@H]1C[C@@H](C)CN(c2ccc3c(c2)N(C)C(=O)[C@H]3N)C1 252087041 GPPZIBHGMBBNLR-RWSFTLGLSA-N 273.380 2.145 10 10 CECE COc1cc2c(cc1OC)N(Cc1n[nH]cc1C)CC2 1970282723 XHJRZCBBZHJRTF-UHFFFAOYSA-N 273.336 2.298 10 10 CECE CCN[C@@H](C)c1ccc(N2CCCNC(=O)CC2)cc1 2145346783 PDHWRNQDECEVKZ-ZDUSSCGKSA-N 275.396 2.074 10 10 CECE CCN[C@H](c1ccccc1O)c1cccn2ncnc12 2150764834 XHGUGOVSENEXRX-CQSZACIVSA-N 268.320 2.134 10 10 CECE CCOC(=O)CCC[C@H]1NCCc2cccc(O)c21 259778732 MHSLIGCZGQSHKZ-GFCCVEGCSA-N 263.337 2.312 10 10 CECE COC(=O)CC1(c2cc(C)c(C)c(O)c2O)CC1 260101575 ISOFVNKXKNYUND-UHFFFAOYSA-N 250.294 2.309 10 10 CECE COC(=O)C[C@H](N)c1c(O)cc2c(c1C)CCCC2 260961599 YUBXSYYDHYMLJV-LBPRGKRZSA-N 263.337 2.142 10 10 CECE OCC1[C@@H]2CN(c3ccc(CNC4CC4)cc3Cl)C[C@@H]12 2146870364 FDBOPPPWMXZVMS-CHWSQXEVSA-N 292.810 2.267 10 10 CECE CCN(c1ccc(CNC2CC2)cc1C)C1CN(C)C1 2146888717 BQSNTTZXMDVARN-UHFFFAOYSA-N 273.424 2.387 10 10 CECE CCc1ccccc1C(=O)NCc1cc(N)ccc1O 161662283 JEJVWMLOKSQZAZ-UHFFFAOYSA-N 270.332 2.467 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C[C@@H]1[C@@H]2CCOC[C@H]21 2150105257 MENGTRFUWCGFFY-GVDBMIGSSA-N 274.408 2.467 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CCNC1CC1 37826600 QLLSRADDFOEMMB-LLVKDONJSA-N 262.353 2.054 10 10 CECE C[C@@H](OCCOC(C)(C)C)C(=O)Nc1ccc(N)cc1 162779195 YMRSCMPJHXMMDF-LLVKDONJSA-N 280.368 2.428 10 10 CECE Oc1c(Cl)cccc1CN1C[C@@H]2CCO[C@H]2C1 2004629134 JBBKTAPRPOFOQU-CABZTGNLSA-N 253.729 2.266 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H](N)c2cccc(O)c2)cc1 2147501387 MJHHWBFAMQXYPA-HOTGVXAUSA-N 272.348 2.192 10 10 CECE CNCc1ccc(N2CCN3CCC[C@@H]3C2)c(Cl)c1 164095504 UNTOLNDKXPUHRD-CYBMUJFWSA-N 279.815 2.344 10 10 CECE COc1cccc(CNC2CC([C@H]3CCOC3)C2)c1O 2151172191 XGKSWOLZFIYNEU-HSBZDZAISA-N 277.364 2.306 10 10 CECE CC1(C)C[C@H](CNC(=O)CCc2ccc(N)cc2)CO1 2159389220 ZSNQFXFYZAGOHV-CYBMUJFWSA-N 276.380 2.133 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1Cc1nccnc1Cl 2009447000 QUXYJMFIWRSCGJ-MRVPVSSYSA-N 252.709 2.405 10 10 CECE CN(Cc1cncn1C1CC1)c1ccc(CN)c(F)c1 2152994281 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2118210392 MAKOWYGIWGWZCK-MNOVXSKESA-N 266.345 2.398 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@H](O)C2CC3(CC3)C2)cc1 2127591954 WSQAHRFACBRYBC-CABCVRRESA-N 260.381 2.304 10 10 CECE COc1ncccc1COCCc1ccc(N)cc1 2119733656 NEFIMYNTRUOQQI-UHFFFAOYSA-N 258.321 2.432 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@@H](F)[C@@H](C(=O)O)C2)c1 2120636828 CXCHYHLCARWZEQ-ZMLRMANQSA-N 267.300 2.116 10 10 CECE CCNCc1ccc(N2CCC=C[C@@H]2CO)c(C)c1 2125931476 GGYAHUQNLYCECT-OAHLLOKOSA-N 260.381 2.232 10 10 CECE C[C@H](NC[C@@H]1C[C@H]2C[C@@H]2CO1)c1ccc(O)cc1O 2122829069 MCKNKJCFNZFZLM-WGBDABJCSA-N 263.337 2.173 10 10 CECE OC[C@H]1CCCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128274222 NJNFNWLWVHWDPY-BLLLJJGKSA-N 261.365 2.265 10 10 CECE O[C@H]1CCC12CN(c1ccc3c(c1)CCC[C@H]3O)C2 2128277073 JFFDLFOZMHKMHQ-CABCVRRESA-N 259.349 2.017 10 10 CECE Cc1cc(N2[C@H]3CC[C@H]2[C@H]2CC[C@H]3O2)ccc1CN 1901498517 YVAFHWITUQIOLE-CAOSSQGBSA-N 258.365 2.352 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C[C@@H]1[C@@H]2COC[C@@H]21 2132390913 RENFWRPXEAYTAM-MUJYYYPQSA-N 260.381 2.372 10 10 CECE CCNCc1cc(F)c(N2CC[C@@H](O)[C@@H]2C)c(F)c1 1914253668 CEOWPVITPSLCES-TVQRCGJNSA-N 270.323 2.034 10 10 CECE CNC(=O)[C@@H]1CCCCN1[C@@H](C)c1cc(C)ccc1O 217812769 NMUCGUXDOXWARZ-JSGCOSHPSA-N 276.380 2.362 10 10 CECE CCOc1cccc(CN2C[C@H](CN)C(C)(C)C2)c1O 1913127785 QOZDWUNXVGTDDF-ZDUSSCGKSA-N 278.396 2.208 10 10 CECE CC(C)(C)O[C@H]1C[C@@H]([C@H](NN)c2ccccc2O)C1 1914030462 SHRRAAUQKKKGFY-WDMOLILDSA-N 264.369 2.490 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1C[C@@H]2CC[C@H](C1)O2 1911852558 HJOBGZBDGAYBLA-OKILXGFUSA-N 273.332 2.460 10 10 CECE CCN(C(=O)CN1CC[C@@H](N=[N+]=[N-])C1)C1=CCCC1 1912150233 QROLCSXZWXTQAO-LLVKDONJSA-N 263.345 2.287 10 10 CECE CCCSC[C@@](C)(NCCCN=[N+]=[N-])C(=O)O 1912187088 FHXLCOGMPLFXDB-SNVBAGLBSA-N 260.363 2.263 10 10 CECE C[C@H]1CCCN(C(=O)CN2CCC[C@H](CN=[N+]=[N-])C2)C1 1912180545 CECKJASPNIZAIM-QWHCGFSZSA-N 279.388 2.267 10 10 CECE CN(CCN=[N+]=[N-])[C@H]1CCO[C@]2(CCSC2)C1 1912210410 JDSMYUJZTVZNDA-WDEREUQCSA-N 256.375 2.283 10 10 CECE 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COc1ccc(C)cc1/N=N/N1CCC(C(N)=O)CC1 1860495548 GRDIDEMHXWYAJY-WUKNDPDISA-N 276.340 2.200 10 10 CECE CN(c1ccc2c(c1)OCCO2)C(C)(C)CCN 258705761 CLXUNBMXTHCVRN-UHFFFAOYSA-N 250.342 2.021 10 10 CECE CCCC(=O)N[C@@H]1CCCN(Cc2ccc(N)cc2)C1 586052955 ROIVGCLOTFOMLS-OAHLLOKOSA-N 275.396 2.150 10 10 CECE CO[C@H]1CN([C@H](C)c2cc(C)ccc2O)C[C@H]1OC 234935783 XCSKJVBMYDZLSC-DFBGVHRSSA-N 265.353 2.107 10 10 CECE C[C@@]12C[C@@H](CO1)N(c1ccc(CN)cc1Br)C2 1941011126 CMWYEGABSGIWBD-GWCFXTLKSA-N 297.196 2.275 10 10 CECE Oc1ccc(CN[C@@H]2C[C@H]3COC[C@H](C3)C2)c(O)c1 2141807085 VSNCTCDTBCZSOB-PJXYFTJBSA-N 263.337 2.003 10 10 CECE C[C@@H](c1cc(O)ccc1O)N(C)C[C@@H]1CCCCN1 235482475 ZZLXMBBLXYIILX-RYUDHWBXSA-N 264.369 2.233 10 10 CECE C[C@H](N[C@H]1CCO[C@@H]1C1CC1)c1c(O)cccc1O 235519074 FDPRYKZXXHIQOT-CCUNJIBTSA-N 263.337 2.316 10 10 CECE N[C@H](c1ccccc1O)[C@H](O)c1occc1Br 1943692117 WYVCNLMYVDKYNO-MNOVXSKESA-N 298.136 2.481 10 10 CECE CCNCc1cc(OC)ccc1N1CC(C)(F)C1 2220418254 XMOKCWROBLDPSW-UHFFFAOYSA-N 252.333 2.353 10 10 CECE C[C@H](NCC[C@]1(C)COCCO1)c1ccccc1O 1875565420 YSPORHWKLGBADA-SWLSCSKDSA-N 265.353 2.238 10 10 CECE ClC=CCNCc1ccc(N2CCOCC2)cc1 1878147987 JJHKEESZEPYIHI-UHFFFAOYSA-N 266.772 2.365 10 10 CECE CC[C@@H]1CC[C@@H](C)N1CC(=O)Nc1ccc(N)cc1 135977389 OTFJDOSGRAZZRR-BXUZGUMPSA-N 261.369 2.470 10 10 CECE CC[C@@H]1CN(c2c(F)cc([C@H](C)N)cc2F)C[C@@H]1O 1880926964 JXEQASFGMVQWRN-RWEMILLDSA-N 270.323 2.192 10 10 CECE C[C@@H]1OCCO[C@H]1CN(C)[C@H]1CCc2cccc(O)c21 2143681614 FUYDJKXDZZEDMX-WHOFXGATSA-N 277.364 2.115 10 10 CECE Oc1ccc(CNc2ccc3c(c2)OCCO3)c(O)c1 19916093 WUGJVFGOLGYQTD-UHFFFAOYSA-N 273.288 2.481 10 10 CECE CNCc1ccc(N2CCC[C@@H](O)C2(C)C)c(F)c1 1887813261 DTZJMBHFQDPONV-CQSZACIVSA-N 266.360 2.285 10 10 CECE Oc1cccc(F)c1CNC[C@@H]1CSCCS1 1964572970 YSORDNDTYQNPEX-SECBINFHSA-N 273.398 2.470 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@]1(C)CCC[C@H]1N 251527786 MEHPDTPYLTZJKG-XFJVYGCCSA-N 276.380 2.429 10 10 CECE Oc1c(F)cc(F)cc1CN1CC[C@@]2(CCCO2)C1 1967823511 ZEHSLKPALWHVRJ-AWEZNQCLSA-N 269.291 2.425 10 10 CECE CCOc1cccc(CN2CC(C)(C)[C@@H]2C(=O)O)c1O 1968204225 QGTQFKGIIFWBCW-ZDUSSCGKSA-N 279.336 2.086 10 10 CECE CC[C@H](C)[C@@H](N[C@H](C)c1cc(O)ccc1O)C(=O)OC 252412481 OCEDPLPWQZVUDE-IMSIIYSGSA-N 281.352 2.336 10 10 CECE Oc1c(CN[C@@H]2C[C@@H]3CCCCN3C2)ccc(F)c1F 1969648408 LFIYVEVKCLPATR-NEPJUHHUSA-N 282.334 2.387 10 10 CECE Oc1ccc(C(F)(F)F)c(C[C@@H]2CCCN2)c1O 258538456 ZHIQEWVSNBIJNR-ZETCQYMHSA-N 261.243 2.411 10 10 CECE Nc1ccc(NC(=O)N(CCO)C2CCCC2)cc1 42526548 HSTSYZVEUCOAPG-UHFFFAOYSA-N 263.341 2.038 10 10 CECE CCOC(=O)CC[C@H](N)c1c(O)ccc(F)c1F 260884511 VVWBTIYNRROTCX-QMMMGPOBSA-N 259.252 2.014 10 10 CECE COC(=O)C[C@H](N)c1ccc(N2CCCCC2)cc1 260821139 CZGIKHAHSCUBOZ-AWEZNQCLSA-N 262.353 2.240 10 10 CECE CC[C@H]1COCCN1CCCOc1ccc(N)cc1 36322411 ZLNRBZOCOABYQV-AWEZNQCLSA-N 264.369 2.149 10 10 CECE CN1CCc2cc([C@H](O)[C@H](N)C3[C@H]4CCC[C@H]34)ccc21 2150911743 YSEZFJYRDCNPHD-CLROSIBMSA-N 272.392 2.086 10 10 CECE Cc1nscc1CN(C)c1cc2c(cc1N)OCCO2 2150274390 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10 10 CECE COc1cc(C)c(N(CCN)CCCN(C)C)c(C)c1 2285040489 KDHNTUHZTLZTNH-UHFFFAOYSA-N 279.428 2.029 10 10 CECE Cc1cc(N2CCC(CC(N)=O)CC2)ccc1[C@@H](C)N 2285145291 BUVADNDSJJKYTH-GFCCVEGCSA-N 275.396 2.107 10 10 CECE Cc1cc(N2CC(c3cnn(C)c3)C2)ccc1[C@@H](C)O 2285166491 LAWPQDWLJUIMJD-GFCCVEGCSA-N 271.364 2.386 10 10 CECE CN[C@@H](C)c1ccc(N2CCCC[C@@H]2C(N)=O)cc1C 2285132565 PFEFZSXIEFQXQE-SWLSCSKDSA-N 275.396 2.120 10 10 CECE FCOc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CNC[C@@H]32)cc1 2295961238 OTEZDVCZJAZUMU-CAPXZKIUSA-N 276.355 2.427 10 10 CECE Cc1cc(O)c([C@@H](C)N2CCN(C(N)=O)CC2)cc1Cl 2286446198 XDNACYGNNLXKBE-SNVBAGLBSA-N 297.786 2.111 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1Cl 2333104503 LZHXTCXMMZUDEH-JLBHGKSJSA-N 280.799 2.437 10 10 CECE N[C@@H]1C[C@H]2C[C@@H]1CN(c1ccc(OC3CC3)cc1)C2 2333674395 FFHBGDWHNYUKSN-XHBSWPGZSA-N 258.365 2.401 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H](N)[C@@H](C3)C2)c(F)c1F 2333670305 LZJBFMLVWUEXQU-GUBZILKMSA-N 268.307 2.147 10 10 CECE CN1CCC2(CCN(Cc3ccc(N)cc3)CC2)C1 2335649837 IHUZLZHTGOSBRN-UHFFFAOYSA-N 259.397 2.187 10 10 CECE C[C@@H](NC[C@@]1(C)CC=CCO1)c1ccc(O)cc1O 2340198343 MQUVNVIGPXAHLE-IAQYHMDHSA-N 263.337 2.484 10 10 CECE Nc1ccc(CNC(=O)[C@H]2C[C@@H](C(F)(F)F)C2)cc1 2352736594 BAUQDGUAMQCNIF-AOOOYVTPSA-N 272.270 2.474 10 10 CECE CN(C[C@H]1[C@@H]2CCCO[C@@H]21)c1c(F)cc(CO)cc1F 2355544480 PIJBSESFRSAWEY-PGUXBMHVSA-N 283.318 2.318 10 10 CECE Cc1cc(N2CCCOCC2)ccc1/C=C/C(=O)O 61920583 VYWKNFCVTZFVJT-GQCTYLIASA-N 261.321 2.320 10 10 CECE Oc1ccc(CNC[C@H]2C[C@]23CCCOC3)c(O)c1 1894129705 WCYNTAMKARFROX-DOMZBBRYSA-N 263.337 2.004 10 10 CECE CC(C)CNCc1ccc(N(CC(N)=O)CC(C)C)cc1 62737820 CNXQPEOSXWNAIU-UHFFFAOYSA-N 291.439 2.380 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cc(F)ccc1O 231732168 QKJZUJRTNPPEKB-UHFFFAOYSA-N 252.249 2.352 10 10 CECE COC[C@@H](O)CN(C)Cc1ccc(N2CCCCC2)cc1 181972598 XSVUWNDNBAACJC-KRWDZBQOSA-N 292.423 2.116 10 10 CECE CC(C)[C@H](C)C(=O)NCCOc1ccc(N)cc1 70122032 CHGIRPFYDVOCIG-NSHDSACASA-N 250.342 2.056 10 10 CECE Oc1ccc(Br)cc1CN1C[C@H]2C[C@H]1CO2 374966742 XMXAHAWCQALQIW-WDEREUQCSA-N 284.153 2.128 10 10 CECE CCC[C@H](C)NC(=O)COCc1ccc(N)cc1 49286991 CPEUTMHDNQTBFA-NSHDSACASA-N 250.342 2.090 10 10 CECE CCN[C@@](C)(CCSc1nccs1)C(=O)O 45596196 QMJOKECEFBQJJW-JTQLQIEISA-N 260.384 2.078 10 10 CECE Cc1nc(C(=O)Nc2ccnn2-c2ccc(N)cc2)cs1 87427723 MHWNJPMHDKYDCR-UHFFFAOYSA-N 299.359 2.472 10 10 CECE CC(C)Oc1ccc(N(C[C@H](C)O)C[C@H](C)O)cc1 49859342 SLHSZPFOHPRMJD-STQMWFEESA-N 267.369 2.042 10 10 CECE CO[C@@H]1CCN([C@@H](C)c2ccc(N(C)C)cc2)[C@@H](CN)C1 226409588 UDUOJJPKAGEFJE-IAOVAPTHSA-N 291.439 2.252 10 10 CECE CC(C)c1ccc(O)c([C@@H]2N[C@@H](C(=O)O)CS2)c1 83236675 VYNUXJHDYCYYPJ-ZYHUDNBSSA-N 267.350 2.304 10 10 CECE Oc1cc(Br)ccc1[C@H]1COCCCN1 96886677 APAYMLAWMBNDCH-SNVBAGLBSA-N 272.142 2.206 10 10 CECE CC1(C)CC[C@@](NCCN=[N+]=[N-])(C(N)=O)c2ccccc21 90257881 AHUCRUDJVFRSHU-HNNXBMFYSA-N 287.367 2.339 10 10 CECE CC(C)N1C(=O)N=C(N)[C@@H]1c1ccc2c(c1)CCCN2C 94515393 XXGPXTFAHZHURJ-AWEZNQCLSA-N 286.379 2.311 10 10 CECE CC[C@H](C)NC(=S)N(C(C)=O)c1ccc(N)cc1 244082122 UDMKTNXJFNHXIK-VIFPVBQESA-N 265.382 2.295 10 10 CECE C[C@H](N[C@@H]1CCC[C@H]1O)c1ccc(N2CCOCC2)cc1 246490924 RVNQCJXOBLCVDQ-IAOVAPTHSA-N 290.407 2.087 10 10 CECE Cc1[nH]nc(C(=O)NCc2ccc3c(c2)CCCN3C)c1C 265195510 ILNZUBWRBOOIDF-UHFFFAOYSA-N 298.390 2.339 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3CCNC[C@@H]3C)ccc21 2163071849 SAVATMYLVLUDOJ-NUTKFTJISA-N 274.408 2.348 10 10 CECE CCN1CCc2cc([C@@]3(O)CCN4CCC[C@@H]43)ccc21 2163076934 SHPSIRPMWBQXOS-SJORKVTESA-N 272.392 2.125 10 10 CECE CN(C)c1ccc([C@@H](NN)C(C)(C)[C@H]2CCCO2)cc1 2163103698 WVDSJZMUJNSGRB-HUUCEWRRSA-N 277.412 2.462 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@@](O)(CC)COC 2163132583 DFQJHOOMRYIVIG-HZPDHXFCSA-N 280.412 2.191 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@](C)(O)CC1CC1 2163134624 AZSWJQBQNZPKSJ-SJORKVTESA-N 274.408 2.491 10 10 CECE COc1ccc(N2C[C@@H]3C[C@]3(CO)C2)cc1Cl 2214328198 BJSXYCCVMNKBCJ-TVQRCGJNSA-N 253.729 2.167 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3C[C@H](N)[C@H]4C[C@@H]43)ccc21 2166247093 WXFPVKMQOSBWOI-JBXGNFEISA-N 272.392 2.086 10 10 CECE C[C@@H](CNCc1ccc2c(c1)CCCN2C)CN(C)C 394265205 NLPVVTKOYYYBIA-AWEZNQCLSA-N 275.440 2.356 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H](CN)C[C@@H]2CCC[C@H]21 2164806121 KNZLIMRPPRHHDH-MROQNXINSA-N 276.380 2.361 10 10 CECE CCN(CC)c1ccc(CNC[C@H](O)COC(C)C)cc1 818964874 JYXLHZFKRPFNEV-KRWDZBQOSA-N 294.439 2.408 10 10 CECE CCNC(=O)CN(CC)c1ccc([C@@H](C)N)c(Cl)c1 723189064 WOUVPGASWLFSFC-SNVBAGLBSA-N 283.803 2.322 10 10 CECE Cc1ncnc(C)c1[C@@H](N)c1ccc(N(C)C)cc1 2130934981 GGUHTGXKVMIXBH-HNNXBMFYSA-N 256.353 2.208 10 10 CECE CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 828884598 GLZMQMVOAQIHQE-MVWJERBFSA-N 263.337 2.191 10 10 CECE COC(=O)C1(CN[C@H](C)c2ccc(N(C)C)cc2)CC1 828959277 KDNCAZJNYOGCLY-GFCCVEGCSA-N 276.380 2.356 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(NC(C)=O)C2)cc1Cl 723183502 SYFKHMIFOPNIQS-JTQLQIEISA-N 295.814 2.335 10 10 CECE CSC[C@@H](CCO)NC/C=C/c1ccc(N(C)C)cc1 835041471 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269.348 2.464 10 10 CECE CC(C)OCCCN1Cc2ccc(N(C)C)cc2[C@H]1CN 82701848 IGEFLMIAKUULDU-QGZVFWFLSA-N 291.439 2.383 10 10 CECE COc1cc(O)c(CNc2ccncc2)c(OC)c1 83439638 YLIVNUKLNKROED-UHFFFAOYSA-N 260.293 2.417 10 10 CECE Oc1cc2c(cc1O)[C@@H](c1ccc(Cl)nc1)NCC2 83621088 WDHMRZXAPYMLIF-CQSZACIVSA-N 276.723 2.381 10 10 CECE Oc1cc2c(cc1O)[C@H](c1cnccc1Cl)NCC2 83724069 ZHPALSZAASRXHP-CQSZACIVSA-N 276.723 2.381 10 10 CECE CCNCc1ccc(N2C[C@@H](O)CC[C@H]2C)c(F)c1 399311710 CKGAJPJDOYOOLW-YPMHNXCESA-N 266.360 2.285 10 10 CECE CN(CCC1CCC1)C[C@@H](O)COc1ccc(N)cc1 701498121 YIXKSASMRITLKE-OAHLLOKOSA-N 278.396 2.131 10 10 CECE C[C@@H]([C@H]1CCCCO1)N(C)C(=O)c1ccc(O)c(O)c1 706064132 YSMUVQMFLPSZGB-IINYFYTJSA-N 279.336 2.127 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](C)[C@H]3C)c(Cl)cc21 706741860 DNVAJTFQTYSMQU-RBDZCENOSA-N 279.771 2.397 10 10 CECE CCNCc1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)cc1Cl 706823706 AWXHCJVKQIOOIR-OKILXGFUSA-N 293.842 2.447 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]2C(C)(C)O)cc1O 707366542 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840977602 ITGMYBZXFRAUDA-VXGBXAGGSA-N 265.353 2.042 10 10 CECE C[C@H](c1ccccc1O)N1C[C@H]2CCC[C@@]2(C(N)=O)C1 2144092374 CAPHWPZVPQYLBF-XHBSWPGZSA-N 274.364 2.041 10 10 CECE C[C@@H](NC(=O)[C@]1(C)CCCCN1)c1ccccc1O 870988297 MEEMGTTYDNYCGO-ABAIWWIYSA-N 262.353 2.102 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@]2(C)CCCO2)cc1O 1876701537 YAJXPBMRCBXKJS-IAQYHMDHSA-N 264.369 2.417 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cnc(N)c(O)c1 1877545201 MUJYEUDKCZRAPT-SECBINFHSA-N 259.309 2.272 10 10 CECE CCc1nocc1CNCc1ccc(F)cc1O 1963208263 CSVMEVJUJQDUIX-UHFFFAOYSA-N 250.273 2.372 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@@H]2[C@H](C)O)c(F)c1 1880927674 LNEAVQRXIZIXSY-MWODSPESSA-N 270.323 2.334 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H](C)[C@@H](CO)C2)c(F)c1 1880927952 NDJWGJQJQOETOB-WCABBAIRSA-N 270.323 2.049 10 10 CECE Cc1cc(N(C)CC[C@@H](C)O)ccc1CNC1CC1 135584385 MNBJRDUUKIVLTQ-CYBMUJFWSA-N 262.397 2.454 10 10 CECE Cc1ccc(CN[C@@H]2CC[C@H]3CN(C)C[C@H]32)c(O)c1 1184387767 NJUWYPQQXMOLLU-RRFJBIMHSA-N 260.381 2.130 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CCCSC[C@H]1C1CC1 2144285034 GXQZPQQMWUTDFE-LBPRGKRZSA-N 293.388 2.456 10 10 CECE Nc1ccc(OCC(=O)NC2(C3CCCC3)CC2)cc1 2143904030 UYKKZDJQZSXYAI-UHFFFAOYSA-N 274.364 2.487 10 10 CECE c1ccc(COc2ccc(N3CCNNCC3)cc2)cc1 1886858163 BGMOKYXMYJIRMP-UHFFFAOYSA-N 283.375 2.180 10 10 CECE CC1(C)CC[C@@]1(C)NC(=O)c1cc(O)c(O)c(O)c1 1889172522 HGIYYEVAOCYEFX-CQSZACIVSA-N 265.309 2.112 10 10 CECE N=c1[nH][nH]c(N)c1N=NC1C2CC3CC(C2)CC1C3 1951315646 ZMTYWPQVLVVBEA-UHFFFAOYSA-N 260.345 2.313 10 10 CECE NCc1ccc(N2CC[C@@H](O)[C@@H](F)C2)c(C(F)(F)F)c1 2144566923 QNSLZQMJCCYYID-CMPLNLGQSA-N 292.276 2.073 10 10 CECE CCCN(Cc1ccccc1O)C[C@@H]1C[C@@H](CO)CO1 1966179501 AEPDNBPTQLKZEU-ZFWWWQNUSA-N 279.380 2.002 10 10 CECE CCCn1nccc1CNCCc1ccc(O)c(O)c1 2148003972 LUOAEZALIVUCRR-UHFFFAOYSA-N 275.352 2.037 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@]2(C)COCCO2)c1 1967514990 FCGFJTQVTAAPPS-WFASDCNBSA-N 265.353 2.157 10 10 CECE COCCC1CC(NCc2ccc(F)cc2O)C1 1967713830 RZNNCGMKMNGXOK-UHFFFAOYSA-N 253.317 2.436 10 10 CECE c1cc2c(cc1CN[C@@H]1[C@@H]3CCOC[C@H]31)CCCO2 1967844374 IXJNGNGNORHWLQ-IIAWOOMASA-N 259.349 2.136 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H]2CCC[C@H]2O)c1 251749364 QREDLEOARCDIJL-COPLHBTASA-N 265.353 2.212 10 10 CECE Cc1ccc(CN2CC[C@@H](C(=O)O)C2(C)C)c(O)c1 1968221578 AMDCMHYNRAQENK-LBPRGKRZSA-N 263.337 2.386 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@@H]3CCCCN3C2)cc1 1969661046 LQZMHJBLVAJHDZ-RDJZCZTQSA-N 273.424 2.469 10 10 CECE COC(C)(C)CC[C@@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2148205637 UANVXGUQVKCWLI-CABCVRRESA-N 280.412 2.319 10 10 CECE OC[C@@H](NCc1ccc(F)c(F)c1O)[C@H]1CC=CCC1 1971223417 XLVUQVGXHRAOBG-GXFFZTMASA-N 283.318 2.477 10 10 CECE CNCC[C@@H](C)N(C)Cc1cc(Cl)ccc1O 2002734898 VASULDPEIMACGD-SNVBAGLBSA-N 256.777 2.475 10 10 CECE CN(C)c1ccc([C@H](O)c2cnn3ccccc23)cc1 2145401758 VGNMMPKBSGLIFC-INIZCTEOSA-N 267.332 2.482 10 10 CECE Cc1ccc(CN(C)c2c(F)cc(CO)cc2F)nn1 2145793349 MVIOOOPUMOHRSU-UHFFFAOYSA-N 279.290 2.192 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](CO)C(F)(F)C2)cc1 2146376099 WERUOTJCLFUSOU-WCQYABFASA-N 284.350 2.421 10 10 CECE CNCc1ccc(N2CC[C@H](CO)C(F)(F)C2)cc1C 2146390150 XJEMUNWCKLNNSA-CYBMUJFWSA-N 284.350 2.168 10 10 CECE OC[C@@H](NCc1cccc(F)c1O)c1ccccc1 158766232 HEFTZTCQKFWYBO-CQSZACIVSA-N 261.296 2.355 10 10 CECE COC[C@@H]1CN([C@@H](C)c2ccccc2O)C[C@H]1COC 2149238706 PEGCUDMSNPHWGA-IHRRRGAJSA-N 279.380 2.294 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)CCOCC1(C)C 2149231750 ZRDAFCHTOTZDHT-GDBMZVCRSA-N 279.380 2.220 10 10 CECE CN(Cc1cccnc1)C(=O)Nc1ccc(N)cc1 36771634 XJUBIYVBFOPPHJ-UHFFFAOYSA-N 256.309 2.328 10 10 CECE N=c1[nH]c(Oc2ccc(N)cc2)ncc1Br 1993194951 GBHUFQBFIKLAIW-UHFFFAOYSA-N 281.113 2.026 10 10 CECE Oc1ccc(Br)cc1CNC[C@H]1CC[C@H]1O 1994680698 YQBUVDHROWDONH-LDYMZIIASA-N 286.169 2.015 10 10 CECE OC[C@H]1[C@H]2CN(c3ccc(CNC4CC4)cc3)CC[C@H]21 2149509029 KYORZGCBFNVDMN-IXDOHACOSA-N 272.392 2.003 10 10 CECE C[C@H](N)c1ccc(N2CCCC[C@H]2CS(C)(=O)=O)cc1 2151284505 BVYYRGSDFCQZEV-WFASDCNBSA-N 296.436 2.110 10 10 CECE CN(Cc1cccc2nccn12)c1ccc(CN)cc1 2151723140 NRLYPYQUXRNUCT-UHFFFAOYSA-N 266.348 2.429 10 10 CECE COc1cc(CN2CCC[C@H]2CN=[N+]=[N-])sn1 2009443834 YGMNMVKPKOAWJO-QMMMGPOBSA-N 253.331 2.426 10 10 CECE Nc1ccc(CCNC(=O)c2nccc(Cl)c2F)cc1 2154336420 QRMXWBFWWCWIMI-UHFFFAOYSA-N 293.729 2.429 10 10 CECE Nc1ccc(CCC(=O)N2C[C@H]3C[C@H]2C(F)(F)C3)cc1 2155851172 LYLIJEJSWZTLGS-AAEUAGOBSA-N 280.318 2.458 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](O)C2(C)C)c(Cl)c1 2023144741 UKTQAQDHHBDELI-QPUJVOFHSA-N 254.761 2.319 10 10 CECE COCC1(CNCc2ccc(F)cc2O)CCC1 294630577 JQENWHCMCZBUGS-UHFFFAOYSA-N 253.317 2.438 10 10 CECE Oc1cc(Cl)ccc1CNCCCc1ncc[nH]1 2029658155 VZDSOMYOHZNTPA-UHFFFAOYSA-N 265.744 2.491 10 10 CECE Nc1ccc(NC(=O)NCCc2cncs2)cc1 2029982393 KAUMQOGDJYNMQB-UHFFFAOYSA-N 262.338 2.090 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1scnc1C 2031159620 MDMOSSWEYUAUBN-RYUDHWBXSA-N 264.350 2.151 10 10 CECE CN(C)c1ccc([C@H](O)c2sccc2CN)cc1 2031509296 IZDVSYBGVAGPBG-ZDUSSCGKSA-N 262.378 2.355 10 10 CECE CN[C@@H](C)c1ccc(N2CCn3ccnc3C2)c(F)c1 62252899 HIFPXQKGRNZLSD-NSHDSACASA-N 274.343 2.323 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H]3C(=O)NC[C@H]32)c(Cl)c1 300166909 YHPRHNWYPJZEEN-OLUVUFQESA-N 293.798 2.075 10 10 CECE C[C@@](O)(CN1CCC[C@H](N=[N+]=[N-])CC1)C(F)(F)F 2038004029 DCTDNJSXIASKAS-DTWKUNHWSA-N 266.267 2.465 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H](C(N)=O)CC[C@H]2C)cc1 300508789 XHBIMBYGBYXSGD-KYOSRNDESA-N 275.396 2.187 10 10 CECE Cc1ccc([C@H](C)N2C[C@H](C)S(=O)(=O)[C@H](C)C2)c(O)c1 401044644 IABZKXPPJSMQHL-XQQFMLRXSA-N 297.420 2.269 10 10 CECE CCN(C(=O)CCc1ccc(N)cc1)[C@H]1CCCOC1 402638229 DGUPRMWMBHBOBE-HNNXBMFYSA-N 276.380 2.229 10 10 CECE CNCc1ccc(N2CCN(C3CC3)C[C@H]2C)cc1C 402707673 QNXWVKKXCSVFTE-CQSZACIVSA-N 273.424 2.387 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)c2cccc(F)c2)C1 403643800 DGSSJKJTLUUXPA-SNVBAGLBSA-N 284.316 2.289 10 10 CECE C[C@@H](NC1CC(n2cncn2)C1)c1cc(F)ccc1O 2159855680 TWBNECIJWYEKKQ-OIKLOGQESA-N 276.315 2.177 10 10 CECE C[C@H](CC1CC1)N(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 2158006490 GJPGTPFPNJCPKB-BMIGLBTASA-N 273.380 2.288 10 10 CECE COc1ccc(N2CC[S@](=O)C(C)(C)CC2)c(N)c1 321680827 RPDSQEMNHPFNCX-IBGZPJMESA-N 282.409 2.015 10 10 CECE CN(C)[C@@H]1CCN(c2ccc(CO)cc2F)C2(CC2)C1 2160272106 IQXKJAKNHSAWHG-CYBMUJFWSA-N 278.371 2.381 10 10 CECE Cc1c(CN2C[C@@H]3C[C@H](CN3)C2)n(C)c2ccccc12 2160653308 ZSRCRRCVIHOLIF-KGLIPLIRSA-N 269.392 2.280 10 10 CECE CN(Cc1c(O)cccc1F)[C@H](CC(=O)O)C(F)(F)F 2160779343 CEGGIDQQRNFCJT-SNVBAGLBSA-N 295.232 2.369 10 10 CECE CCCO[C@@H]1CCN(Cc2cccc(OC)c2O)C1 701674446 VZWLVZURXKCQNG-CYBMUJFWSA-N 265.353 2.402 10 10 CECE CNCc1ccc(N2CCS[C@@H]3COCC[C@@H]32)c(F)c1 2170505793 PDCDLYVTBCWWJI-LSDHHAIUSA-N 296.411 2.256 10 10 CECE CCO[C@H]1CCN(c2ccc(CNCCOC)cc2)C1 701719263 SQHMVZBPROBHCI-INIZCTEOSA-N 278.396 2.038 10 10 CECE CN(CCC1CCC1)c1ccc2c(c1)NC(=O)[C@H]2N 701548632 QSUDMGWXLNDGGL-AWEZNQCLSA-N 259.353 2.265 10 10 CECE Oc1cccc(-c2nc([C@@H]3CCCCO3)no2)c1O 705747169 AYNXFLVOGQRTGX-JTQLQIEISA-N 262.265 2.389 10 10 CECE CC(C)(C)OC1CN(c2ccc(CN)c(F)c2F)C1 707653839 KOHVTHFYVIPCDE-UHFFFAOYSA-N 270.323 2.427 10 10 CECE CN(c1ccc2c(c1)OCCO2)C1C[C@@H]2CC[C@H](C1)N2 2162628433 AMOFPMWPUGJPRD-ONXXMXGDSA-N 274.364 2.177 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@H]2COC[C@@H]2C)cc1 2163157171 ZFWQCGFOSVNBBD-RCBQFDQVSA-N 277.412 2.320 10 10 CECE CC[C@@H]1[C@@H](C)CCN1c1ccc2c(c1)NC(=O)[C@@H]2N 384016745 PITDDWIYCNJLMN-CUOATXAZSA-N 259.353 2.263 10 10 CECE C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc(N)cc2)[C@@H](C)O1 384520984 BAKFPIOWXMQTHD-GIPNMCIBSA-N 263.341 2.298 10 10 CECE Cc1cc(N2CCC[C@@H](C)[C@H]2CCO)ccc1CN 697206711 HCKKSIDJDXDHNW-MLGOLLRUSA-N 262.397 2.441 10 10 CECE CO[C@H](C1CC1)[C@@H](C)NCc1ccc(O)cc1O 388243030 RMUSSMXCJLCCPF-OTYXRUKQSA-N 251.326 2.001 10 10 CECE Cc1nnc([C@@H](C)NCc2cccc(O)c2O)s1 391777655 KXQZWXVKBIYPES-SSDOTTSWSA-N 265.338 2.109 10 10 CECE Cc1nnc(CNCc2cccc(Cl)c2O)s1 391824767 ABUOCHPTVXZQAQ-UHFFFAOYSA-N 269.757 2.495 10 10 CECE CCc1cc(C(=O)NC)n(Cc2ccc(Cl)cc2O)n1 2070025804 MCKLALIFQVFUMA-UHFFFAOYSA-N 293.754 2.212 10 10 CECE CO[C@H]1C[C@@H](CNCc2cc(F)ccc2O)C[C@H]1OC 2174854855 NTKBFAIWVCRKIV-UVGIYENGSA-N 283.343 2.061 10 10 CECE Cc1nn(Cc2cccc(Cl)c2O)cc1C(=O)O 2070218700 CYFIUCCQJWAIJC-UHFFFAOYSA-N 266.684 2.297 10 10 CECE CON(C1CNC1)[C@H](C)c1ccc2ccccc2c1O 2169255630 PVARAMXVDVVAKC-LLVKDONJSA-N 272.348 2.442 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@@H]2OCC[C@H]2F)c1 2179092478 NDDZCSDMWGXOIB-HIFRSBDPSA-N 281.327 2.154 10 10 CECE CN(Cc1cccc(C(N)=S)n1)Cc1ccccc1O 2192593721 JEFAFCDWAPJUTF-UHFFFAOYSA-N 287.388 2.053 10 10 CECE COCc1ccc([C@H](N)c2ccc(N(C)C)cc2)nc1 2199163820 IBHDDVIUWHYAGX-MRXNPFEDSA-N 271.364 2.342 10 10 CECE OCc1ccc(N2C[C@@H]3COCC[C@H]32)cc1C(F)(F)F 2193276752 WPACAZCPKYYALO-ZWNOBZJWSA-N 287.281 2.423 10 10 CECE [N-]=[N+]=NCCCN1CCN(C(=O)C2CCCCC2)CC1 2182588003 VTPBEZJYUXMJJN-UHFFFAOYSA-N 279.388 2.411 10 10 CECE CC1(C)CC[C@H](C(=O)O)CN1Cc1ccc(O)c(O)c1 2193509945 JJEXXMVQQAIEGX-NSHDSACASA-N 279.336 2.173 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@@H]1CCC2CC1C2 2189644084 YUXUUERIGMQDFR-KOHJWAIASA-N 273.380 2.328 10 10 CECE Nc1ccc(CN2CC3(CCCC3)C[C@@H]2C(=O)O)cc1 2197589183 PBCCMJGLPOWDJK-CQSZACIVSA-N 274.364 2.488 10 10 CECE CCCOc1cc(N2C[C@H]3CCC[C@]3(N)C2)ccc1N 2198067399 NVIAKMHSZGVDSM-WBMJQRKESA-N 275.396 2.375 10 10 CECE CCCN[C@@H]1CCc2cc(N3C[C@H](O)[C@H](F)C3)ccc21 2184730634 XZUIMPSYTGURMF-OAGGEKHMSA-N 278.371 2.193 10 10 CECE O[C@H]1CCc2cc(N3CC[C@H]4C[C@H](O)CC[C@@H]43)ccc21 2184738258 RGRNCLKCUMCARY-YVVXQTMVSA-N 273.376 2.406 10 10 CECE CN1C[C@@H]2CN(c3ccc4c(c3)CC[C@@H]4N)C[C@@]2(C)C1 2184739514 ICSJXKBJJDRWSW-XOKHGSTOSA-N 271.408 2.021 10 10 CECE CCCN[C@H](C(=O)OCC)c1c(O)cccc1F 2042596425 BPWOTKHHAGHKDO-LBPRGKRZSA-N 255.289 2.135 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CCCCO1 2042581899 WTPAGJFHOPMWDU-NSHDSACASA-N 251.326 2.060 10 10 CECE C[C@@H]1CO[C@@H](CN[C@H](C)c2c(O)cccc2O)C1 2047502949 PBBAHMYBZSETPF-HBNTYKKESA-N 251.326 2.173 10 10 CECE CN[C@H](C)c1cc(F)c(N(CCO)[C@H]2C[C@H]2C)c(F)c1 2194690996 PVLAHRBMEMGECI-RULNRJAQSA-N 284.350 2.452 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC(C)(C)OC[C@@H]1CN 2194637555 NJLLDSMURRNPCT-PWSUYJOCSA-N 282.359 2.030 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@H]2CCCC(F)(F)[C@H]21 2051250719 FXZKGGNIWOGUME-IWSPIJDZSA-N 258.272 2.437 10 10 CECE NCc1ccc(N2CC3(CC(F)C3)C2)c(F)c1F 2051887012 XEXIIWSYNXAVLB-UHFFFAOYSA-N 256.271 2.362 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3C[C@@H](O)[C@H]2C3)c(Cl)c1 2057055636 ZELZTQKTKJRVEX-NYHSCFHFSA-N 267.756 2.353 10 10 CECE C[C@H](N)c1ccc(N(C2CCC2)C2COC2)cc1O 2105056728 NCTRKMAQGBQQQL-JTQLQIEISA-N 262.353 2.170 10 10 CECE CC(C)Oc1[nH]c(=NCc2ccccc2O)ccc1N 2191623801 ICPAHGFCVDTWFN-UHFFFAOYSA-N 273.336 2.191 10 10 CECE C[C@H]1C[C@@H](N(C)C(=O)c2cccc(O)c2O)CS1 2069125526 VARSOVWQFODUHJ-DTWKUNHWSA-N 267.350 2.064 10 10 CECE C[C@@](F)(CNCc1ccc(O)cc1O)C(F)(F)F 2071842803 CQACNQQOWARURH-SNVBAGLBSA-N 267.222 2.478 10 10 CECE CS[C@@H]1CNC[C@@H]1N(C)[C@@H](C)c1ccccc1O 2072467928 YBIHGWDDIBMVTL-VHRBIJSZSA-N 266.410 2.088 10 10 CECE CCOC1CN(c2c(F)cc([C@@H](C)N)cc2F)C1 2074223761 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CCCNCc1ccc(N2CCNC(=O)[C@H]2CC)c(C)c1 110682986 AADWEHUASBZNEQ-OAHLLOKOSA-N 289.423 2.209 10 10 CECE CCC1CCC(O)(CNC(=O)c2cccc(O)c2O)CC1 126625876 YFXJQBHFZLUBOE-UHFFFAOYSA-N 293.363 2.159 10 10 CECE CCOc1ccc(O)c(CN[C@@H](C)[C@H](C)OC)c1 189114842 YBMFPSXVZZIUKS-QWRGUYRKSA-N 253.342 2.304 10 10 CECE CCCN(CC(=O)NC)c1ccc(CNC(C)C)cc1F 42405590 AZHWMOSFCQQYOQ-UHFFFAOYSA-N 295.402 2.286 10 10 CECE CC[C@H](CO)NCc1cc(C)cc(Br)c1O 134748270 FHOGMYJPDGVISA-SNVBAGLBSA-N 288.185 2.324 10 10 CECE CCOC(=O)[C@H](C)N[C@H](C)c1ccc(C)cc1O 49370433 CAAFAAGYSBXPEA-MNOVXSKESA-N 251.326 2.303 10 10 CECE CCN(CC(=O)N(C)C)c1ccc(/C=C\C(=O)O)c(C)c1 220143961 CAJTWSVNISAZFE-CLFYSBASSA-N 290.363 2.007 10 10 CECE COc1ccc(CN(CC(=O)O)C(C)(C)C)c(O)c1 92450921 PVAICTDPIHXDDR-UHFFFAOYSA-N 267.325 2.086 10 10 CECE COC[C@H]1CCCN(c2ccc(CN)c(F)c2)C1 234860694 TYDGARBYTWHTAB-NSHDSACASA-N 252.333 2.147 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@@H]1CCCNC1 234327908 WRUMUNRCYRHSPJ-LLVKDONJSA-N 268.788 2.477 10 10 CECE Nc1ccc(OCCCN2CCCN3CCC[C@H]3C2)cc1 249986833 JEMFBBWXKCIXFB-INIZCTEOSA-N 289.423 2.208 10 10 CECE Cc1cnc(NC(=S)Nc2ccc(N)cc2)cn1 242833755 FRXBJEUNZPNJHK-UHFFFAOYSA-N 259.338 2.176 10 10 CECE C[C@H](N[C@H]1CC[C@H](O)CC1)c1cc(O)ccc1O 253118837 HGBJUQBRKNOYKM-DCAQKATOSA-N 251.326 2.052 10 10 CECE NCC1(c2c(O)c(O)cc(F)c2Br)CCC1 258711822 ZCIYIBCEWIEGSS-UHFFFAOYSA-N 290.132 2.380 10 10 CECE C[C@H](O)c1c(F)cc(O)c(O)c1Br 258440648 UHDIVOFAACQQCQ-VKHMYHEASA-N 251.051 2.053 10 10 CECE Cc1cc(N2C[C@@H]3CC[C@@H](O)[C@H]3C2)ccc1CNC1CC1 252883973 VVQJTERNSPRFLG-JCGIZDLHSA-N 286.419 2.454 10 10 CECE O=C(O)[C@H]1CCN[C@@H]1c1ccc(C(F)(F)F)cc1O 1952830352 VIUIKUCEITYVMT-WCBMZHEXSA-N 275.226 2.146 10 10 CECE CN1CCc2cc([C@@]3(N)CCc4cccnc43)ccc21 2163069077 AESGTKOYQUWHFU-KRWDZBQOSA-N 265.360 2.222 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H]1C[C@@H]2C[C@@H]2CO1 2163139247 WORQXXLASPEUOZ-HDEZJCGLSA-N 272.392 2.364 10 10 CECE CCN1CCc2cc([C@H](N)[C@H](O)CC(F)(F)F)ccc21 2163141807 YJXKQJXAJCRCKQ-OLZOCXBDSA-N 288.313 2.382 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)C1(O)CC(F)(F)C1 2163227663 BVXOOWUJZPEXBI-CYBMUJFWSA-N 282.334 2.447 10 10 CECE CCc1nc(C(=O)NCc2cc(OC)ccc2O)c(C)o1 802783603 YSWWJASIXKPZMM-UHFFFAOYSA-N 290.319 2.190 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@@]2(CCNC2)C1 2163335029 PUDMVGNOFMSJPZ-WBMJQRKESA-N 276.380 2.234 10 10 CECE CC[C@@H]1OCC[C@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1O 802782059 MZHMVVIDVMXXNJ-NVBFEUDRSA-N 293.363 2.393 10 10 CECE COC1CCN(c2ccc(CN(C)CCCO)cc2)CC1 295387344 QQLSTIOKZBIIJZ-UHFFFAOYSA-N 292.423 2.116 10 10 CECE O=C(c1cnn(CC2CC2)c1)c1cccc2c1NCC2 2163946937 ORSUNFCPTGBVPA-UHFFFAOYSA-N 267.332 2.492 10 10 CECE C[C@H]1C[C@@H](C)N(c2ccc3c(c2)OCCCO3)CCN1 2164452806 JDYFJBVWBCGRRE-QWHCGFSZSA-N 276.380 2.425 10 10 CECE CCN(Cc1ccc(N)cc1)c1ccc2nccn2n1 2164608714 KYIRQDYFENWIJN-UHFFFAOYSA-N 267.336 2.338 10 10 CECE CSC(C)(C)C[C@@H](NCCCN=[N+]=[N-])C(=O)O 385344162 YXBCPIYIRIQAGY-MRVPVSSYSA-N 260.363 2.261 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C3(CCC3)C2)c(C)c1 2165056983 GLZGLKKLMNGRHW-MRXNPFEDSA-N 274.408 2.456 10 10 CECE CCNC(=O)CN(CC)c1ccc([C@H](C)NCC)cc1 723185558 SHGMVUGGKFGXAD-ZDUSSCGKSA-N 277.412 2.320 10 10 CECE C[C@H](O)C1(NC/C=C/c2ccc(N(C)C)cc2)CC1 827586597 ZGDIRZKMUUAVIL-IHVVCDCBSA-N 260.381 2.269 10 10 CECE F[C@@H]1OCCC[C@H]1NCc1ccc2c(c1)CCO2 585384326 NWOKDFWNXCUGMN-TZMCWYRMSA-N 251.301 2.186 10 10 CECE Oc1ccc(Cl)c(F)c1CN1CCNC[C@@H]1C(F)F 843125111 WPTIMYWTKQROET-SECBINFHSA-N 294.704 2.224 10 10 CECE CN(C)c1ccc(/C=C/CN[C@@H]2CNCCC2(F)F)cc1 841080025 MHGOOXPNEHYWKK-NHZBNJEXSA-N 295.377 2.353 10 10 CECE CN(C)c1ccc(/C=C\CN[C@@H]2CCNC2(C)C)cc1 841085632 JBLHXURGLYYNJV-OGZRUICASA-N 273.424 2.496 10 10 CECE Cc1cc(O)c(CNC[C@@H](CO)[C@@H]2CCOC2)c(Cl)c1 840940748 FEZJHDDXNYHYJK-NEPJUHHUSA-N 299.798 2.089 10 10 CECE CCCOc1ccc(CNCC[C@H]2CNC(=O)C2)cc1C 922781084 MGTZTHQFTLBGSO-OAHLLOKOSA-N 290.407 2.400 10 10 CECE COc1nc(C(=O)NCCCSc2nccs2)co1 859352254 OZBQEKFITNLJDM-UHFFFAOYSA-N 299.377 2.052 10 10 CECE COc1ccc(CNC(=O)NC2CC(C)(C)C2)c(O)c1 852698319 OYTOZFBLQHDRIV-UHFFFAOYSA-N 278.352 2.389 10 10 CECE CN1CCCN(C(=O)C=C2CCNCC2)c2ccccc21 852871873 XYJMCEINWZQUJX-UHFFFAOYSA-N 285.391 2.169 10 10 CECE CC[C@H](NC[C@H]1COCCN1C)c1ccc(N(C)C)cc1 858520667 HQHIRKFMTVRNPZ-IRXDYDNUSA-N 291.439 2.124 10 10 CECE C[C@H]1CCC(=O)CN1Cc1ccc(N2CCOCC2)cc1 932877570 IWGWRZYCKLHKMT-AWEZNQCLSA-N 288.391 2.077 10 10 CECE CC[S@](=O)CCN[C@@H](C)c1cc(F)cc(F)c1O 756574672 FULMHCBZOVAGFN-ASCAZGACSA-N 277.336 2.090 10 10 CECE C1=C[C@H]2CC[C@H]1ON2Cc1ccc(N2CCOCC2)cc1 931571898 RSUMOGNEZVZWNX-IRXDYDNUSA-N 286.375 2.358 10 10 CECE COc1ccc(N(C)Cc2nc(C)cc(O)n2)cc1 844352972 LPQXVYZWZILCEA-UHFFFAOYSA-N 259.309 2.136 10 10 CECE CCN(CC(=O)NC(C)C)Cc1c(O)cccc1Cl 133196515 RAPCXTGVVBVKSF-UHFFFAOYSA-N 284.787 2.392 10 10 CECE CCCCN(CC(N)=O)[C@@H](C)c1ccc(F)cc1O 132867662 IVNJRUWLPIHMHN-JTQLQIEISA-N 268.332 2.180 10 10 CECE C[C@@H](NCC1(CCO)CC1)c1cc([N+](=O)[O-])ccc1O 779086328 VJTXRFYVCLGQPF-SNVBAGLBSA-N 280.324 2.114 10 10 CECE CP(C)(=O)CCC(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213589994 JNGOOUTVTAWJQG-RKDXNWHRSA-N 258.262 2.347 10 10 CECE CCO[C@]12CCC[C@@]1(NC(=O)c1cc(O)cs1)CCO2 889806468 LSASTANQIQOZEK-KGLIPLIRSA-N 297.376 2.259 10 10 CECE COc1ccc(CNCc2ccc(N)cc2)c(O)c1 83430417 ZEQIUTMTHPAUQG-UHFFFAOYSA-N 258.321 2.273 10 10 CECE Oc1ccc(O)c([C@@H]2NCCc3cccc(O)c32)c1 83594429 ODMCFNKEHAHNGH-HNNXBMFYSA-N 257.289 2.039 10 10 CECE CC(=O)C1(C(=O)NCc2cccc(Cl)c2O)CC1 890761831 ZQJXTRUWMVFMTK-UHFFFAOYSA-N 267.712 2.031 10 10 CECE NCc1ccc(N2CCC23CCOCC3)c(F)c1 707612516 CTSYFWJWOLUBAF-UHFFFAOYSA-N 250.317 2.044 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(C(F)(F)F)c2)C[C@@H]1CO 709374667 MLXZGAZLNVLPJZ-MWLCHTKSSA-N 288.313 2.229 10 10 CECE CCC[C@H]1COC[C@@H]1N(C)CCOc1ccc(N)cc1 688261054 MEVXZWGPTZEQIS-BBRMVZONSA-N 278.396 2.395 10 10 CECE O=C(NCC1C[C@@H]2[C@@H](C1)C2(F)F)c1cccc(O)c1O 693384326 XLIKQNFVYSDOKR-NXEZZACHSA-N 283.274 2.119 10 10 CECE C[C@@H](NC1CCC(C(N)=O)CC1)c1cc(F)ccc1O 94617548 DONOOOHXMMCRAC-GRZMOONWSA-N 280.343 2.226 10 10 CECE O=C(c1nncc2ccccc12)N1Cc2cccc(O)c2C1 1152572420 DCLKRZTVUKHMKY-UHFFFAOYSA-N 291.310 2.491 10 10 CECE COCCNCc1ccc(N(C)[C@@H]2C[C@@H]2C)c(F)c1 2116305288 TXFXIPIQWUAFGG-XHDPSFHLSA-N 266.360 2.406 10 10 CECE COc1ncnc(NCc2cccc(C)c2O)c1C 1160768816 BCKFGMBZKDOBJC-UHFFFAOYSA-N 259.309 2.420 10 10 CECE CCNCc1ccc(N2C[C@@H]3CCO[C@@H]3C2)cc1C 2115406811 MHQPMNCMJQWZTG-GOEBONIOSA-N 260.381 2.330 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H]1CCCCC[C@@H]1O 2115929745 LPARWSVZTMPRFW-CABCVRRESA-N 266.360 2.414 10 10 CECE NC(=O)[C@H]1CCCC[C@H]1NCc1c(O)cccc1Cl 2117475143 LVNFZHAFRYFHLL-JOYOIKCWSA-N 282.771 2.179 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@@H]1CC[C@]2(C)C[C@@H]12 2128957102 ZHJZEPKKGRXMSG-FIXISWKDSA-N 261.321 2.358 10 10 CECE COC[C@H]1CN(c2ccc(CCN)c(C)c2)C[C@@H]1C 2118635407 WVENSXDMXJLZPF-DZGCQCFKSA-N 262.397 2.215 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C2C[C@@H]3CC[C@H](C2)O3)C1 2124927428 QJVHJSPMRXNXNS-HSTDOPHLSA-N 264.329 2.245 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@H]2C[C@@H]3CC[C@H](C2)O3)CC1 2124924974 FQUHXGJFYOTLIW-YHPBZONMSA-N 264.329 2.245 10 10 CECE NCc1cc(F)c(N2C[C@@H]3CC[C@@H](O)[C@H]3C2)cc1Cl 2120880131 VSJBJTMMRMULQR-QEVYDEPDSA-N 284.762 2.145 10 10 CECE Cn1ccnc1CCn1ccc2ccc(CCN)cc21 229746236 COCPJYXIFRBRSX-UHFFFAOYSA-N 268.364 2.119 10 10 CECE O[C@H]1CCCc2cc(N3C[C@@H]4CC[C@H](C3)O4)ccc21 2128274709 QLLXZHYNBXCLHH-LZWOXQAQSA-N 259.349 2.424 10 10 CECE CCN(CC1CN(C)C1)c1ccc2c(c1)CC[C@H]2N 2128309287 QLCJYOWJBFHXEJ-MRXNPFEDSA-N 259.397 2.021 10 10 CECE COC1CC2(C1)CN(c1ccc3c(c1)CC[C@H]3O)C2 2128322403 NZMSXRVCJKMGEJ-OAHLLOKOSA-N 259.349 2.281 10 10 CECE CCN1CCN(c2ccc3c(c2)CC[C@@H]3N)[C@H](C)C1 2128322159 PJVVTDQMLNMMRU-WBMJQRKESA-N 259.397 2.163 10 10 CECE CN(Cc1ccn(C)n1)c1ccc2c(c1)CC[C@H]2N 2128308667 ICNQGPUJUSPFQC-OAHLLOKOSA-N 256.353 2.003 10 10 CECE Nc1ccc(CC(=O)OCCCOCC2CC2)cc1 2128340664 GHULFXNZZRTLBD-UHFFFAOYSA-N 263.337 2.171 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1C[C@H](CO)[C@@H]2C[C@@H]12 1906624359 KIEFRRCANFGYQC-JXVAYASWSA-N 252.745 2.351 10 10 CECE CCN1CCN([C@@H](C)c2ccc(OC)cc2O)C[C@@H]1C 211381602 XLCFUQRFZOSBCI-STQMWFEESA-N 278.396 2.488 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2O)[C@@H]1CCOC[C@H]1F 2130201719 SZGLOOLOCLLFGD-KFWWJZLASA-N 265.328 2.229 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)[C@@H]1CCOC[C@H]1F 2130207733 WWBGYSMWDOCYPD-GMTAPVOTSA-N 269.316 2.218 10 10 CECE Cn1ncc(CN2CCc3cc(CN)ccc32)c1Cl 2133392579 FQTSOYLFJASGHI-UHFFFAOYSA-N 276.771 2.095 10 10 CECE COC[C@@H]1C[C@@H]1CN(C)c1ccc(CN)c(F)c1F 2133441562 YLWNRKVCBAKHDX-MNOVXSKESA-N 270.323 2.142 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C23CCC3)cc1 1914415711 OUQUOTCXAIQTHL-HNNXBMFYSA-N 260.381 2.290 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3ccc(O)cc3O)C[C@H]21 2133899524 WHUDFBHHCQTPTH-FMVNMVDZSA-N 263.337 2.001 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](N(C)c3ccc(CN)cc3)[C@H]2C1 2133975300 PHZSPLYSWONORI-DMRZNYOFSA-N 260.381 2.395 10 10 CECE CC[C@H]1CCN(c2ccc(CN)c(F)c2)CCO1 1913643516 NCBGASGMOHWXOX-ZDUSSCGKSA-N 252.333 2.290 10 10 CECE CC1(C)C[C@](C)(CO)CN1c1ccc(CN)cc1F 2134835457 NDXFGLCMDAXIKM-HNNXBMFYSA-N 266.360 2.272 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CC2(CCCO2)C1 1911831693 MEPNZBOCGMFLEY-UHFFFAOYSA-N 273.332 2.462 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)C[C@@H]2CCCOCC2)C1 1912175313 KPVQJZKTIGWGFF-VXGBXAGGSA-N 266.345 2.495 10 10 CECE CO[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)c1ccccc1 1912183448 PIXRYYJENFNNBN-VXGBXAGGSA-N 260.297 2.285 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(CC(=O)N2CCCCC2)C1 1912187470 HMCYMQOQPBMCAZ-LBPRGKRZSA-N 265.361 2.021 10 10 CECE CN1CCC[C@@H]1CCN1CCC[C@H](CN=[N+]=[N-])C1 1912163567 LCUXFKAHYBNOQM-CHWSQXEVSA-N 251.378 2.493 10 10 CECE [N-]=[N+]=NC1CN(CC(=O)N(C2=CCCCC2)C2CC2)C1 1912150675 WZURPMSLMYXSPP-UHFFFAOYSA-N 275.356 2.430 10 10 CECE CCC(CC)NC(=O)[C@H](C)N1CC[C@@H](N=[N+]=[N-])C1 1912143132 BAHHFHJBHOUNTN-GXSJLCMTSA-N 253.350 2.064 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(CCn2cc(Cl)cn2)C1 1912202049 BBDWNKPUGCKBJZ-SECBINFHSA-N 254.725 2.169 10 10 CECE Cc1nnc(CCCN2CCC[C@@H](N=[N+]=[N-])C2)o1 1912208458 SPHXUULKBHTVRA-SNVBAGLBSA-N 250.306 2.085 10 10 CECE C[C@@H](NC[C@@H](C)N(C)C1CC1)c1cc(O)ccc1O 217602272 OXRPFXUQTPCUJP-GHMZBOCLSA-N 264.369 2.231 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@@H](CN)C(C)(C)C1 1913120498 WIUUYIXCEYUXBT-GHMZBOCLSA-N 264.369 2.076 10 10 CECE COC[C@@H]1CCCN(CCCOc2ccc(N)cc2)C1 234696637 GXFYSDIDERQNLM-CQSZACIVSA-N 278.396 2.396 10 10 CECE COC[C@@H]1CC[C@H](N(C)Cc2cc(N)ccc2O)C1 1918681970 QHIPZEJMTWZDOM-RISCZKNCSA-N 264.369 2.221 10 10 CECE COC[C@H]1CC[C@H](NCc2cccc(O)c2O)C1 1918651654 GKPYZACCFQUKSA-JQWIXIFHSA-N 251.326 2.003 10 10 CECE Cc1cc(CO)ccc1N1CC[C@]2(CCC[C@H]2O)C1 1918990143 FOZVEDLSPJJFTO-HZPDHXFCSA-N 261.365 2.229 10 10 CECE NC(=O)Nc1cc(NC(=O)c2cc(O)cs2)ccc1F 1298634828 DAMJOGJPCSGGIJ-UHFFFAOYSA-N 295.295 2.336 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCSC[C@@H]1C(=O)O 2136340867 PUFYKOUPKPGKKS-GZMMTYOYSA-N 285.340 2.094 10 10 CECE COC(=O)CC[C@@H](N)c1c(O)cccc1Br 1536070894 MCPMLELOWWQTFG-MRVPVSSYSA-N 288.141 2.108 10 10 CECE C[C@H](N[C@@H]1CCC[C@H]1N(C)C)c1c(O)cccc1O 1921737780 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C[C@@H]1[C@@H](NCc2ccc(F)cc2O)CCN(C)[C@@H]1C 2139879196 GJRYUVBSWONMOL-WDMOLILDSA-N 266.360 2.350 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@H](C(C)(C)N)C1 2139879362 HIJMXPQIAVWOHU-MNOVXSKESA-N 264.369 2.218 10 10 CECE CCC12COC(CNCc3ccc(O)cc3O)(C1)C2 2140437786 RBMRALYGSKKADF-UHFFFAOYSA-N 263.337 2.147 10 10 CECE CNCc1ccc(N2C[C@@H]3CC[C@H](C2)O3)c(Cl)c1 164082906 LBZFZZQFONBHMW-TXEJJXNPSA-N 266.772 2.427 10 10 CECE CC1(C)CC[C@H](CO)N1c1ccc2c(c1)CC[C@H]2O 2140858332 JPRWFYDYNADMAB-UKRRQHHQSA-N 261.365 2.406 10 10 CECE CC(C)COCCN[C@@H](C)c1ccc(O)cc1O 167560348 BGBHLIOSGFTJGJ-NSHDSACASA-N 253.342 2.421 10 10 CECE CCc1ccc(/N=N/N2CCN(C(C)=O)CC2)cc1 1860483139 FNYILTONOWWBCO-FOCLMDBBSA-N 260.341 2.412 10 10 CECE Cc1cc2c(cc1N(C)[C@H](CO)C(C)C)OCCO2 258957053 XLTSIUIHKQRLOO-CYBMUJFWSA-N 265.353 2.219 10 10 CECE CCNCc1ccc(N2C[C@@H](OC)[C@H](OC)C2)c(Cl)c1 233545982 WZSBGWRUVRKEAP-HUUCEWRRSA-N 298.814 2.300 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1C[C@H](O)C12CCC2 1875444058 OERLXEGUPRWFNA-FZMZJTMJSA-N 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CN(CCNCc1cc(Cl)ccc1O)C(=O)C1CC1 2265832274 XYTTZNIKKFNITH-UHFFFAOYSA-N 282.771 2.004 10 10 CECE CCc1ccc(C=C2C(=O)NC(C)=C2C(=O)OC)cc1 2294037444 FYAPJWAHGGOUBB-UHFFFAOYSA-N 271.316 2.209 10 10 CECE CCN1C(=O)C(=Cc2cnn(CC)c2C)SC1=S 2295452450 IHZVPVWUBQWMET-UHFFFAOYSA-N 281.406 2.433 10 10 CECE c1cc2c(cc1N1CCC[C@H]3CCNC[C@H]31)COCC2 2290220421 YRPAIWZSJUNAGH-WMLDXEAASA-N 272.392 2.338 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](O)C[C@H]3C2)c2c1CCC2 2284523570 QJXZWFWIVSIAOJ-ITGUQSILSA-N 273.376 2.391 10 10 CECE Cc1cc(N2CC[C@@H](OCCCO)C2)ccc1[C@H](C)O 2285174769 IDCITEZVLXYSAI-DZGCQCFKSA-N 279.380 2.026 10 10 CECE COC[C@]1(C)COCCN1c1ccc([C@H](C)O)c(C)c1 2285156062 ABYJPQSATCZIOX-XJKSGUPXSA-N 279.380 2.290 10 10 CECE Cc1cc(N(C)C[C@H]2OCCO[C@H]2C)ccc1[C@H](C)O 2285162736 HGEUAFQAGPKFEH-HEHGZKQESA-N 279.380 2.288 10 10 CECE Cc1cc(N(C)CCCn2cncn2)ccc1[C@@H](C)O 2285166565 UJBVWTWTFJAANN-CYBMUJFWSA-N 274.368 2.166 10 10 CECE COc1ccc(N2CC[C@@H]3[C@H](CO)[C@@H]3C2)c(OC)c1C 2295463295 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CC[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@](C)(O)C3)cc1 2339635037 XDVFVGUXJHBVIU-BJKJVOPESA-N 261.365 2.480 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CCS[C@H](CO)C2)c1C 2340851055 NZFHCOCOECNZBM-OLZOCXBDSA-N 280.437 2.237 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1Cc1cnn(CC(F)F)c1 2343163468 ODLUCBCUHYYFAQ-SNVBAGLBSA-N 270.287 2.423 10 10 CECE CC(C)[C@H]1C[C@@H](O)CN1c1ccc2c(c1)OCCO2 2344604799 RTAFMEMTMFEOAW-CHWSQXEVSA-N 263.337 2.053 10 10 CECE COc1ccc(N2CC(F)(F)[C@@](C)(CN)C2)c(C)c1 2351661910 PNPPUIRUIPYHME-ZDUSSCGKSA-N 270.323 2.424 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@@H]2O[C@H]3CC[C@H]2C3)CC1 2352539089 MZVASFPFTPADEV-FIQHERPVSA-N 264.329 2.245 10 10 CECE C[C@@H]1CC(N2CCC[C@@H]2CN=[N+]=[N-])C[C@@H](C)S1(=O)=O 2352604672 NQSPHJNWJAKSKE-GMTAPVOTSA-N 286.401 2.115 10 10 CECE COc1ccc(N(C)[C@]2(C(=O)O)CC[C@H]2SC)cc1 2353474882 RGBBWQHHYUFHFX-TZMCWYRMSA-N 281.377 2.480 10 10 CECE C[C@@H](NC[C@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)c1cc(O)ccc1O 2353918741 UVKZPOMNMUHHTR-XVBGGAKZSA-N 275.348 2.172 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H]2C(C)(C)C)cc1O 2356184157 DFHQGRXKAXABOQ-YVLXSGLVSA-N 279.380 2.431 10 10 CECE COc1ccc(N2CCN(c3ccc(C=O)o3)CC2)cc1 50544094 LTXBLSVEHSFRFC-UHFFFAOYSA-N 286.331 2.427 10 10 CECE C[C@@H](N[C@@H]1CCCC[C@@H]1O)c1ccc(O)cc1O 51991501 IQFDKVZZBPOZRR-WQAKAFBOSA-N 251.326 2.052 10 10 CECE O=C(N[C@@H](C(F)F)C1CCC1)c1ccc(O)c(O)c1 1893187486 HEJQQUWJHGNJPV-LLVKDONJSA-N 271.263 2.261 10 10 CECE Oc1c(F)cccc1CNC[C@H]1C[C@@]12CCCOC2 1894135713 SCGFUVZJKKHFFZ-IUODEOHRSA-N 265.328 2.438 10 10 CECE N[C@@H](CC(=O)O)c1cc(Cl)c(Cl)cc1O 308983388 SVBHJAIHWOHBAM-ZETCQYMHSA-N 250.081 2.174 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)CCCN 122331873 VTLZQOWYWQNAMK-AWEZNQCLSA-N 291.439 2.476 10 10 CECE CCCN(CCN(C)C)Cc1cccc(C)c1O 124573926 JXNNVUHWPVUOIF-UHFFFAOYSA-N 250.386 2.474 10 10 CECE CN[C@H](CO)c1ccc(OCc2ccccc2)cc1O 309645952 YWFHYONGTJJUIP-OAHLLOKOSA-N 273.332 2.224 10 10 CECE C[C@@H](NCCc1cn(C)cn1)c1cc(F)ccc1O 313251096 HZMACTUTAASJFA-SNVBAGLBSA-N 263.316 2.158 10 10 CECE CC(C)C[C@@H](N[C@H](C)c1ccc(O)cc1O)C(=O)N(C)C 36924558 WUAJHWKWIAWVNN-BXUZGUMPSA-N 294.395 2.251 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@H](O)COC(C)(C)C)c1 182460083 XQSXAOJIKCNFCO-RYUDHWBXSA-N 297.395 2.227 10 10 CECE COc1ccc([C@@H](N[C@H](C)CO)c2ccccc2)c(O)c1 35602914 GSHYOHOOTFECMH-PXAZEXFGSA-N 287.359 2.461 10 10 CECE O=C(NCCc1ccccc1)Nc1cc(O)c(O)c(O)c1 217278662 BBWIHOJFKAEVKM-UHFFFAOYSA-N 288.303 2.168 10 10 CECE [N-]=[N+]=NCCCNS(=O)(=O)c1ccc(Cl)s1 42013229 CSQUBHKRCVOSQC-UHFFFAOYSA-N 280.762 2.380 10 10 CECE C[C@H](CN1CCCC1)NCc1cc(F)ccc1O 226586101 UDTZAXSIEQNPPE-LLVKDONJSA-N 252.333 2.105 10 10 CECE C[C@H]1CC[C@@H](N(CC(N)=O)Cc2ccc(N)cc2)C[C@@H]1C 85027187 GVKUDRMXYDTFLM-HEHGZKQESA-N 289.423 2.381 10 10 CECE O=C(O)CC1(CSc2ncc([N+](=O)[O-])s2)CC1 226766178 OJGUBVPKXWILNI-UHFFFAOYSA-N 274.323 2.398 10 10 CECE CC(C)(C)OC(=O)Nc1ccc([C@@H]2C[C@H](O)CN2)c(O)c1 1952564760 OGNHBTSNXXZJGU-JQWIXIFHSA-N 294.351 2.135 10 10 CECE CCOC(=O)C(C)(C)CNCc1cccc(C)c1O 2139757941 NPYLOTKUSNUXTP-UHFFFAOYSA-N 265.353 2.380 10 10 CECE CCCN(c1ccc(CN)c(F)c1)[C@@H]1CCOC1 381440071 LBUQSCAVSZTYOG-CYBMUJFWSA-N 252.333 2.290 10 10 CECE COC(=O)c1ccccc1NC(=O)c1ccc(O)c(O)c1 227015055 MNPSYCFXMLGBGW-UHFFFAOYSA-N 287.271 2.137 10 10 CECE C[C@@H](NC[C@@H]1CCO[C@@H]1C)c1ccc(O)cc1O 235202121 SIGCHEJCMIOYBM-MXWKQRLJSA-N 251.326 2.173 10 10 CECE C[C@H](NC[C@@H]1CCCCO1)c1cc(O)ccc1O 42812401 OBXGZEYVRGFHAX-JQWIXIFHSA-N 251.326 2.318 10 10 CECE Oc1cc(Br)c([C@H]2CCNC2)c(F)c1O 258772885 XHICHKGTNPWXON-YFKPBYRVSA-N 276.105 2.076 10 10 CECE C[C@H]1CCC[C@](CO)(NCc2ccc(O)c(O)c2)C1 53115513 ACUHEQGKRYXUBP-NHYWBVRUSA-N 265.353 2.129 10 10 CECE CCOc1cccc(CN2CC([C@@H]3CCOC3)C2)c1O 365559357 HZZPZXVOAAATSP-CYBMUJFWSA-N 277.364 2.259 10 10 CECE C[C@@H](N[C@H]1CC[C@H](C(=O)O)CC1)c1c(O)cccc1O 709937256 HMABWSHNDMYNGV-GMTAPVOTSA-N 279.336 2.392 10 10 CECE N[C@@]1(c2ccc(N3CCCC3)cc2)CCN2CC[C@H]1C2 2163107296 RRLDMTUKKXUHBE-DOTOQJQBSA-N 271.408 2.166 10 10 CECE CN1CCCc2cc([C@H](N)CCn3ccnc3)ccc21 2163104833 GOIAEGILBLEEHD-OAHLLOKOSA-N 270.380 2.356 10 10 CECE CCc1ccnc([C@@H](NN)c2ccc(N(C)C)cc2)c1 2163133781 PNVWITZTKLAOJL-INIZCTEOSA-N 270.380 2.263 10 10 CECE CN1CCc2cc([C@H](NN)[C@@]3(C)CCCCO3)ccc21 2163136481 SULMWWOBWLREEU-JKSUJKDBSA-N 275.396 2.143 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2C[C@H]3OCC[C@H]3O2)cc1 2163179727 FGGHKNSOIDGKEA-DANNLKNASA-N 277.364 2.123 10 10 CECE COc1ccc(N2CCC[C@@]3(CO)CCC[C@H]23)c(N)c1 2165233225 JMAGHBHLSJUGAJ-JKSUJKDBSA-N 276.380 2.409 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC[C@@]2(CCNC2)C1 2163333641 IECXPXRCEVNHFW-LRDDRELGSA-N 276.380 2.234 10 10 CECE N[C@H](C(=O)O)c1cc(Cl)cc(C(F)F)c1O 714071137 PJNNGWPCIYWRLI-LURJTMIESA-N 251.616 2.068 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCCC1(F)F 813728918 BIDSDQMTDOXBHR-FUEXJSSKSA-N 283.274 2.415 10 10 CECE COC(=O)c1cc(N(C)C)ccc1OC(F)(F)F 575397097 KUENSSDIZVAPSS-UHFFFAOYSA-N 263.215 2.438 10 10 CECE CCc1cccc(CN[C@@H]2CC[C@H](C)S(=O)(=O)C2)c1O 827165401 YBMOOEAUAXSLLK-SMDDNHRTSA-N 297.420 2.010 10 10 CECE CCCN(CCO[C@H]1CCOC1)c1ccc(CN)cc1 724973651 IZMYPXJUNPOBMU-INIZCTEOSA-N 278.396 2.167 10 10 CECE C[C@H](NCC[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 903217435 ANNZZIKXCCICLM-KBPBESRZSA-N 289.423 2.272 10 10 CECE CN(C)c1ccc(/C=C/CN(CCO)C2CC2)cc1 835026218 SGJNMUNMBAHLQQ-ONEGZZNKSA-N 260.381 2.223 10 10 CECE CC(=O)CCN(C)C(=O)c1cc2cc(O)c(O)cc2s1 901248433 ZQNHRUAITTWAQI-UHFFFAOYSA-N 293.344 2.364 10 10 CECE CN(C)c1ccc(/C=C\CNCCCn2ccnn2)cc1 835048369 QOCMZSQQNGAOAY-HYXAFXHYSA-N 285.395 2.037 10 10 CECE CN(C(=O)COC[C@@H]1CC1(C)C)c1ccc(N)cc1 1897078855 VBTGFJYBNBLEJW-NSHDSACASA-N 262.353 2.294 10 10 CECE C[C@@H](N[C@@H]1CCN(C2CCC2)C1=O)c1cc(F)ccc1O 858602649 FSCBPVWCGMJUID-QMTHXVAHSA-N 292.354 2.335 10 10 CECE CC[C@H](N[C@H]1C[C@H](C(N)=O)C1)c1ccc(N(C)C)cc1 858494361 QIFQZSNUCAOYAX-YDHLFZDLSA-N 275.396 2.057 10 10 CECE CCOC[C@@H]1CCCN1c1ccc([C@H](C)O)c(O)c1 696591443 VGIGBINNHRNUKH-AAEUAGOBSA-N 265.353 2.451 10 10 CECE CN(CC(N)=O)c1ccc(CNC(C)(C)C)cc1Cl 163966844 ZAXJEYZLDWAJHC-UHFFFAOYSA-N 283.803 2.150 10 10 CECE CC(C)C1(S(=O)(=O)N2Cc3cccc(O)c3C2)CC1 867691275 UOPJZLWDKJXTNB-UHFFFAOYSA-N 281.377 2.226 10 10 CECE COC(=O)[C@@H]1CCN(Cc2cc3c(cc2O)CCCC3)C1 768442831 ODVVUFKOQUTBIT-CQSZACIVSA-N 289.375 2.266 10 10 CECE Nc1ccc(NC(=O)CC(F)(F)C(F)F)cc1 884009272 RDLRBLKKOQARMU-UHFFFAOYSA-N 250.195 2.498 10 10 CECE CCCCNC(=O)CSCc1ccc(N)cc1 58236821 YRRKDJXDBCXDIT-UHFFFAOYSA-N 252.383 2.418 10 10 CECE C[C@@H](NC(=O)/C=C\c1cnccn1)c1ccc(N(C)C)cc1 775403266 IMYUZUYORWVHAM-OYVUYXNMSA-N 296.374 2.433 10 10 CECE NNc1nc2ccc(F)c(F)c2n1Cc1ccc(N)cc1 75950620 CWPQNTVLLNVZJC-UHFFFAOYSA-N 289.289 2.231 10 10 CECE CC(C)Sc1ccc(C(=O)C(=O)C(=O)O)cc1 77434527 QWBJUDVLTTYVEK-UHFFFAOYSA-N 252.291 2.024 10 10 CECE CCc1cnc(/C=C2\C(=O)NN(c3ccccc3)C2=O)s1 783707226 NUMDJPSFXCUTLA-XYOKQWHBSA-N 299.355 2.167 10 10 CECE CNC(=O)[C@H]1CCCN1[C@H](C)c1cc(Cl)ccc1O 133609525 JHSFFCMBCWNAAO-BXKDBHETSA-N 282.771 2.317 10 10 CECE CC(C)(C)[C@@H](N)c1nnc(-c2ccc(O)c(O)c2)o1 83458778 SFDOHJOWULAUHJ-JTQLQIEISA-N 263.297 2.194 10 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CCOC[C@@H]1CN(c2ccc(CN)cc2Cl)CCO1 705829500 RBMOJKNVJDQZFC-LBPRGKRZSA-N 284.787 2.040 10 10 CECE Nc1ccc(NC(=O)CCCN2CC[C@H]3C[C@@H]32)cc1 706988738 ONJZUGKJDPFQIV-FZMZJTMJSA-N 259.353 2.082 10 10 CECE CN(c1ccc(CNC2CC2)cc1)[C@H]1CCC[C@H]1O 709294470 CAYMKXNQEFKGNT-JKSUJKDBSA-N 260.381 2.288 10 10 CECE Nc1ccc(OCCNC(=O)C2CC(C3CC3)C2)cc1 714432868 HGNLKXLPTDSGDZ-UHFFFAOYSA-N 274.364 2.200 10 10 CECE C[C@@H](NCc1cccnc1O)c1ccc(F)cc1O 714964524 PDQNMWMRBWDLGI-SECBINFHSA-N 262.284 2.483 10 10 CECE C[C@H](NC[C@H]1[C@@H](C(=O)O)C1(F)F)c1cc(F)ccc1O 715296063 LPOCTYQDJXDLBJ-IHBFAXJASA-N 289.253 2.148 10 10 CECE Cc1cc(CO)ccc1N1CCOc2cccnc2C1 716471622 KOMNOWQABXTTGX-UHFFFAOYSA-N 270.332 2.281 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H]2CNC[C@@H](C2)C1 719049053 HTWSIGMCYKLNCK-QJPTWQEYSA-N 264.344 2.134 10 10 CECE CNCc1ccc(N2CCCCC[C@H]2CO)cc1C 133867302 PGGPGGLLRJSNOT-INIZCTEOSA-N 262.397 2.456 10 10 CECE CCC[C@@](C)(NCc1ccc2c(c1)CCN2C)C(=O)O 86732095 SWGWIROGYAMUQR-MRXNPFEDSA-N 276.380 2.412 10 10 CECE 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273.279 2.493 10 10 CECE CN(C(=O)c1cccc(O)c1O)C1CC2(CSC2)C1 2353371207 PPGUAGCGLYZWHC-UHFFFAOYSA-N 279.361 2.065 10 10 CECE COC[C@H]1C[C@@H](O)[C@H](N2CCCC[C@H](CN=[N+]=[N-])C2)C1 2354211919 POKQXRPKMFPHEX-AAVRWANBSA-N 282.388 2.185 10 10 CECE C[C@@H](N[C@H]1C[C@@H]2CC[C@@]1(CO)C2)c1c(O)cccc1O 2354527300 RRVHCECASUHNDD-AZLWOZFGSA-N 277.364 2.300 10 10 CECE CN(C)Cc1ccccc1CNCc1ccc(O)c(O)c1 20128588 AHVHEXCXPBYSFJ-UHFFFAOYSA-N 286.375 2.449 10 10 CECE CC[C@H](C)[C@@H](NCc1ccc2c(c1)CCN2C)C(=O)OC 50286619 ZHEHUQWPEJEQHV-BLLLJJGKSA-N 290.407 2.356 10 10 CECE C[C@H](O)c1ccc(N2CCCCC23COC3)cc1O 1892827291 IGROAZNIMBJXFB-NSHDSACASA-N 263.337 2.205 10 10 CECE O=C(N[C@H](C(F)F)C1CCC1)c1cccc(O)c1O 1893188187 TVGMJQKLLLGXAL-JTQLQIEISA-N 271.263 2.261 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCCN(C)C2)c(C)c1 53246428 LSSJKAIJQMXKLA-OAHLLOKOSA-N 261.413 2.245 10 10 CECE CCN1CCc2cc([C@H](N)CCCC(=O)OC)ccc21 1952053771 UYHFZUKWQQPFQY-CQSZACIVSA-N 276.380 2.412 10 10 CECE COCCN(c1ccc([C@@H](C)N)c(O)c1)C(C)C 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2.257 10 10 CECE Cc1c(CN2C[C@@H](N)C[C@H]2C)n(C)c2ccccc12 702642884 HOFFPAKFUCWYIN-YPMHNXCESA-N 257.381 2.408 10 10 CECE CN(Cc1ccc(F)c(F)c1O)Cc1nccn1C 703440449 WQZBLVTYEAFQLM-UHFFFAOYSA-N 267.279 2.036 10 10 CECE C[C@H]1Cc2cc(N3CCCNCC(F)(F)C3)ccc2O1 2162657121 GGFYTBVWBDQTII-NSHDSACASA-N 282.334 2.445 10 10 CECE c1cc2c(cc1N1CC[C@@H]3CCNC[C@H]3C1)CCCO2 2162663547 DAIKCDSTWVQVPM-ZFWWWQNUSA-N 272.392 2.447 10 10 CECE CCOC[C@@H]1CN(c2ccc([C@@H](C)O)cc2F)CCO1 705850591 KBFOVTMMEJKAOX-YPMHNXCESA-N 283.343 2.121 10 10 CECE CN1CCC[C@@H](NCc2c(O)cccc2Br)C1 706855630 IOKZQZZPXAZRJW-SNVBAGLBSA-N 299.212 2.339 10 10 CECE C[C@@H]1CC[C@@H](N(C)C(=O)c2cccc(O)c2O)CS1 689536767 CXBLCWGDLDLPLE-NXEZZACHSA-N 281.377 2.454 10 10 CECE CNCc1cc(F)c(N2CC[C@H]3COC[C@H]3C2)c(F)c1 690297942 HAZWNOWOMPDLPE-NWDGAFQWSA-N 282.334 2.157 10 10 CECE CN1CCc2cc([C@@]3(O)C[C@@H](CN)C34CCC4)ccc21 2173224024 MSPJTKWCUVVVQA-YOEHRIQHSA-N 272.392 2.015 10 10 CECE C[C@H]1[C@@H](N)CCCN1Cc1ccc(Br)cc1O 691384412 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CC[C@](O)(C(F)F)[C@H](NC)c1ccc2c(c1)CCN2C 2178795361 VIAYOSKQUFSVAN-UKRRQHHQSA-N 284.350 2.346 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)C1[C@H]2CCC[C@H]12 2167424188 JAFNUKUMWIWLOQ-XJNFMUPTSA-N 274.408 2.420 10 10 CECE COc1ccc(N(C)[C@@]2(CN)COC3(CCC3)C2)cc1 2179039785 KEXQESJRALLJDY-HNNXBMFYSA-N 276.380 2.172 10 10 CECE COc1cccc(Cn2nc(CC(C)C)cc2N)c1O 2070171341 AZHQQRKNFMTADS-UHFFFAOYSA-N 275.352 2.426 10 10 CECE COc1ccc(Cn2ncc(C3CC3)c2N)c(O)c1 2070247226 UXKLOEVAFRQTFJ-UHFFFAOYSA-N 259.309 2.105 10 10 CECE CN1CCc2cc(CNC[C@@H]3[C@@H]4CCCO[C@H]43)ccc21 2176450550 HMLQHHKWULMASY-ZMSDIMECSA-N 272.392 2.194 10 10 CECE CC[C@H](NC)c1ccc(N(C)[C@@H]2CCCNC2=O)cc1 2171078829 FIADHSCJVXTJIX-LSDHHAIUSA-N 275.396 2.072 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)C1CC(F)(F)C1 1157567379 KYOWIZFBVNLYMF-UHFFFAOYSA-N 254.280 2.067 10 10 CECE CC(C)CN(CCCOc1ccc(N)cc1)C1COC1 2193577572 XXFGSYHSDYSJSJ-UHFFFAOYSA-N 278.396 2.395 10 10 CECE CNCc1ccc(OC)c(COC2CC3(COC3)C2)c1 2182183010 HJYKBHNIUNHNTQ-UHFFFAOYSA-N 277.364 2.110 10 10 CECE O=C(O)C=Cc1ccc(N(CC2CC2)C2COC2)cc1 2193578082 DMWSADJBSVMQSY-UHFFFAOYSA-N 273.332 2.400 10 10 CECE C[C@]12CCO[C@](COC(=O)Cc3ccc(N)cc3)(C1)C2 2193684710 HKRMPZZGAAMSQN-IYBDPMFKSA-N 275.348 2.314 10 10 CECE CN(C)c1ccc(CN=c2nc3scnc3c[nH]2)cc1 2189177527 SVQSQWOEXVCGPN-UHFFFAOYSA-N 285.376 2.186 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3NCCSC3(C)C)ccc21 2193891095 WMGJMZFYPJFAEA-LSDHHAIUSA-N 292.448 2.196 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H]4C[C@H]3CC[C@H]4O)ccc21 2184684039 HQQZEDWIIKQGMH-QIJZBDPFSA-N 272.392 2.372 10 10 CECE CN(C[C@H]1[C@H]2OCC[C@H]12)c1ccc2c(c1)CCC[C@H]2N 2184757758 RUIWLYHJJBIDDF-VQHPVUNQSA-N 272.392 2.494 10 10 CECE CN[C@H]1CCc2cc(N(C)Cc3cccnn3)ccc21 2184727510 PYVAIGVGCVIJSY-INIZCTEOSA-N 268.364 2.320 10 10 CECE CN1CCc2cc([C@H](O)C34CCC(N)(CC3)C4)ccc21 2184985348 JUEHZDOMNSPEJB-GTPINHCMSA-N 272.392 2.374 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@H]4CCOC[C@@H]4C3)ccc21 2185436275 DDNGKRPEDVJWMY-RVSPLBMKSA-N 272.392 2.495 10 10 CECE 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CECE CNCc1ccc(OC[C@](C)(COC)OC)c(C)c1 1895806840 WNPJWUWZHOHRBN-HNNXBMFYSA-N 267.369 2.145 10 10 CECE CCNC(=O)CN(CC)C/C=C/c1ccc(N(C)C)cc1 835024673 ATPNHFADVLJNER-BQYQJAHWSA-N 289.423 2.224 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC[C@H](C(=O)O)[C@@H]1C 686710318 RBPISOCMVVUMAP-KWBADKCTSA-N 279.336 2.344 10 10 CECE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CC23CC3)cc1 844857545 ZUSMQSADIJMUQV-OAHLLOKOSA-N 288.391 2.390 10 10 CECE O=C(NCCC[C@H]1CCOC1)NCc1c(O)cccc1F 922769289 VKWKOUXRYVMUCL-NSHDSACASA-N 296.342 2.147 10 10 CECE C[C@H](NC[C@H]1CNCCC1(F)F)c1ccc(F)cc1O 925781694 JLSKVYDHOKCDSR-VHSXEESVSA-N 288.313 2.427 10 10 CECE CN(C)c1ccc(CNCc2cc3n(n2)CCC3)cc1 850010761 HOSFKNGIUXTYHV-UHFFFAOYSA-N 270.380 2.185 10 10 CECE CO[C@@H]1CCC[C@H]([C@H](CO)NCc2ccccc2O)C1 850353967 RCBHOTJBRHTHET-CFVMTHIKSA-N 279.380 2.048 10 10 CECE O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CC[C@@H](C2)C1 857334549 FEGASCCARYQGTG-IUCAKERBSA-N 265.284 2.109 10 10 CECE CCN(C[C@@H]1C[C@@H]1C)c1ccc2c(c1)N(C)C(=O)[C@H]2O 698224055 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1912181491 OQXSCSSJYODALO-GHMZBOCLSA-N 254.334 2.206 10 10 CECE CO[C@@H]1[C@H]2C[C@@H]3CN(CCCCN=[N+]=[N-])[C@@H]1[C@H]3C2 1912184612 ZPRHSHWZIYIQGB-OBPIAQAESA-N 250.346 2.432 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)CCOC2CCC2)CC1 1912200011 AITYNPKEEGPKCQ-UHFFFAOYSA-N 252.318 2.247 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(CC(=O)Nc2nccs2)C1 1912210971 QJYPNLQJBDPDLY-JTQLQIEISA-N 294.384 2.494 10 10 CECE CNc1ccccc1C(=O)NCc1cccc(OC)c1O 1445969885 NZDCXIOXJFNWOS-UHFFFAOYSA-N 286.331 2.373 10 10 CECE CCCN[C@H](C)c1ccc(N2CCNC(=O)[C@@H]2C)cc1 110658703 GXHJRJXDFWQYAS-OLZOCXBDSA-N 275.396 2.072 10 10 CECE O=C(O)C=Cc1ccc(N2CC(F)(F)C2)c([N+](=O)[O-])c1 1917027799 KVYPRPFOFMLQQB-UHFFFAOYSA-N 284.218 2.148 10 10 CECE COc1cccc(CNCC[C@H]2OCC[C@@H]2C)c1O 1918107492 VBWOESWVMBIXOO-WCQYABFASA-N 265.353 2.306 10 10 CECE O=C(Nc1ccc2c(n1)CCC2)c1cccc(O)c1O 1468138628 TVRJENJLXWGVRF-UHFFFAOYSA-N 270.288 2.234 10 10 CECE NCCC(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1866115049 DEAUUIOTENYISE-UHFFFAOYSA-N 269.348 2.147 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@H](O)C2(C)C)c(F)c1 2136628050 BYOADKMNKVIUAR-PELKAZGASA-N 270.323 2.205 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCCC[C@@]1(C)C(=O)O 228034053 JBFBQVOCWZPIJE-BMIGLBTASA-N 279.336 2.488 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCCCC(F)(F)F 1623916956 VCIYXJVJULFIFA-UHFFFAOYSA-N 277.242 2.099 10 10 CECE O=C(O)[C@H](NCc1ccccn1)c1cc(Cl)ccc1O 211830857 VECWOSQKCHWEOO-CYBMUJFWSA-N 292.722 2.356 10 10 CECE CC[C@]1(F)CCN(CC(=O)Nc2ccc(N)cc2)C1 1925583233 MMKDJKGHFUMGEE-AWEZNQCLSA-N 265.332 2.031 10 10 CECE O=C(CCc1cccc(O)c1)NCc1cc(O)ccc1O 1558175350 MWIXDVIQKQAWEX-UHFFFAOYSA-N 287.315 2.052 10 10 CECE CCc1ccc(C(=O)NCc2c(O)cccc2O)c(O)c1 1639292478 FBXNRIJKNVHTOF-UHFFFAOYSA-N 287.315 2.296 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CC12CCCCC2 1631832816 YLWACUNSZQGCSN-CQSZACIVSA-N 275.348 2.479 10 10 CECE CN[C@H](C)c1ccc(N(C)CC2(O)CCOCC2)c(F)c1 161745142 CUEUYVSXOSPWHF-GFCCVEGCSA-N 296.386 2.084 10 10 CECE O=C(c1cncc2c1CCNC2)N1CCCc2ccccc21 169796955 HWAPULRPVBJYMA-UHFFFAOYSA-N 293.370 2.320 10 10 CECE CCN[C@H](C)c1ccc(N2CCN3C(=O)CC[C@@H]3C2)cc1 168593926 MIOPOGISEWDJRC-CZUORRHYSA-N 287.407 2.168 10 10 CECE COc1ccc(CN[C@H]2CC3(CCC3)[C@@H]2O)cc1C 2140684121 QJKXIKZFVSYAND-DZGCQCFKSA-N 261.365 2.397 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@@H](CN)C1CC1 159736244 LNQMOEJBKQKJEL-RNCFNFMXSA-N 252.333 2.261 10 10 CECE C[C@H](NCCO[C@@H]1CCOC1)c1ccc(N(C)C)cc1 927082777 DFESOSRACABWFM-XJKSGUPXSA-N 278.396 2.209 10 10 CECE C[C@H]1CN(C)CCN1Cc1ccc(Cl)cc1O 1942492248 WNVSITMRIPYVDI-JTQLQIEISA-N 254.761 2.182 10 10 CECE N[C@@H](c1ccccc1O)[C@@H](O)c1ccc(Br)o1 1943689600 GYQYZTMESNUZRQ-RYUDHWBXSA-N 298.136 2.481 10 10 CECE Oc1cccc(Br)c1CN[C@@H]1[C@H]2CCOC[C@H]21 1945023850 OAKOGVHKDZWXCP-IYYTYJHQSA-N 298.180 2.279 10 10 CECE CN(c1ccc(CO)c(C(F)(F)F)c1)C1(C)COC1 2143193652 JPHDFRQWQQJTEJ-UHFFFAOYSA-N 275.270 2.423 10 10 CECE CC(C)c1cc(=NC(=O)Nc2ccc(N)cc2)[nH][nH]1 1876137801 XJRHVHIZTYLACE-UHFFFAOYSA-N 259.313 2.181 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)CC2(CCC2)C1=O 1877586874 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CC[C@@H]1[C@@H]2CNC[C@H]2CN1[C@H](C)c1ccc(O)cc1O 251560352 IKNJBVKZMWRMGZ-BAESOJJISA-N 276.380 2.089 10 10 CECE COc1ccc(O)c(CNC[C@H]2CCCC[C@@H](O)C2)c1 1967745927 JSGCLGTVMQZXBF-GXTWGEPZSA-N 279.380 2.432 10 10 CECE CCOc1cccc(CN[C@H]2C[C@H]3C[C@H]2C[C@@H]3O)c1O 1967768634 YIJPPNSJSAZVBY-CRWXNKLISA-N 277.364 2.040 10 10 CECE Nc1ccc(CC(=O)c2ccc3c(c2)OCCO3)cc1 166816651 AASFWICNULOORB-UHFFFAOYSA-N 269.300 2.465 10 10 CECE Cc1ccc(O)c(CN2CC[C@@H]([C@@H]3CCCN3)C2)c1 1967992904 XMPUXXCEAFIYAY-HIFRSBDPSA-N 260.381 2.275 10 10 CECE COc1ccnc(CNCc2ccc(N(C)C)cc2)c1 1968437923 APDHWYWIZSCIAN-UHFFFAOYSA-N 271.364 2.446 10 10 CECE COCc1ocnc1CN(C)c1ccc(OC)cc1 1968600048 WXMKQPBJAIFEPM-UHFFFAOYSA-N 262.309 2.466 10 10 CECE CCOC1CC(NC(=O)N(C)Cc2ccccc2O)C1 1972067244 RFOWJGXSVUMGKI-UHFFFAOYSA-N 278.352 2.101 10 10 CECE Oc1c(F)cc(F)cc1CNC1C[C@@H]2COC[C@H]2C1 1973083779 UYOOOBQLQTYZJL-NXEZZACHSA-N 269.291 2.185 10 10 CECE Oc1cccc(Cl)c1CNCc1nnnn1C1CCC1 1974429028 KSQPNYVVFKDACA-UHFFFAOYSA-N 293.758 2.047 10 10 CECE OCC1CC(CNCc2c(O)cccc2Cl)C1 2003065187 JHJXZLXTVJCCNN-UHFFFAOYSA-N 255.745 2.154 10 10 CECE CCN(CCO)c1ccc(CNC)c(C(F)(F)F)c1 167362839 GJTFHVNNJQZUHZ-UHFFFAOYSA-N 276.302 2.243 10 10 CECE CN1CCCc2cc([C@H]3C[C@H](CN)CN3C)ccc21 258366377 JAWMXOYXDLOTDD-MLGOLLRUSA-N 259.397 2.021 10 10 CECE CNCc1ccc(N2CC[C@@H](CO)C(F)(F)C2)cc1C 2146390151 XJEMUNWCKLNNSA-ZDUSSCGKSA-N 284.350 2.168 10 10 CECE CCOC(=O)c1cnc(-c2ccc(N(C)C)cc2)[nH]1 259853313 QUBQQMNFNYGOIR-UHFFFAOYSA-N 259.309 2.319 10 10 CECE CCOC(=O)C[C@@H](N)c1c(O)ccc2c1CCCC2 259878984 AJBXJVCCCWYOLO-GFCCVEGCSA-N 263.337 2.224 10 10 CECE Nc1ccc(CCCN2CC[C@H](N3CCCC3)C2)cc1 158222187 QPDZACPVRBLEQW-KRWDZBQOSA-N 273.424 2.372 10 10 CECE Cn1cc(Br)nc1-c1ccccc1CCN 1987611797 DARPPLSDMLNUKJ-UHFFFAOYSA-N 280.169 2.351 10 10 CECE CC(C)N(Cc1ccc(N)cc1)[C@H](C)C(=O)NC1CC1 35365433 ZLYZRIFMMLYYQY-GFCCVEGCSA-N 275.396 2.146 10 10 CECE CN[C@H](C1=CCCC1)[C@@H](O)c1ccc2c(c1)CCN2C 2151212586 XUMXYRBEXULQDA-SJORKVTESA-N 272.392 2.411 10 10 CECE COC[C@H]1[C@H]2CN(c3ccc([C@@H](C)N)c(O)c3)CC[C@H]21 2149565660 VJJRWBQDKLQVOY-QPKOPYBWSA-N 276.380 2.131 10 10 CECE COc1ccc(CNC[C@@H](C)c2ccn(C)n2)c(O)c1 2147079741 JIKBRCGSDMRTBE-LLVKDONJSA-N 275.352 2.028 10 10 CECE CCN(CC(=O)N(C)C)c1ccc2c(c1)CC[C@H](C)N2 168358005 AUKIYIDVYFWHIZ-LBPRGKRZSA-N 275.396 2.348 10 10 CECE CCc1nc(CCN[C@H](C)c2ccccc2O)no1 272853670 LNKNTVHQVUOSBG-SNVBAGLBSA-N 261.325 2.231 10 10 CECE CCNCc1ccc(N2C[C@H]3[C@@H](O)CCC[C@H]3C2)cc1 2150926623 JUHFZGALFSNJRX-UAGQMJEPSA-N 274.408 2.393 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)c1cccc(S)c1 2148014531 BWFDAIBACGTSCZ-UHFFFAOYSA-N 289.356 2.359 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2[C@@H]3CCOC[C@@H]32)cc1O 2150179615 ILCVKFFPZWSPEP-HPEDKQMDSA-N 277.364 2.164 10 10 CECE CCNCc1ccc(N2CC[C@](COC)(OC)C2)cc1 2151845459 FBEICCKADOEDEQ-INIZCTEOSA-N 278.396 2.038 10 10 CECE CC[C@@H]1CCOC[C@H]1NCc1cc2c(cc1O)OCO2 2152566139 UDNUUIMFYKMEOP-ZYHUDNBSSA-N 279.336 2.026 10 10 CECE C[C@H]1CN(C(=O)c2ccc(O)c(O)c2)C[C@@H](C)C1(F)F 2153789697 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CN(C[C@H]1CCN1)c1ccc(OCC(F)(F)F)cc1 1879911432 RITQDTIBSBTNLR-SNVBAGLBSA-N 274.286 2.426 10 10 CECE NC1[C@H]2CN(c3ccc(OCC(F)(F)F)cc3)C[C@H]12 1879915194 NXCDTDRWNKSFQA-QWRGUYRKSA-N 272.270 2.021 10 10 CECE C[C@@H](O)c1cc(F)c(N(CCO)[C@H]2C[C@H]2C)c(F)c1 1880485826 DHPGETDVJHLXNH-KKFJDGPESA-N 271.307 2.225 10 10 CECE CC(=O)NCC1CCN(Cc2ccc(Cl)cc2O)CC1 1308590508 GZUQUUURZKSVSP-UHFFFAOYSA-N 296.798 2.394 10 10 CECE C[C@@H]1CC[C@H](CN(C)c2ccc([C@@H](C)N)c(O)c2)O1 1885266318 YHCSQVLZSJMPTI-NQBHXWOUSA-N 264.369 2.416 10 10 CECE CNCc1ccc(N(C)C[C@@H]2OCCO[C@H]2C)c(Cl)c1 2143695021 OLTYJMFXVDJNRF-NHYWBVRUSA-N 298.814 2.300 10 10 CECE CCN(c1ccc(CN)cc1)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1O 1888482528 XWWXSNHTPRSRPQ-SDADXPQNSA-N 260.381 2.131 10 10 CECE CN(C)C(=O)OCCCNCc1cccc(Cl)c1O 1964620640 KXIGKIXRNSJYRK-UHFFFAOYSA-N 286.759 2.224 10 10 CECE C[C@@H](NCCCn1ccnc1)c1cc(O)ccc1O 20506230 BFNFJPNUEAJGBR-LLVKDONJSA-N 261.325 2.035 10 10 CECE CC(C)C[C@@H]1COC[C@@H]1NCCc1ccc(O)c(O)c1 2148015255 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CCOC(=O)C[C@@H](N)c1ccc(C(F)(F)F)c(O)c1O 260684537 SBKYCUUYOREHKU-MRVPVSSYSA-N 293.241 2.070 10 10 CECE Nc1ccc(CNc2nc3sccn3c2[N+](=O)[O-])cc1 159526568 OFLLOCWXPRJTCO-UHFFFAOYSA-N 289.320 2.498 10 10 CECE CCN[C@@H](c1ccccc1O)C1(O)C[C@@H]2CC[C@H](C1)O2 2149170566 OFKNVPHSQSSHEO-SQJLCCANSA-N 277.364 2.115 10 10 CECE CCc1nc(CN[C@@H](CC)c2ccccc2O)n[nH]1 160428149 YOAOSQWVJDEJFC-NSHDSACASA-N 260.341 2.314 10 10 CECE CCC1(C)CC(=O)N(Cc2ccc(N)cc2)C(=O)C1 196140214 OKIAOKDPNJVYNW-UHFFFAOYSA-N 260.337 2.334 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3CCN(C)[C@@H]3C2)c(F)c1 2158548557 RKYROLDAIBZKII-HWWQOWPSSA-N 277.387 2.376 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1C[C@H]2C[C@H]1C[C@H]2O 1997916205 BNGNWSAOKKCOFV-JTRYMVSWSA-N 252.745 2.494 10 10 CECE CSCC1CN(CCCc2ccc(N)cc2)C1 1998204551 VVLVFUBYYDSSPW-UHFFFAOYSA-N 250.411 2.496 10 10 CECE CCC1CCN(C(=O)COc2ccc(N)cc2)CC1 40330945 CBUKKWBOIUTPSU-UHFFFAOYSA-N 262.353 2.296 10 10 CECE CN1CCCc2cc(CNCc3ccnnc3)ccc21 2151881307 LAWZKLBXXWEACJ-UHFFFAOYSA-N 268.364 2.149 10 10 CECE Cc1nnc(N(Cc2ccc(N)cc2)C2CC2)nc1C 165395954 ATJMWQZEHCTIDM-UHFFFAOYSA-N 269.352 2.240 10 10 CECE COCCNCc1ccc(N2C[C@H]3C[C@]3(C)C2)c(F)c1 2152466647 CVMVKQRQEHHARB-CZUORRHYSA-N 278.371 2.408 10 10 CECE CCN1CCC[C@H](N(C)Cc2cccc(OC)c2O)C1 2158729742 OPNIJDXUCHEJDU-AWEZNQCLSA-N 278.396 2.317 10 10 CECE CCc1c(C(=O)N(CC)c2ccc(N)cc2)cnn1C 2152897577 WSFFJXURKYJAEO-UHFFFAOYSA-N 272.352 2.231 10 10 CECE CN(C[C@@H]1C=CCCC1)S(=O)(=O)Cc1ccc(N)cc1 2153100519 IIRRFVASHGPQPQ-CYBMUJFWSA-N 294.420 2.387 10 10 CECE Cn1ncc(CN2CCC[C@H]2CN=[N+]=[N-])c1Cl 2009446546 YATVGQYAZOLJJM-VIFPVBQESA-N 254.725 2.348 10 10 CECE CCCSC1CN(c2ccc3c(c2)NC(=O)[C@@H]3NC)C1 2153916374 JMAGMKOOJOWROU-CQSZACIVSA-N 291.420 2.231 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1CO[C@H]2C[C@@H]1C2 2011807802 KFQQRHWWFRIBKS-VDDIYKPWSA-N 253.729 2.313 10 10 CECE CN1CCc2cc([C@H](N)C[C@@H]3[C@@H]4CCOC[C@H]43)ccc21 2154705075 ABVYBAMZNPJMRS-ZJIFWQFVSA-N 272.392 2.351 10 10 CECE COCCNCc1ccc(OCC(C)(C)CO)c(C)c1 2155018096 ARTQPALOSYMOBR-UHFFFAOYSA-N 281.396 2.128 10 10 CECE CNCc1ccc(N(C)CC(F)(F)CO)c(Cl)c1 2033566781 JFRNYEFHFYUHQW-UHFFFAOYSA-N 278.730 2.123 10 10 CECE C[C@H]1CCOC[C@@H]1N(C)c1ccc(CO)cc1F 2035117588 DYNURECOIIGMHU-HZMBPMFUSA-N 253.317 2.179 10 10 CECE C[C@H]1[C@H](C(=O)N(C)Cc2ccccc2O)C1(F)F 2036076714 GHYMWMDJNFTOHH-GZMMTYOYSA-N 255.264 2.252 10 10 CECE CC[C@H]1CN(c2c(F)cc(CNC)cc2F)CCO1 62710840 HSWWCYXDPMOPFS-NSHDSACASA-N 270.323 2.299 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H](C)C[C@@H]2C(=O)O)c1 2159259816 ONHLGKOTIYVRGT-GBIKHYSHSA-N 279.336 2.257 10 10 CECE C[C@@H]1C[C@H](C(=O)O)N(Cc2ccc(Cl)cc2O)C1 2041321704 JQQYNRZJBDPSKR-LDYMZIIASA-N 269.728 2.341 10 10 CECE CN(C)c1cccc(NS(=O)(=O)c2cccnc2F)c1 401856708 ZEHAVFYUQCNXAP-UHFFFAOYSA-N 295.339 2.088 10 10 CECE COc1ccc(CN2CCC[C@]23CCOC3)c(O)c1 311882037 YPAQPMGVRXQJMK-OAHLLOKOSA-N 263.337 2.156 10 10 CECE Nc1ccc(OCC(=O)N2CCC3(CCCC3)C2)cc1 312402670 VMFZINHECPJTFK-UHFFFAOYSA-N 274.364 2.440 10 10 CECE COCCNCc1ccc(N(C)C[C@@H](C)OC)c(C)c1 312491535 WGXZRFHGQXVNOX-CQSZACIVSA-N 280.412 2.202 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@H]3C[C@H]2CS3)c1 321365816 BYTCSFWREQKLKN-QWHCGFSZSA-N 263.362 2.285 10 10 CECE CC(C)[C@H](C)CNC(=O)CCOc1ccc(N)cc1 81039427 AFKKVXYOEBQAOM-GFCCVEGCSA-N 264.369 2.446 10 10 CECE CNCc1ccc(N2C[C@H](SC)[C@H](N(C)C)C2)c(C)c1 2170711764 YKUZZYKDEPWXRH-CVEARBPZSA-N 293.480 2.196 10 10 CECE C[C@H]1CN[C@@H](C2CC2)CN1c1ccc2c(c1)OCCO2 86181490 DSKOVCQPMFWWKR-SMDDNHRTSA-N 274.364 2.035 10 10 CECE CN(C)[C@@H]1CN(c2c(F)cc(CO)cc2F)C(C)(C)C1 2161753069 SGVNEOSSUDTQDQ-NSHDSACASA-N 284.350 2.376 10 10 CECE COCCC1CCN(CCOc2ccc(N)cc2)CC1 704144963 IBZJNEHPFZUQHZ-UHFFFAOYSA-N 278.396 2.396 10 10 CECE CCN(c1ccc([C@H](C)NC)c(O)c1)C(C)(C)CO 688311768 RDUVUXWOABCOJY-NSHDSACASA-N 266.385 2.270 10 10 CECE C[C@H]1CN(C)CCN(Cc2c(O)cccc2Cl)C1 707516752 IRVKPPJYAQWDCK-NSHDSACASA-N 268.788 2.429 10 10 CECE CNCc1ccc(N2CC[C@]3(CCOC3)C2)c(C)c1 707652966 OPJFHDHOQFENRF-INIZCTEOSA-N 260.381 2.331 10 10 CECE C[C@H]1CN(C)CCN(Cc2cc(F)cc(F)c2O)C1 708382086 DUQUOEOUELJJEH-JTQLQIEISA-N 270.323 2.054 10 10 CECE Oc1ccc(-c2nc(-c3cnsc3)no2)cc1O 687172573 KGRVOANLWQSJRW-UHFFFAOYSA-N 261.262 2.271 10 10 CECE COC(C)(C)COCCCOc1ccc(N)cc1 379211802 FGDPXKCMRXUOMT-UHFFFAOYSA-N 253.342 2.479 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@@H]4CNC[C@@H]4CC3)ccc2O1 2162635575 HGRYXQJWOLIOQX-MCIONIFRSA-N 272.392 2.446 10 10 CECE Nc1ccc(OCCN2C(=O)C3CCC2CC3)cc1 379691173 GSDMOKYRAYBLHX-UHFFFAOYSA-N 260.337 2.049 10 10 CECE C[C@H]1CN(Cc2ccc(Br)cc2O)C[C@@H](C)N1 691386522 KZVRBVULZMZPDT-AOOOYVTPSA-N 299.212 2.337 10 10 CECE CCN(C[C@@H](C)O)c1ccc(CNC2CC2)c(C)c1 691417323 IXYLDGVZDKCIHJ-CYBMUJFWSA-N 262.397 2.454 10 10 CECE CN(C)c1ccc([C@H](O)c2ccc(CCN)cc2)cc1 2163068072 DFSQWMUWHAHQSI-QGZVFWFLSA-N 270.376 2.336 10 10 CECE CCN1CCc2cc([C@H](NC)c3ncccn3)ccc21 2163067500 XMTGATUNEYPKKG-HNNXBMFYSA-N 268.364 2.168 10 10 CECE CC(C)NCc1ccc(N(C)CCC(N)=O)c(Cl)c1 382076851 KBNJJSDANWNWIC-UHFFFAOYSA-N 283.803 2.150 10 10 CECE CN1CCCc2cc([C@@H](O)C[C@H]3CSCCN3)ccc21 2163106764 LDNFZDHJZIDMHD-HOCLYGCPSA-N 292.448 2.198 10 10 CECE Cc1cnc([C@H](O)c2ccc3c(c2)CCCN3C)nc1 2163108163 RTSASBVKECRRQO-OAHLLOKOSA-N 269.348 2.249 10 10 CECE CC1(C)[C@@H](O)CCN1c1ccc(CN)c(Br)c1 384068418 UWSSIVBSKNLYSN-LBPRGKRZSA-N 299.212 2.257 10 10 CECE Cc1cc(CN)ccc1N1CC(C)(C)[C@H]2COC[C@@H]21 384618604 HHPQEVLXTZLXJQ-ZFWWWQNUSA-N 260.381 2.315 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@H](O)C[C@@H]1C 384804222 XKZXUZXQXNUCQM-SWLSCSKDSA-N 260.381 2.207 10 10 CECE C[C@H]1[C@H](NCc2c(O)cccc2Br)CCN1C 719601000 LMFBIIGPURXKRR-JOYOIKCWSA-N 299.212 2.337 10 10 CECE Cc1nc(CNCc2ccc(O)cc2O)sc1C 719637638 SQDCHWQQNKYOQY-UHFFFAOYSA-N 264.350 2.461 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CCOC2)c(F)c1 399068206 HHTXWIJDRYRHPA-QWRGUYRKSA-N 252.333 2.318 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1CCC2(C1)N=N2 2062540375 LKMZMYPWJVMDQO-SNVBAGLBSA-N 259.309 2.313 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CC12CCOCC2 779887419 KRZWZRZDEOMCLR-LBPRGKRZSA-N 277.364 2.307 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H](CO)OCC2(C)C)cc1 2167527149 PARZJAUMZUTKRJ-LSDHHAIUSA-N 278.396 2.073 10 10 CECE COC[C@@H]1CN(Cc2c(C)cccc2O)CC(C)(C)O1 877508661 BIHSXIXJMLTZGT-ZDUSSCGKSA-N 279.380 2.326 10 10 CECE COC(=O)c1cc(C)nn1[C@H](C)c1ccc(OC)cc1O 2069925590 PHJFMHNHWWYRKM-SNVBAGLBSA-N 290.319 2.302 10 10 CECE CCNC(=O)c1cnn(Cc2c(O)cccc2Cl)c1 2069940622 YDJNNDDBYHPSLX-UHFFFAOYSA-N 279.727 2.040 10 10 CECE O=Cc1ccnn1Cc1ccc(Br)cc1O 2069999644 ZVBAXHTVTWQSSD-UHFFFAOYSA-N 281.109 2.212 10 10 CECE CCOC(=O)c1cnn([C@H](C)c2cccc(C)c2O)c1N 2070317835 FCQQPLUWFGVLGC-SNVBAGLBSA-N 289.335 2.265 10 10 CECE N=c1ccc([C@H](N)c2ccc(N3CCCC3)cc2)c[nH]1 2169167883 WYKQWMSOKSYOQH-MRXNPFEDSA-N 268.364 2.142 10 10 CECE CCN1CCc2cc([C@@H](N)[C@](C)(O)C(C)(F)F)ccc21 2178860347 JGUICWCJQFOWLK-KGLIPLIRSA-N 284.350 2.475 10 10 CECE Nc1ccc(CCOC[C@@H]2C[C@H]3COCC[C@@H]3O2)cc1 2176290272 LYCXWRMQCRDHCQ-BPUTZDHNSA-N 277.364 2.022 10 10 CECE NCc1ccc(N2CC=CC[C@H]2CO)cc1C(F)(F)F 2176339468 OYJUIZBFZIOQGZ-LBPRGKRZSA-N 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C[C@H]1Cc2cc(N3[C@H]4CC[C@@H]3C[C@H]4CN)ccc2O1 2330487444 JUWHCOFIFWPTDF-DNVSUFBTSA-N 258.365 2.326 10 10 CECE CO[C@H]1C[C@@H]2[C@H]1CCN2c1ccc2c(c1)CC[C@@H]2O 2331551808 QCNKLWNBHJTLAL-WCVJEAGWSA-N 259.349 2.280 10 10 CECE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@]3(C)O)c(O)c1 2333191084 VTKGJPNBMPHVDY-RZLSGREXSA-N 261.365 2.340 10 10 CECE NCc1ccc(N2[C@H]3CCCC[C@H]3C[C@@H]2CO)cc1 2333977051 XLGBBZXIDIBIHU-IMJJTQAJSA-N 260.381 2.275 10 10 CECE CCN1[C@H]2CC[C@H]1CN(Cc1cc(C)ccc1O)C2 2335539432 ASMPUHTYDWHUQR-GJZGRUSLSA-N 260.381 2.369 10 10 CECE CCNCc1ccc(N2CCOC[C@@H](F)C2)c(F)c1 2336666594 WKKIILCWKPEDCN-LBPRGKRZSA-N 270.323 2.110 10 10 CECE CCN(CCN=[N+]=[N-])Cc1nnc(-c2ccco2)o1 2337778198 SWHXOHDQHAPBGF-UHFFFAOYSA-N 262.273 2.462 10 10 CECE Nc1ccc(CC[C@@H](O)c2ncc3n2CCC3)cc1 2338502755 FBRLMRZPJBXVEC-CQSZACIVSA-N 257.337 2.078 10 10 CECE Nc1ncc(F)cc1OCc1ccn(C(F)(F)F)n1 2340423223 JCYVNULOGXRFQK-UHFFFAOYSA-N 276.193 2.055 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](O)[C@@H](F)C2)c(C)c1C 2340856892 TXHKJJMUQRIZSQ-ZLDLUXBVSA-N 266.360 2.103 10 10 CECE CCN(C)C1CN(c2ccc([C@H](C)O)c(C)c2C)C1 2340857450 WOHYIHLUNLJULZ-ZDUSSCGKSA-N 262.397 2.497 10 10 CECE COc1ccc(N(C)[C@@H](CN)c2cnc(C)o2)cc1 2342795581 POWDELBWTDPAMB-ZDUSSCGKSA-N 261.325 2.128 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@H](C)[C@@H]2C)c(C)c1 2344572074 HSJLETPDULRQGQ-WWGRRREGSA-N 262.397 2.310 10 10 CECE Nc1ccc(CC(=O)N[C@H]2C[C@@H]3C[C@H]2CC3(F)F)cc1 2354301345 LPIZCPOVPYGIDJ-GVXVVHGQSA-N 280.318 2.361 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2CC[C@@H]3[C@H]2C3(F)F)cc1 2354371934 DCKRGYBWSSUUJF-MBNYWOFBSA-N 280.318 2.361 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@H]1[C@H]2C(=O)O 2354636403 AFICZZYSRLDIBE-YYESSMSJSA-N 279.311 2.387 10 10 CECE COc1cc(Cl)cc(CN2[C@H]3CC[C@@H]2C[C@H]3CN)c1O 2355419500 OZTDAQMXWFZYHJ-BIMULSAOSA-N 296.798 2.366 10 10 CECE CCCN(c1ccc(N)cc1)[C@@H](C)C(=O)NCCCOC 63115824 FRJHNKNKUGFTOB-ZDUSSCGKSA-N 293.411 2.026 10 10 CECE COC[C@H](NCc1ccc(OC)cc1O)c1ccco1 177577765 HLMGSYPWBBRPQM-ZDUSSCGKSA-N 277.320 2.471 10 10 CECE Cc1ccc(CNC(=O)CCc2ccc(N)cc2)o1 53035473 DAXOKWHKTGOKBS-UHFFFAOYSA-N 258.321 2.419 10 10 CECE COC(=O)[C@@H]1N[C@@H](c2ccccc2O)SC1(C)C 39330486 CEDZSFSCZNVZPR-WDEREUQCSA-N 267.350 2.047 10 10 CECE C[C@@H]1CSCCN1c1c(F)cc(CN)cc1F 70220742 IXRQOLVWWLAURO-MRVPVSSYSA-N 258.337 2.365 10 10 CECE Cn1cncc1CCCC(=O)Cc1ccc(N)cc1 314073482 LSPBYBXKPMTELU-UHFFFAOYSA-N 257.337 2.137 10 10 CECE CCO[C@H]1C[C@@](O)(CNCc2cccc(C)c2O)C1(C)C 188054607 BRGSNMYSEHHCCP-WMLDXEAASA-N 293.407 2.356 10 10 CECE CN1CC[C@@H](N)[C@@H]1c1ccc(C(F)(F)F)cc1O 1952213118 ILRFOHUETNAHCY-KOLCDFICSA-N 260.259 2.115 10 10 CECE COc1cc(N)c(N2CCS[C@H](C)C2)cc1OC 137089031 WMXNGMXOBFUMPH-SECBINFHSA-N 268.382 2.228 10 10 CECE COCOc1cc2c(c(O)c1CC=C(C)C)CNC2=O 89211063 TWIKSSNSQPEFLO-UHFFFAOYSA-N 277.320 2.127 10 10 CECE CCC(CC)N(C)C(=O)COc1ccc(N)cc1 40451903 MZPHCULXRNJRDB-UHFFFAOYSA-N 250.342 2.295 10 10 CECE CC(C)(C(=O)O)[C@@H]1CCCN(Cc2ccc(O)c(O)c2)C1 135048026 DFYGUQZODOMRSF-GFCCVEGCSA-N 293.363 2.421 10 10 CECE CN[C@H](C)CCCN1CCN(c2ccc(OC)cc2)CC1 45599073 MVDKWCXIPGARBF-OAHLLOKOSA-N 291.439 2.205 10 10 CECE C[C@@H]1CCCN(CC(=O)N(C)c2ccc(N)cc2)[C@@H]1C 50563222 RUXCLIAGEMSBIB-CHWSQXEVSA-N 275.396 2.352 10 10 CECE CC[C@@H](N)c1c(Br)ccc(C(=O)O)c1O 95717679 JKNDVKCILNXCTH-SSDOTTSWSA-N 274.114 2.263 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@]1(C)CCCO1 94789705 MJSZNZIWUYOXRL-NHYWBVRUSA-N 263.337 2.481 10 10 CECE COc1ccc(Br)c(CN(C)C)c1O 1231546850 AKZZLRIRBQQRHR-UHFFFAOYSA-N 260.131 2.225 10 10 CECE CC1(C)C[C@H](C(=O)NCc2ccc(O)c(O)c2)C(C)(C)O1 528865858 WRINLVVOVBIPKJ-LLVKDONJSA-N 293.363 2.308 10 10 CECE CCN(CC)CCCNC(=S)Nc1ccc(N)cc1 243197012 KCSMSABNAADHAG-UHFFFAOYSA-N 280.441 2.287 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H](C)CO)cc1Cl 252808453 KALRHQATFDOQEJ-ZJUUUORDSA-N 256.777 2.437 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@]2(F)CCOC2)cc1 2222376620 JZEZDDHUGYMHSC-SMDDNHRTSA-N 252.333 2.271 10 10 CECE C[C@H](CCN)c1c(F)cc(O)c(O)c1Br 258804480 YRWUCLRAKBMJRU-RXMQYKEDSA-N 278.121 2.452 10 10 CECE CC[C@@H](C)N(CC(=O)O)[C@H](C)c1cc(O)ccc1O 251661399 BVISBSVEBQGBAT-NXEZZACHSA-N 267.325 2.344 10 10 CECE CN1C[C@@H](CN)C[C@@H]1c1cccc(Br)c1O 258553514 NITDSOPOCBBGJK-LDYMZIIASA-N 285.185 2.106 10 10 CECE Oc1cc(F)c(Cl)cc1CNC[C@@H](O)C1CC1 294067181 YEPAEGQHZLJSOD-GFCCVEGCSA-N 259.708 2.045 10 10 CECE CC(C)[C@]1([C@@H](O)c2ccc3c(c2)CCN3C)CCNC1 2163064951 ZMGIYFLMBUTAKP-IRXDYDNUSA-N 274.408 2.348 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)CC[C@H]4CC[C@@H]43)ccc21 2163140529 KFXCEXFUCRNXTM-UMPQAUOISA-N 272.392 2.230 10 10 CECE C[C@@H](N)[C@H](N)c1ccc(OCc2ccccc2)cc1O 713751210 BCZCKMNVRQWTOJ-BZNIZROVSA-N 272.348 2.318 10 10 CECE C[C@H]1[C@H](NCc2ccc3c(c2)CCCN3C)CCN1C 719572802 LATAPDKGMOTEKD-XJKSGUPXSA-N 273.424 2.251 10 10 CECE Cc1ccc([C@H](C)NC2COCCOC2)c(O)c1C 813881490 YRCMAZVMHFNDPA-LBPRGKRZSA-N 265.353 2.075 10 10 CECE CN(Cc1ccccc1O)C(=O)NCCCCF 813226450 MNCSJUYXTARZOD-UHFFFAOYSA-N 254.305 2.283 10 10 CECE COc1cc(C)c(N2CC(F)(F)C[C@@H]2CN)cc1C 2278981842 BCCANXSIVXQNGV-LLVKDONJSA-N 270.323 2.485 10 10 CECE CCCN(CC(=O)NC)c1ccc([C@@H](C)NC)cc1F 723183332 QJBDCXIRSHGGMO-LLVKDONJSA-N 281.375 2.069 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N1C[C@@H]2C[C@H]1CN2 2130973266 UUBAYYAIKDRJKS-ZDEQEGDKSA-N 258.365 2.295 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)C1(C)CCCC1 720347190 VYEDDJNJHUHVSX-ZDUSSCGKSA-N 259.353 2.407 10 10 CECE CCOC(=O)C[C@](C)(N)c1cc(C)c(C)cc1O 1952913422 IXOIKGZFAJAZHK-AWEZNQCLSA-N 251.326 2.136 10 10 CECE CNC(=O)[C@H]1CCC[C@@H]1NCc1c(O)cc(C)cc1Cl 840907791 QYGDQBJREQWZST-GWCFXTLKSA-N 296.798 2.358 10 10 CECE C[C@H](NC(=O)C1(F)CC1)c1ccc(N(C)C)cc1 843582018 WVDFMPPVVIWHBE-JTQLQIEISA-N 250.317 2.432 10 10 CECE C[C@@H]1CN(CCN=[N+]=[N-])C[C@H]1CNC(=O)OC(C)(C)C 1954208160 JGJORZBIXVZLCE-GHMZBOCLSA-N 283.376 2.389 10 10 CECE Nc1ccc(OCCOC[C@H]2C[C@@]23CCOC3)cc1 1897011183 NDJPMVHGVYWAOC-IUODEOHRSA-N 263.337 2.091 10 10 CECE CN(C)c1ccc([C@H](N)CN[C@@H]2CCCSC2)cc1 841044556 CZILCHZNYSYMBF-UKRRQHHQSA-N 279.453 2.238 10 10 CECE COc1ccc2c(c1)CCCN2C[C@@H]1CCC2(COC2)O1 929235868 BQCYKBNZHHEACJ-HNNXBMFYSA-N 289.375 2.396 10 10 CECE C[C@@H](N[C@@H]1CNOC1)c1ccc(N2CCCCC2)c(F)c1 925863305 AGINBDWXHYRZEG-TZMCWYRMSA-N 293.386 2.370 10 10 CECE Cc1cc(CN2C[C@H]3CC[C@H]2[C@@H]2CNC[C@@H]32)ccc1N(C)C 923415546 QRSDLJHQZAVXOB-NTDBWNAOSA-N 299.462 2.491 10 10 CECE CCOC(=O)c1cnc(SCCSCCO)s1 853546678 GTKZCQNMULIIJT-UHFFFAOYSA-N 293.435 2.137 10 10 CECE CO[C@H]1CC[C@H](C(=O)NCc2cc(Cl)ccc2O)C1 855023450 ZADQJRAARCJMPW-CABZTGNLSA-N 283.755 2.477 10 10 CECE COc1cc(C[C@@H](O)CCc2ccc(N)cc2)sn1 695829657 UNLCGHVQBWLPNN-LBPRGKRZSA-N 278.377 2.270 10 10 CECE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCS1 862027593 XZVUIEMPMNPZDT-GFCCVEGCSA-N 288.372 2.452 10 10 CECE C[C@@H](NCc1cc(-c2ccccc2)ccc1O)C(N)=O 775199494 DRRYYILDHXAABN-LLVKDONJSA-N 270.332 2.023 10 10 CECE CCN(C[C@H](C)O)c1c(F)cc([C@@H](C)NC)cc1F 1880929054 UPJCGJBPJVPQCV-VHSXEESVSA-N 272.339 2.452 10 10 CECE COc1cc2c(cc1OC)N(CCO)C[C@](C)(C(C)C)N2 76930907 YQCZAUYULWVGEE-MRXNPFEDSA-N 294.395 2.343 10 10 CECE CNC(=O)[C@@H](NCc1cc(Cl)cc(C)c1O)C(C)C 787323752 QGBSAYXNZGCZDK-LBPRGKRZSA-N 284.787 2.214 10 10 CECE Oc1cccc2c1[C@H]([C@H](O)c1ccccc1F)NCC2 83660241 ZIWZIUYGZUGRDM-HZPDHXFCSA-N 273.307 2.452 10 10 CECE COc1ccc(N(CCO)C(C)(C)C)c([N+](=O)[O-])c1 691073023 FIQAUDYRUHUJNQ-UHFFFAOYSA-N 268.313 2.201 10 10 CECE C[C@@H]1CCCCN(CC(=O)Nc2ccc(N)cc2)C1 705539737 ULPPHXUTJPZEDA-GFCCVEGCSA-N 261.369 2.329 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Br)CC[C@@H]1N 706861485 ZTSJKECWYLXZGG-CABZTGNLSA-N 299.212 2.324 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@@H]2CCCC[C@H]21 706810095 JMKBOOKZRKQWIU-TYNCELHUSA-N 273.380 2.470 10 10 CECE CCC[C@@H]1CN(c2ccc([C@H](C)N)c(O)c2)CCO1 708972983 JFZNSVJPVZONAC-WCQYABFASA-N 264.369 2.417 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@](O)(C(C)C)C1 710208105 RRKMLXTZHVTKQU-INIZCTEOSA-N 262.397 2.441 10 10 CECE O=C1Nc2cc(N3C[C@H]4CC[C@H]4C3)c(Cl)cc2[C@@H]1O 688285197 CQBZHARDDILVTF-DAROEXNTSA-N 278.739 2.172 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](CO)CC[C@H]2C)c(F)c1 688727647 BZOCBQPFDUVVJX-WOPDTQHZSA-N 267.344 2.476 10 10 CECE C[C@@H](NCC[C@@H]1CCCS1(=O)=O)c1ccccc1O 714383940 XBBBYUWWSPJBDU-NEPJUHHUSA-N 283.393 2.010 10 10 CECE CC1=C[C@H](C)CN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 797419426 LPZCKAFTRTVKMQ-BONVTDFDSA-N 275.348 2.216 10 10 CECE C[C@H]1CO[C@@H](C(=O)N(Cc2ccc(N)cc2)C2CC2)C1 718400037 CXSBBMDSNWILJZ-IAQYHMDHSA-N 274.364 2.185 10 10 CECE C[C@H]1CCCCN1S(=O)(=O)Nc1ccc(O)c(F)c1 85200910 YFZBAAUCWGHDLL-VIFPVBQESA-N 288.344 2.062 10 10 CECE CC(C)[C@H]1CN(c2ccc3c(c2)OCCO3)CCCN1 86285798 ZJJHQLRVLHRZLY-CQSZACIVSA-N 276.380 2.282 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccnc(Cl)c1F 1162277698 BHSVNQWMWQZDAD-UHFFFAOYSA-N 296.685 2.215 10 10 CECE C[C@H](CNC(=O)COc1ccc(N)cc1)C(C)(F)F 2115258906 LLAXVETVMDLDES-SECBINFHSA-N 272.295 2.055 10 10 CECE CCOc1cccc(CN2C[C@@H]3CCO[C@H]3C2)c1O 2115448896 BQCJWBXYMBUWFX-FZMZJTMJSA-N 263.337 2.012 10 10 CECE C[C@@H](Nc1ccc(S(C)(=O)=O)cn1)c1ccccc1O 1163935674 CRLXTCVYLBINPT-SNVBAGLBSA-N 292.360 2.364 10 10 CECE CN(CC(F)(F)CO)c1ccc2c(c1)CCC[C@@H]2N 2128278845 HTUCQMAOFFMOCO-ZDUSSCGKSA-N 270.323 2.087 10 10 CECE C[C@@]1(O)CCCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128270402 FJBQXUCIPNLLIX-JKSUJKDBSA-N 261.365 2.408 10 10 CECE CC[C@@H]1[C@@H](CO)CCN1c1ccc2c(c1)CC[C@@H]2O 2128320149 APFFCBREIOSCKM-WQVCFCJDSA-N 261.365 2.263 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@H](CCO)C3)ccc21 2128309453 SRILXMSLIZHZHW-LRDDRELGSA-N 260.381 2.102 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@@H]3O)C[C@H]1N(C)C 2128318511 VNEBCPSOBRDNMM-XZJROXQQSA-N 260.381 2.053 10 10 CECE Cc1cnc(C(=O)NCc2cccc(O)c2O)cc1C 1176576788 SKJKQSDYWSWPAV-UHFFFAOYSA-N 272.304 2.040 10 10 CECE CN[C@H]1CCc2cc(N3CC4(C=CCO4)C3)ccc21 2128313874 YVPXEQFDMSKLEB-HNNXBMFYSA-N 256.349 2.039 10 10 CECE Oc1c(CNC[C@H]2[C@H]3OCCC[C@H]23)ccc(F)c1F 2119930343 QINNIJJSSAQSFJ-RULNRJAQSA-N 269.291 2.185 10 10 CECE Oc1c(F)cccc1CN[C@H]1C[C@@H](n2cccn2)C1 2127718533 FKTDYEZATMLWBU-TXEJJXNPSA-N 261.300 2.221 10 10 CECE CC[C@H](O)c1ccc(N2[C@H]3CC[C@@H](C3)[C@H]2CO)cc1 2122173289 MBIMTBGDOSWMQR-HNKHHVNMSA-N 261.365 2.480 10 10 CECE CCOC1(CN2CCC[C@@H]2CN=[N+]=[N-])CCOCC1 2123014763 HEACMNGZAQVYKJ-GFCCVEGCSA-N 268.361 2.347 10 10 CECE CN(C(=O)CN1CCC[C@H]1CN=[N+]=[N-])C1=CCCC1 2123020135 UNFIDRFWXVDOHR-LBPRGKRZSA-N 263.345 2.287 10 10 CECE CCN1CCc2cc([C@]3(O)COC4CC3C4)ccc21 2126689400 JLZKXWKMTSFLJC-ZBCRRDGASA-N 259.349 2.065 10 10 CECE NCCN(Cc1cc(F)cc(F)c1O)C1CCCC1 2130098907 PMUTUMHIZXTKHQ-UHFFFAOYSA-N 270.323 2.374 10 10 CECE CO[C@@H]1CC[C@H]1C[C@H](NN)c1ccc(N(C)C)cc1 2130377674 CIVQEVJWRDXJOO-AEGPPILISA-N 263.385 2.072 10 10 CECE C[C@@H]1CCN(c2ccc(CO)c([N+](=O)[O-])c2)C[C@@H]1F 2132059882 VVCFLCJRFZOTLQ-SKDRFNHKSA-N 268.288 2.271 10 10 CECE COc1ccc(N2CCN(CC(C)C)CC2)c(N)c1 213400855 DZXVVEPZIQJPJK-UHFFFAOYSA-N 263.385 2.055 10 10 CECE COC[C@@H]1C[C@H]1C[C@H](O)c1ccc2c(c1)CCN2C 2133591961 LFOHSGUKEGHSDI-DZKIICNBSA-N 261.365 2.385 10 10 CECE CCN(CCN(C)C)c1ccc(C=CC(=O)O)cc1F 1911841889 HVKRYRROEGTTCH-UHFFFAOYSA-N 280.343 2.311 10 10 CECE C[C@H]1CN(c2ccc(C=CC(=O)O)cc2)[C@H](C)CO1 1911978353 DLVGZCWTHMQQGO-NEPJUHHUSA-N 261.321 2.398 10 10 CECE [N-]=[N+]=NCCNC(=O)C=Cc1c(Cl)nc2sccn12 1911980721 HVJRRTVBDPZFKQ-UHFFFAOYSA-N 296.743 2.489 10 10 CECE CCOC1CN(c2ccc(C=CC(=O)O)c(C)c2)C1 1912056863 XUYYUEUPLBJBHH-UHFFFAOYSA-N 261.321 2.318 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)N2C[C@H]3CCC[C@@H]3C2)C1 1912176020 TVXZNTCFFQCWND-QJPTWQEYSA-N 263.345 2.471 10 10 CECE C[C@H](C(=O)NC1CCCC1)N(C)CCCN=[N+]=[N-] 1912166933 DNHMMHRIKDISAN-SNVBAGLBSA-N 253.350 2.066 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 1912164099 SAHQRKSQBQUQHE-VIFPVBQESA-N 275.268 2.367 10 10 CECE Cc1ccc(S(=O)(=O)N(C)CCN=[N+]=[N-])cc1C 1912202197 CWQITDPGOOWFIF-UHFFFAOYSA-N 268.342 2.234 10 10 CECE CCOC(=O)c1nc(CN(C)CCN=[N+]=[N-])cs1 1912210725 NABDNXIAAZRQDF-UHFFFAOYSA-N 269.330 2.062 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2ccc(O)c(O)c2)C1 1912210488 KDWMFZBVGJDMEG-VIFPVBQESA-N 276.296 2.260 10 10 CECE C[C@H]1[C@H](N)CC(C)(C)CN1Cc1ccc(O)cc1O 1916273557 IRLOEZRTPGRBHQ-GXFFZTMASA-N 264.369 2.046 10 10 CECE CN(CC1=CCSC1)c1ccc(CO)cc1[N+](=O)[O-] 1916839160 RAGWIAFKHJSEMI-UHFFFAOYSA-N 280.349 2.197 10 10 CECE CCN(CCSC)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 1916990530 DNONRAGGSHLNHT-GFCCVEGCSA-N 299.827 2.481 10 10 CECE Oc1cccc(O)c1CNc1ncc(Cl)cn1 1458639689 JTLUIIKKFWDRKL-UHFFFAOYSA-N 251.673 2.153 10 10 CECE CN(Cc1cccc(O)c1)C(=O)c1c(F)ccc(O)c1O 1457549663 CILKECCFKRFGJC-UHFFFAOYSA-N 291.278 2.215 10 10 CECE Cc1c(F)ccc(N)c1C(=O)NCc1c(O)cccc1F 1471975777 GYVBGWVQMUWQEH-UHFFFAOYSA-N 292.285 2.491 10 10 CECE CCOc1cccc(CN[C@H]2CCC[C@@H]2N(C)C)c1O 1921991674 PUDACRLRSZAHPX-KBPBESRZSA-N 278.396 2.363 10 10 CECE COc1ccc(CC(=O)C(=O)C(C)(C)C)cc1OC 258689572 WZBGXZYDJWFVRX-UHFFFAOYSA-N 264.321 2.431 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCCc1cccs1 1623932259 WSZASRHISWKNPU-UHFFFAOYSA-N 277.345 2.061 10 10 CECE COc1ccc(N(CC(C)C)C[C@H](C)O)c(N)c1 2259828385 WQTGNPJWKXOJGE-NSHDSACASA-N 252.358 2.121 10 10 CECE CN(C)C(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1 1587629095 NCEKDWKCQOJBAY-UHFFFAOYSA-N 290.344 2.408 10 10 CECE COc1ccccc1CC(=O)NCCCCN=[N+]=[N-] 231732069 IDYXDTYRJPTIOV-UHFFFAOYSA-N 262.313 2.444 10 10 CECE CCO[C@H]1[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H]1C 1598029938 YKRFZWJMXPNTDD-WKPIXPDZSA-N 294.370 2.179 10 10 CECE CCC(CC)N(CCO)c1ccc(CN)c(F)c1F 232882928 SLSQWWRQGHWMAO-UHFFFAOYSA-N 272.339 2.411 10 10 CECE CCCN([C@@H]1CCNC1)[C@H](C)c1c(O)cccc1O 233046257 ODAKOQQHBQFBSG-VXGBXAGGSA-N 264.369 2.233 10 10 CECE COc1cc(-c2nc3cccnc3[nH]2)cc(O)c1O 154545369 PJCWWYVABSGSSV-UHFFFAOYSA-N 257.249 2.045 10 10 CECE Cc1cc2c(cc1N(C)[C@@H](CO)C(C)C)OCCO2 258957056 XLTSIUIHKQRLOO-ZDUSSCGKSA-N 265.353 2.219 10 10 CECE COc1ccc(N(C)C[C@H](C)CC(=O)O)cc1F 258954664 VEXZYLGWWCZZER-SECBINFHSA-N 255.289 2.381 10 10 CECE CN[C@H]1CN([C@@H](C)c2cc(C)ccc2O)CC12CC2 2140955221 PNZUSSUTKBOGBO-WFASDCNBSA-N 260.381 2.445 10 10 CECE CNCc1ccc(N2CC[C@H]([C@@H](C)O)C2)cc1Cl 234376914 UXSQRJQWDAHOFW-PWSUYJOCSA-N 268.788 2.267 10 10 CECE CC[C@H](CN(C)C)NCc1cc(Cl)ccc1O 1942691259 SQPICCFAXYKTRZ-GFCCVEGCSA-N 256.777 2.475 10 10 CECE COC(C)(C)[C@@H]1CCCN1C(=O)c1cccc(O)c1O 1148214770 WUALOQLDJACEIK-LBPRGKRZSA-N 279.336 2.127 10 10 CECE C[C@H](N[C@H]1C[C@](C)(CO)C1)c1ccc(F)cc1O 1876194966 GCSRUISRCMFKPQ-CHIMOYNISA-N 253.317 2.343 10 10 CECE CC[C@H](C)[C@@H](NC)C(=O)N[C@@H](C)c1ccccc1O 1877590400 SWWQTKNUJWRACK-COPLHBTASA-N 264.369 2.204 10 10 CECE CCN(Cc1nnccc1C)c1ccc(CN)cc1 1877777340 HOYQZZHJLVWHBM-UHFFFAOYSA-N 256.353 2.270 10 10 CECE CC(C)(O)CCCNCc1cc(F)cc(F)c1O 1962879227 BMINSMUENFOJLH-UHFFFAOYSA-N 259.296 2.311 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCC(C)(O)CC2)c(F)c1 1880478340 DVMWPZKIYBEABZ-SECBINFHSA-N 271.307 2.369 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@@H](C)[C@@H](O)C2)c(F)c1 1880961680 APGMSCWSCCNXLT-KKFJDGPESA-N 270.323 2.192 10 10 CECE CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)NCCN=[N+]=[N-] 1885557117 KMSUFVSQOXUPSK-JTQLQIEISA-N 297.359 2.203 10 10 CECE CN1CCc2cc([C@@H](O)C34CC(CCO3)C4)ccc21 1887024291 KWNXWZKKIRJUCG-YWCUFVOSSA-N 259.349 2.281 10 10 CECE Cc1cc(CN[C@H](C)c2cc(F)ccc2O)nn1C 1964458284 UOSXTXJONUZKLZ-SNVBAGLBSA-N 263.316 2.424 10 10 CECE O=C(O)[C@H]1CCN(Cc2ccc(F)cc2O)CC1(F)F 1964733610 XXYOOGVDQHPKBM-SNVBAGLBSA-N 289.253 2.073 10 10 CECE COc1ccc(CN[C@H](C)[C@H](O)C(C)C)cc1C 1964589633 PKOJPYFIOMFMQJ-IUODEOHRSA-N 251.370 2.499 10 10 CECE CN[C@@H]1CCN(c2ccc(OC)cc2OC)C[C@H]1C 251916806 XQNRMIWVOLETPN-DGCLKSJQSA-N 264.369 2.138 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2ncccc2O)c1 1969271636 OPVPEMYYBZGYET-SNVBAGLBSA-N 274.320 2.352 10 10 CECE COc1cccc(CNC2CC(n3ccnc3)C2)c1O 1969249429 UAKKLLNQESWBCO-UHFFFAOYSA-N 273.336 2.091 10 10 CECE CC[C@]1(C)C[C@](O)([C@@H](NC)c2ccccc2O)CCO1 2148161246 LNMRDPYWMUZUGV-XHSDSOJGSA-N 279.380 2.363 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CCC[C@H](OC)CC1 2148160898 KNCOYLKLURWHHO-MAZHCROVSA-N 279.380 2.363 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCCN2CC[S@](C)=O 2145834500 HTVULMSWVBSDTM-XCLFUZPHSA-N 294.464 2.488 10 10 CECE CC[C@H](N[C@H]1CCC[C@H](C(N)=O)C1)c1ccccc1O 2146212225 SAPPNTRXDCFKON-OBJOEFQTSA-N 276.380 2.477 10 10 CECE CCOC(=O)C1(c2cc(C)c(O)c(O)c2)CCC1 260477597 SYWOUKZRTRTHRR-UHFFFAOYSA-N 250.294 2.391 10 10 CECE CC(=O)Nc1nc(CN(C)Cc2ccc(N)cc2)cs1 2148888799 MOSCONZFTXPELB-UHFFFAOYSA-N 290.392 2.316 10 10 CECE COc1ccc(S(=O)(=O)CCc2ccc(N)cc2)cc1 35677496 TZKJXFLQRFINNN-UHFFFAOYSA-N 291.372 2.294 10 10 CECE Oc1cc(Cl)ccc1CNC[C@@H]1C[C@@H]2COCC[C@@H]2O1 2148971962 GAHYVHKAFLMGKH-ZLDLUXBVSA-N 297.782 2.329 10 10 CECE CC(C)[C@@H](C)N(C)CC(=O)N(C)c1ccc(N)cc1 36786399 HBTUSBRCOSEOOF-GFCCVEGCSA-N 263.385 2.208 10 10 CECE Nc1ccc(O)c(CNC(=O)c2cc3c(s2)CCC3)c1 36737488 GDBIIDOGYPDXIT-UHFFFAOYSA-N 288.372 2.455 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](O)C(F)(F)CC2)cc1O 2150041065 DKLMGAXTLQXXFZ-ZANVPECISA-N 287.306 2.042 10 10 CECE [N-]=[N+]=NCCCNS(=O)(=O)c1cccc2ncccc12 163328847 FJBGMIOIYAZYHY-UHFFFAOYSA-N 291.336 2.214 10 10 CECE CC(C)Cc1nsc(CN2CC(N=[N+]=[N-])C2)n1 1996823214 QVAGZVRXZWZUGE-UHFFFAOYSA-N 252.347 2.231 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H](CO)C(C)(C)C)c1 273749752 OWRLMZZQWXNZTC-IINYFYTJSA-N 267.369 2.458 10 10 CECE C[C@@H]1CCN(c2cc3c(cc2N)NC(=O)CC3)C[C@@H]1F 2152278154 HDPDLQZIVBUHGK-KOLCDFICSA-N 277.343 2.338 10 10 CECE O=C(NC[C@@H]1CC[C@@H]2[C@H]1C2(F)F)c1ccc(O)c(O)c1 2158390612 YLTOSJGJIPSYBM-SBMIAAHKSA-N 283.274 2.119 10 10 CECE CN(c1ccc(CO)c(Cl)c1)C1(CCO)CC1 2015859894 PCWFBDUGQWXONH-UHFFFAOYSA-N 255.745 2.184 10 10 CECE C[C@H](NCc1ccc2c(c1)CCN2C)C12CC(CO1)C2 2153221483 CQKLZCUZARRBBE-MKQDKFQKSA-N 272.392 2.336 10 10 CECE CC(C)N(C[C@@H]1COCCCO1)c1ccc(CN)cc1 2154010227 FSUIUCHYPWYKJR-MRXNPFEDSA-N 278.396 2.166 10 10 CECE Cc1nc(NC(=O)COc2ccc(N)cc2)sc1C 49095600 CWOYMWDYNDWEPI-UHFFFAOYSA-N 277.349 2.360 10 10 CECE CN1CC[C@@H]2CCN(Cc3ccc(F)c(F)c3O)C[C@@H]21 2158546362 JEIQRNREDKSUSX-MFKMUULPSA-N 282.334 2.196 10 10 CECE CO[C@@H]1CN(c2ccc(CO)cc2F)CC1(C)C 2032391228 IWUWCGLSJOTPNF-CYBMUJFWSA-N 253.317 2.179 10 10 CECE N[C@@H](c1ccccc1O)[C@@H](O)C1CCC(F)CC1 2032533905 JITARBKECXHYDS-FMPDERDJSA-N 253.317 2.281 10 10 CECE CC(C)[C@]1(O)CCN(c2ccc(CO)cc2Cl)C1 2033348433 IILWFMKHCBDKMW-AWEZNQCLSA-N 269.772 2.430 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CCS[C@H](C)C1 2034215663 FYYPJMPYJODUJR-LERXQTSPSA-N 267.394 2.299 10 10 CECE COCC1(C(=O)N2CCC(N=[N+]=[N-])CC2)CCC1 2039727507 XAJGIXPEIIJKPS-UHFFFAOYSA-N 252.318 2.104 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@H]2CN3CC[C@H]2C3)cc1 2158735888 QPHROFDETIEPQD-QRTARXTBSA-N 273.424 2.497 10 10 CECE CSc1ncccc1C(=O)NCc1ccc(N)cc1 700349536 NTZTUWPGCFLPSF-UHFFFAOYSA-N 273.361 2.316 10 10 CECE Cc1cc(Br)cc(CNCCN(C)C)c1O 309458129 NCZFRLSDQYVKGZ-UHFFFAOYSA-N 287.201 2.114 10 10 CECE CN(CC[C@@H]1CCCO1)c1cc2c(cc1N)OCCO2 2157288596 WZRKKYNSXJKUKN-NSHDSACASA-N 278.352 2.045 10 10 CECE COCCOC[C@@H]1CCCN1Cc1cccc(F)c1O 2158967861 LSYNMNHOUCMKBC-ZDUSSCGKSA-N 283.343 2.159 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@](C)(CN)C2)c1 311488741 JFJUMFAZCYFBPC-XHDPSFHLSA-N 264.369 2.133 10 10 CECE C[C@@H]1C[C@H](CCNCc2cc3c(cc2O)OCO3)CO1 2159421501 VBDVOEYWAUQVQN-MNOVXSKESA-N 279.336 2.026 10 10 CECE CN(C)c1ccc(CN(C)[C@H]2C[C@@H]3CC[C@H](C2)N3)cc1 2159674173 LKIKONPFWPJMPX-SCAQPMJSSA-N 273.424 2.467 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@]1(O)C=CCC1 2175779843 LGMGYMCZNOXIMG-IAGOWNOFSA-N 272.392 2.411 10 10 CECE CCN1CCc2cc([C@@H](NC)[C@@]3(O)C=CCC3)ccc21 2175782821 ZERHBEPPXXQFGI-IAGOWNOFSA-N 272.392 2.411 10 10 CECE Cc1ccc(O)c(CN2C[C@@H]3CCC[C@@]3(C(=O)O)C2)c1 701499632 DYTITPVXXIFDOH-XJKSGUPXSA-N 275.348 2.387 10 10 CECE Nc1ccc(OCCCN(C2CCC2)C2COC2)cc1 2161341502 GILQTXZXGHEIIN-UHFFFAOYSA-N 276.380 2.291 10 10 CECE CC[C@H](NC)c1ccc(N(C)C(COC)COC)cc1 701646632 ZOENCBMJRCEZGY-INIZCTEOSA-N 280.412 2.455 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1N(C)[C@H](C)c1c(O)cccc1O 2170419470 HPAPVIWDPVDBMS-UPJWGTAASA-N 278.396 2.431 10 10 CECE Cn1nc(C(F)(F)F)cc1[C@H](O)Cc1ccc(N)cc1 705297746 XWQJEFFCJACLJE-LLVKDONJSA-N 285.269 2.297 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3CN(C)C[C@H]3C2)cc1Cl 705618312 XHLDMCIDEJTBCZ-WOPDTQHZSA-N 280.799 2.391 10 10 CECE CC[C@@H]1C[C@H](N(C)Cc2cc(OC)ccc2O)CO1 688435244 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C[C@H](CCn1ccc2c(c1=O)CNCC2)C(F)(F)F 2228662985 GGFQMEZVKKNUTE-SECBINFHSA-N 274.286 2.083 10 10 CECE NCc1ccc(N2CC[C@H](OC(F)(F)CF)C2)cc1F 2238820787 PIPJYQIPJVRLLS-NSHDSACASA-N 292.276 2.442 10 10 CECE NCc1cc(F)c(N2[C@H]3CC[C@@H](O)[C@H]2CC3)cc1Cl 2229875070 UDPVRRNQFHXUPF-GAJTVXKRSA-N 284.762 2.430 10 10 CECE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H](O)[C@H]2CC3)c(F)c1 2229866745 YDPNCABTLJLKRD-NZQZLILVSA-N 265.328 2.371 10 10 CECE O[C@@H]1C=CCN(c2ccc(CNC3CCC3)cc2F)C1 2240009276 GCMKBSRLBIIZGA-CQSZACIVSA-N 276.355 2.205 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@H](C)CCS(C)(=O)=O 2240751333 DHZHSNWSECTNHM-OLZOCXBDSA-N 298.452 2.274 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)[C@@H]1CS(=O)(=O)C1(C)C 2240740784 GLIIMCDZDFGXEK-BXUZGUMPSA-N 296.436 2.027 10 10 CECE CS[C@@H]1CN(c2ccc([C@@H](C)N)cc2C)C[C@@H]1N(C)C 2240741990 HMZOBZDQDUNOHK-UHOFOFEASA-N 293.480 2.497 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@H](C(F)(F)CO)C1 2240835969 LRLLBKGJXPUZLS-AAEUAGOBSA-N 284.350 2.469 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCC[C@H](OCCO)C1 2240841632 JOXWFJAFICUCDR-HIFRSBDPSA-N 279.380 2.026 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(CC(N)=O)C1CCCC1 2240830018 LPWYKXOPWVEUIU-GFCCVEGCSA-N 276.380 2.283 10 10 CECE C[C@@]1(CO)C=CCCN1c1ccc(CN)c(Cl)c1 2253532080 BXAWIIZDIIFRMX-AWEZNQCLSA-N 266.772 2.316 10 10 CECE CCSC[C@H](N)CNCc1cnc(SC)s1 2243844492 NREKMTOYCWSENL-MRVPVSSYSA-N 277.484 2.035 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(CC23CC(C(F)F)(CO2)C3)C1 2255026759 JFQZKBKSZDKBNS-MFAVDMRSSA-N 258.272 2.185 10 10 CECE COC(=O)[C@@H]1CC[C@H]1CNCc1cnc(SC)s1 2256943629 UJIJVOVZRHITIV-WCBMZHEXSA-N 286.422 2.154 10 10 CECE Nc1ccc(OCC[S@](=O)[C@H]2C[C@@H]3C[C@@H]3C2)cc1 2257860196 CMJNXMAOWYDUHR-WZTYKQCMSA-N 265.378 2.195 10 10 CECE CSC1CC(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2248493579 LULPGSPIJQIWJW-HWOCKDDLSA-N 254.359 2.429 10 10 CECE CSc1ncc(CNCCNCC(F)(F)F)s1 2248741541 YRUKEEPCXVYPOO-UHFFFAOYSA-N 285.360 2.107 10 10 CECE CSc1ncc(CNC[C@@H]2CCC(C)(C)N2)s1 2248745914 YOMGWQRWFVHHSF-VIFPVBQESA-N 271.455 2.485 10 10 CECE CSc1ncc(CNCC[C@H]2CCCNC2)s1 2248744621 MOCNINVNGIOEEK-SNVBAGLBSA-N 271.455 2.344 10 10 CECE C[C@@H](O)c1ccc(N(C)CC2COC2)c(Cl)c1 2248990086 AHESHBZSTVQWMN-SECBINFHSA-N 255.745 2.476 10 10 CECE CCOC(=O)C1(NCCN=[N+]=[N-])CCC(F)CC1 2259181550 ZBJIOJUMZCLYBW-UHFFFAOYSA-N 258.297 2.100 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])[C@H]1CC12CCC2 2268440761 CPGOELGIEFHCPT-ZYHUDNBSSA-N 266.345 2.398 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CC2C[C@@H]3C1[C@@H]3C2 2279130330 XWHFNQQDHKNTRD-RSMJJIBBSA-N 273.332 2.214 10 10 CECE Cc1cc(N(C)Cc2ncccn2)ccc1[C@H](C)O 2269672704 PZBLSRBIWPETRV-LBPRGKRZSA-N 257.337 2.475 10 10 CECE CC(C)(N)c1csc(NC(=O)c2ccc(O)c(O)c2)n1 2282765191 WYZMHPRVEJNCHJ-UHFFFAOYSA-N 293.348 2.000 10 10 CECE CCCN1CCN(c2ccc([C@H](C)N)c(C)c2)CC1=O 2285124075 LSYUTRJUTBWVQV-ZDUSSCGKSA-N 275.396 2.073 10 10 CECE Cc1cc(N2C[C@H]3CCN(C)C[C@H]3C2)ccc1[C@H](C)N 2285252641 DLNVNSSPEQJMRK-ZNMIVQPWSA-N 273.424 2.403 10 10 CECE Cc1ccc(O)c(CN2CC(F)(F)[C@@](C)(C(=O)O)C2)c1 2295474650 MGTMUGUFBVIHAF-CYBMUJFWSA-N 285.290 2.242 10 10 CECE COc1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)c(OC)c1C 2295463293 MYTWWKXIHSWCQA-AVGNSLFASA-N 277.364 2.077 10 10 CECE COc1ccc(N2CC([C@H]3CCNC3)C2)c(OC)c1C 2295419517 RZXZFUAPTGQLRV-LBPRGKRZSA-N 276.380 2.058 10 10 CECE CN(C(=O)C[S@](=O)CC1=CCCC1)c1ccc(N)cc1 2296255463 KJWRSUCXYIIDQN-HXUWFJFHSA-N 292.404 2.091 10 10 CECE O[C@H](c1ccc(N2CCNCC2)cc1)c1cscc1F 2286065459 JIOSIGJVBRUXQW-OAHLLOKOSA-N 292.379 2.379 10 10 CECE CN(C)c1ccc([C@@H](O)c2ccnc3c2CCO3)cc1 2286318378 ISDRIZCMJSGXQX-OAHLLOKOSA-N 270.332 2.164 10 10 CECE CC[C@@H](C)[C@H](NC(=O)c1cc(O)c(O)c(O)c1)C(F)F 2287321692 XTLBSVQIFZTVOR-LDWIPMOCSA-N 289.278 2.213 10 10 CECE Cc1cnnc([C@@H](N)c2ccc3c(c2)CCCN3C)c1 2288684543 VQWIZGZMDLIQNK-INIZCTEOSA-N 268.364 2.216 10 10 CECE COc1cc(CCN)cc(Sc2nccs2)n1 2301335035 COJKEFPIAASCPK-UHFFFAOYSA-N 267.379 2.199 10 10 CECE CNCc1ccc(OC)c(CSCC(C)(C)O)c1 2315206857 OYWLLEWAJAQVNS-UHFFFAOYSA-N 269.410 2.419 10 10 CECE Cc1ccc(N=NN2CCC(C(N)=O)CC2)cc1C 2330272735 FWFKWAPXOKPWQN-UHFFFAOYSA-N 260.341 2.499 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)CCCCCOC 2341322156 XMBRLEQVMDRUOT-GJZGRUSLSA-N 267.369 2.220 10 10 CECE CC[C@](C)(CN(C)Cc1ccccc1O)C(=O)OC 2343226393 JMONMCWEEVVSNN-OAHLLOKOSA-N 265.353 2.413 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3CC[C@H]2[C@H](O)C3)c(F)c1 2349961439 URUHHQWTFIWQQF-FCIDVOKBSA-N 264.344 2.195 10 10 CECE CSc1cc(N2CCOC[C@@H]2C2CC2)ccc1CN 2353857424 SIHKMRMPWZGXHK-CQSZACIVSA-N 278.421 2.482 10 10 CECE CN[C@@H]1CCc2cc(N3[C@H]4CC[C@@H]3C[C@H]4CO)ccc21 2356172052 ICIDZAVLFXJRLR-JFOHDYCDSA-N 272.392 2.243 10 10 CECE O=C1CN(Cc2ccccc2)[C@@H](c2ccccc2O)N1 112370411 ARNLDTPZJZHHAZ-INIZCTEOSA-N 268.316 2.023 10 10 CECE CO[C@](C)(CNCc1ccc(O)cc1O)C1CC1 310923750 SUIJVCNMXPPACJ-CQSZACIVSA-N 251.326 2.003 10 10 CECE CC(C)OC(=O)[C@@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1O 177488642 PQGVERCZHBMWBX-SNVBAGLBSA-N 296.323 2.072 10 10 CECE CN(CCO)c1ccc(CNC(C)(C)C)cc1F 62736425 DTRFXAWSPABYPT-UHFFFAOYSA-N 254.349 2.142 10 10 CECE COc1ccc(N(C)[C@@]2(CN)C[C@@H](C)N(C3CC3)C2)cc1 123183979 ZCAAVQFIHMYLPU-CXAGYDPISA-N 289.423 2.086 10 10 CECE NCc1ccc(N2CCC2)c(F)c1Br 307170542 KQRGNWHPOUGPTI-UHFFFAOYSA-N 259.122 2.257 10 10 CECE COc1cc(Br)cc(C2(N)CC2)c1O 217936495 LFYVBFJUEVLGCP-UHFFFAOYSA-N 258.115 2.111 10 10 CECE CN(C)c1ccc(CNc2ccccc2CC(N)=O)cc1 37124931 NMYOAEOUTCKPLA-UHFFFAOYSA-N 283.375 2.393 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](C(F)(F)CO)C2)cc1 1892714896 KAGWNMQOMWHGTG-PWSUYJOCSA-N 271.307 2.194 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](C3(O)CC3)C2)cc1 2130503572 OJMGDOXNXWOSDP-TZMCWYRMSA-N 260.381 2.448 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)Cc2ccncc2)cc1 36775784 BFXUOSZGQBBHEK-KRWDZBQOSA-N 284.407 2.279 10 10 CECE CCC[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)N(C)C 120498437 ODUADIXLPBRXMB-MRXNPFEDSA-N 291.439 2.441 10 10 CECE COc1cccc(CN(C)CCOC(C)C)c1O 211630460 SRNAZZAKNQQANG-UHFFFAOYSA-N 253.342 2.258 10 10 CECE COc1cc(O)c(CN[C@@H]2CC[C@@H](OC)C2)cc1OC 189224026 WZMPHQFOYKUOHC-VXGBXAGGSA-N 281.352 2.067 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2C[C@@H]3CC[C@@H]2O3)c1 132120217 INFJNBSMFJMEBR-GVAXYQGFSA-N 263.337 2.371 10 10 CECE Oc1ccccc1CNC[C@@H](O)c1ccc(F)c(F)c1 133890841 NSQXQMLMIZCKMF-OAHLLOKOSA-N 279.286 2.494 10 10 CECE CN1CCC[C@@H](NCc2cc(Cl)ccc2O)C1 40672112 IAKBVQOXZHIHMH-GFCCVEGCSA-N 254.761 2.229 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@@H](O)C2)c(Cl)c1 230280724 SFXPVYLEQTXCHU-HZMBPMFUSA-N 268.788 2.267 10 10 CECE CC[C@H](N[C@@H]1CCN(C)C1=O)c1ccc(N(C)C)cc1 90074911 YCXFYKUFEBLDHS-LSDHHAIUSA-N 275.396 2.024 10 10 CECE CN(C)c1ccc([C@H](NN)c2cccc3c2OCC3)cc1 97795500 QITPWSLMEUADIG-INIZCTEOSA-N 283.375 2.240 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCCC1(C)C 94282801 HXYPGNHDDBXVKI-LBPRGKRZSA-N 254.334 2.398 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1ccc(Cl)cc1 90256523 AHZWVZNQAPBHNO-VIFPVBQESA-N 254.677 2.366 10 10 CECE Oc1ccc(-c2nc(CNC3CC3)cs2)cc1O 236570971 CUOFAPTZKXNPBY-UHFFFAOYSA-N 262.334 2.473 10 10 CECE O=C(/C=C\c1cncc(F)c1)N1CCc2cnccc21 255864523 IGLVZNGGBGHZJS-UPHRSURJSA-N 269.279 2.218 10 10 CECE Nc1ccc(CCCO[C@H]2CN3CCC2CC3)cc1 1893439987 BZRPGBZEJOYECI-INIZCTEOSA-N 260.381 2.312 10 10 CECE COC(=O)[C@@H](C)c1c(Br)cc(F)c(O)c1O 260712960 WNWUUHDSDFOHJR-BYPYZUCNSA-N 293.088 2.276 10 10 CECE CO[C@@H](C)c1noc(CN(C)Cc2cccc(C)c2O)n1 271864942 RABNMNWTRYTMPG-NSHDSACASA-N 291.351 2.423 10 10 CECE COC1(C)CN(c2ccc(/C=C\C(=O)O)cc2C)C1 382956333 NTONGEAHAZNPKV-ALCCZGGFSA-N 261.321 2.318 10 10 CECE CC(=O)C(=O)COC(=O)c1cc2ccccc2c(Cl)n1 808503501 PINBMBRIBDORFL-UHFFFAOYSA-N 291.690 2.203 10 10 CECE C[C@H](NCC1CC2(CC(O)C2)C1)c1c(O)cccc1O 2164528381 PKXRHWNWHLEGEW-MJMQAPBISA-N 277.364 2.300 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2cnccn2)cc1 700096891 AIMPAFGQICGAGA-GFCCVEGCSA-N 256.353 2.393 10 10 CECE COc1ccc(N2CC[C@]3(CCCNC3)C2)c(OC)c1 2162672309 WVXBDBHGBMZOBS-INIZCTEOSA-N 276.380 2.284 10 10 CECE CCN(CC)c1ccc([C@]2(O)CC[C@H]3CNC[C@H]32)cc1 2163098049 APDXJTFILYNAKC-IAOVAPTHSA-N 274.408 2.350 10 10 CECE CCN1CCc2cc([C@H](CC(C)(C)OC)NN)ccc21 2163156768 UWVUMDORRFKOGZ-AWEZNQCLSA-N 277.412 2.389 10 10 CECE CN1CCCc2cc([C@H](N)[C@H](O)c3cscn3)ccc21 2163229755 LRKSUEUYIVNTBR-LSDHHAIUSA-N 289.404 2.259 10 10 CECE CC1CC([C@@H](O)[C@H](N)c2ccc3c(c2)CCCN3C)C1 2163231902 WRVFFPKARBBBIM-QBULYQSFSA-N 274.408 2.476 10 10 CECE C[C@@H](C(=O)N(C)Cc1ccc(N)cc1)[C@H]1CCCCO1 711901437 QRFFAZFOKHIOGK-IUODEOHRSA-N 276.380 2.432 10 10 CECE O=C(/C=C/c1cccnc1)N(CCO)c1ccccc1 714409635 HTYUHQGBYRYYCC-CMDGGOBGSA-N 268.316 2.120 10 10 CECE Cc1cc(CN2CCN(CC(F)F)CC2)ccc1N(C)C 815029472 URCOQRCNBMDTEV-UHFFFAOYSA-N 297.393 2.444 10 10 CECE Cc1ccc(O)c(CN2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1 824653787 IASOXGULSFDJQS-BMFZPTHFSA-N 291.391 2.062 10 10 CECE CC1(C)CN(Cc2cc(Cl)cc(F)c2O)C[C@@H]1N 903986766 RLNREMWJECEGSG-NSHDSACASA-N 272.751 2.354 10 10 CECE CCN(C/C=C/c1ccc(N(C)C)cc1)CC(=O)N(C)C 835026220 SKHCCZIKBORITC-BQYQJAHWSA-N 289.423 2.176 10 10 CECE COc1ccc(CNC(=O)[C@@H](C)Cc2ccco2)c(O)c1 846950812 RQMLGOFSHSREOF-NSHDSACASA-N 289.331 2.489 10 10 CECE COc1ccc(CNC(=O)[C@H](C)Cc2ccco2)c(O)c1 846950808 RQMLGOFSHSREOF-LLVKDONJSA-N 289.331 2.489 10 10 CECE Cc1cc(N(C)C)ccc1CNCC1(CCO)CC1 840939316 MTEDHSSFKJSSHO-UHFFFAOYSA-N 262.397 2.313 10 10 CECE COc1ccc(O)c([C@H](C)NCc2cncnc2OC)c1 845971909 NZWWHMXPCDGRQQ-JTQLQIEISA-N 289.335 2.050 10 10 CECE C[C@@H](NC[C@@H]1CC[C@H](N)C1)c1ccc(F)cc1O 925882724 QMRKBYAGJRULHB-FOGDFJRCSA-N 252.333 2.309 10 10 CECE CC(=O)c1cc(F)cc(CN(C)C[C@H]2CCCO2)c1O 48948792 CRMYWSYTPMZNBC-CYBMUJFWSA-N 281.327 2.345 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)CC[C@@H](C)N 70317029 NRYHFJQLOMLSDQ-MNOVXSKESA-N 250.342 2.039 10 10 CECE Cc1noc(CN[C@@H](C)c2cc(F)ccc2O)n1 94617757 BOVWVNHNQMZFOJ-ZETCQYMHSA-N 251.261 2.074 10 10 CECE COc1cccc(O)c1CNCC1(CO)CC2(CCC2)C1 788530198 WLEMXBFTYHLYCA-UHFFFAOYSA-N 291.391 2.433 10 10 CECE CCOc1ccc(CN[C@@H](C)[C@@H](C)OC)c(O)c1 786169125 QTNDJKHPNOCGJQ-WDEREUQCSA-N 253.342 2.304 10 10 CECE Cc1ccc([C@H](N)c2nnc(-c3ccco3)o2)c(O)c1 83518766 YBJDPQUOIDVTCM-LBPRGKRZSA-N 271.276 2.392 10 10 CECE COc1ccc([C@@H]2NCCc3ccc(N)cc32)c(O)c1 83651814 NOBLAHAFLUTWLN-INIZCTEOSA-N 270.332 2.218 10 10 CECE COc1cc2c(cc1OC)N(C)C[C@H]2CCC(=O)O 84165761 JLBGEODCYDVHSZ-SECBINFHSA-N 265.309 2.102 10 10 CECE CCC[C@H](N[C@@H](C)c1cc(O)ccc1O)C(=O)O 86733151 NOFQODHKCIGEIL-KWQFWETISA-N 253.298 2.002 10 10 CECE CCc1ccc([C@@H](NCCN=[N+]=[N-])C(=O)OC)cc1 90256915 YMKMSANLOHFNJA-GFCCVEGCSA-N 262.313 2.363 10 10 CECE CC(C)[C@H]1C[C@H](N(C)Cc2cc(N)ccc2O)CO1 691723793 NTZRQSHKAQCKBZ-DZGCQCFKSA-N 264.369 2.220 10 10 CECE Oc1cccc(Cl)c1CNC[C@H]1CCN1C1CC1 691801670 DFRPIZANGFXFKN-LLVKDONJSA-N 266.772 2.372 10 10 CECE COc1cc(N)c(N2CC[C@@H](CF)C2)cc1OC 711459441 BWGXDZXIKDUTQP-VIFPVBQESA-N 254.305 2.082 10 10 CECE CCN(Cc1cccc(C(N)=O)c1)c1ccc(N)cc1 63114718 MZKODPQAICABRY-UHFFFAOYSA-N 269.348 2.394 10 10 CECE Cc1cccc(CN[C@H]2CCCC3(C2)OCCO3)c1O 715714524 DGPVIDBOJNWTIY-AWEZNQCLSA-N 277.364 2.476 10 10 CECE O=C(NCc1ccc(O)cc1O)c1c(F)ccnc1Cl 1142533994 VMGPNCKMGNWHFG-UHFFFAOYSA-N 296.685 2.215 10 10 CECE C[C@H](O)C1CN(c2ccc(CO)c(C(F)(F)F)c2)C1 719866330 IGPOLIZVFKEXAW-QMMMGPOBSA-N 275.270 2.015 10 10 CECE COc1ccc(N(C)[C@]2(CN)CCO[C@H](C)C2)cc1 70365525 DOHZYAZNYZQJHD-IUODEOHRSA-N 264.369 2.028 10 10 CECE Cc1cccc(S(=O)(=O)N2CCC[C@H]2CN=[N+]=[N-])c1 692822398 JGDIYLDYNSRMNP-NSHDSACASA-N 280.353 2.458 10 10 CECE Nc1ccc(NC(=O)CCN2CCC[C@H]3C[C@@H]32)cc1 1916855613 GYRRHWAOYLHKQB-FZMZJTMJSA-N 259.353 2.082 10 10 CECE COc1ccc(N(C)[C@H]2CN(C)C(C)(C)C2)c(N)c1 694182608 XHZHCYDVVKQZCQ-LLVKDONJSA-N 263.385 2.196 10 10 CECE O=S(=O)(CC(F)F)Nc1ccc(O)c(Cl)c1 695106904 JURWANLIYQYUCP-UHFFFAOYSA-N 271.672 2.052 10 10 CECE C[C@@H](N)c1ccc(N2CC3(COC3)C2)cc1Br 697097407 WWSYHGNWNQUKPP-SECBINFHSA-N 297.196 2.305 10 10 CECE C[C@]1(C(F)F)CN(c2ccc(CN)cc2)CCO1 698729059 MEVFOXIWWIKYOV-CYBMUJFWSA-N 256.296 2.006 10 10 CECE Cc1ccc([C@@H](NN)c2ccc(N(C)C)cc2)cn1 97734093 GMSSATFMVFRVPA-HNNXBMFYSA-N 256.353 2.009 10 10 CECE Cc1c(/C=C/C(=O)N2CCc3c(F)cccc32)cnn1C 183770617 BWAVIDPWCBPLNV-VOTSOKGWSA-N 285.322 2.470 10 10 CECE CCCNCc1ccc(N2C[C@@H]3CCO[C@@H]3C2)cc1 2115403220 OQFHUWKPPNGFDP-GOEBONIOSA-N 260.381 2.411 10 10 CECE C[C@@]1(CO)CCCN1c1ccc2c(c1)CCC[C@H]2N 2128274475 PAWYHQQIULJZFK-CVEARBPZSA-N 260.381 2.374 10 10 CECE C[C@H]1C[C@H](O)[C@H](C)CN1c1ccc2c(c1)CC[C@@H]2N 2128324603 HNNMTYSFBNGDPV-OVTCNUJSSA-N 260.381 2.228 10 10 CECE CN(C)[C@H]1CCCN(c2ccc3c(c2)CC[C@H]3O)C1 2128316484 GEFJBMDNTBVTDE-GOEBONIOSA-N 260.381 2.197 10 10 CECE Cc1cc(CO)ccc1N1CCC[C@@H]2[C@H]1CCN2C 2127391611 WLZSZAQGEZGIPV-HZPDHXFCSA-N 260.381 2.160 10 10 CECE C[C@@H]1CC[C@@H](C(=O)O)[C@H](c2ccc(N(C)C)cc2)N1 2120214250 QRUSGXYDNZVGDC-HONMWMINSA-N 262.353 2.266 10 10 CECE CCCNCc1ccc(N2CC[C@@H]2[C@H](C)O)cc1C 2125823030 OAEKVOWHZYKEOJ-XJKSGUPXSA-N 262.397 2.454 10 10 CECE CC[C@H](C(F)F)N(C)C(=O)COc1ccc(N)cc1 2122249438 TUAPUOXEKFYJSQ-LLVKDONJSA-N 272.295 2.150 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCC[C@H]3N)C[C@H]1O 2128271891 FTBUTSJSYQSFNM-HUUCEWRRSA-N 260.381 2.230 10 10 CECE CCOC12CC(C1)N(c1ccc3c(c1)CC[C@H]3O)C2 2129032668 YOVDIIGPSCSYCK-OGVSOVDVSA-N 259.349 2.424 10 10 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278.695 2.076 10 10 CECE Cc1cccc(CN2CC[C@](CO)(C(F)(F)F)C2)c1O 895836560 MMFLQYZBNGQGKX-ZDUSSCGKSA-N 289.297 2.447 10 10 CECE Oc1cccc(F)c1CNCCn1cc(Cl)cn1 1964055038 DPDXQNCRLXJRNW-UHFFFAOYSA-N 269.707 2.171 10 10 CECE CC[C@@H](N)c1ccc(N2CCC[C@@H]2C(=O)N(C)C)cc1 2143712617 JECNREIBWGRKOJ-HUUCEWRRSA-N 275.396 2.153 10 10 CECE C[C@@]1(c2cc(Br)ccc2O)COC(=O)N1 1951527622 CRQFBDCQIPXQEG-JTQLQIEISA-N 272.098 2.110 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@@H]3C[C@H](O)[C@H]3C2)c1O 1966350490 NAZPXHYRMHBHNA-HERUPUMHSA-N 295.766 2.061 10 10 CECE Cc1cccc(O)c1CN1C[C@@H](C)C[C@H](C(=O)O)C1 1968181883 IIADVTCMTNLBEM-JQWIXIFHSA-N 263.337 2.243 10 10 CECE Cc1ccc([C@H](C)N[C@H](C)[C@H](C)S(C)(=O)=O)c(O)c1 1970411275 WWUQUPLYHJPVOW-WOPDTQHZSA-N 285.409 2.173 10 10 CECE Cc1nc[nH]c1CCNCc1ccc2c(c1)CCCO2 1970611825 FVPDAPLAHYCSOP-UHFFFAOYSA-N 271.364 2.375 10 10 CECE CO[C@H](CCO)CNCc1cc(Cl)cc(Cl)c1O 1972504555 WWHXARQNSXGJFU-SNVBAGLBSA-N 294.178 2.186 10 10 CECE CN1CCCCCN(Cc2cc(N)ccc2O)CCC1 2144948765 DUYXFJMYPHGSIN-UHFFFAOYSA-N 277.412 2.282 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@H](C)[C@H](O)C[C@@H]2C)c1 2149520325 VWMJMEKDXPQYRB-XMZIXOGTSA-N 277.364 2.186 10 10 CECE CCOC(=O)CC[C@@H](N)c1c(O)ccc(F)c1F 260884508 VVWBTIYNRROTCX-MRVPVSSYSA-N 259.252 2.014 10 10 CECE Cc1ccccc1CC(=O)NCc1cc(N)ccc1O 36737478 FUXSGXMOGQJEIQ-UHFFFAOYSA-N 270.332 2.142 10 10 CECE Nc1ccc(CCN2CCOC[C@H]2CC(F)(F)F)cc1 2150386870 MFAPUDWVSUIGSX-CYBMUJFWSA-N 288.313 2.465 10 10 CECE CC(C)C(=O)N1CCC(NCc2ccccc2O)CC1 37142592 HAQFKXGOUTYBAT-UHFFFAOYSA-N 276.380 2.129 10 10 CECE Cc1cc(C(=O)[C@@H](O)c2ccc3c(c2)CCN3C)sn1 2147119219 WHIIPCDBXDRHQH-AWEZNQCLSA-N 288.372 2.360 10 10 CECE CCOCC1CN(c2ccc(CN)c(Cl)c2)C1 2001346515 YYEQCSWQCXWSMM-UHFFFAOYSA-N 254.761 2.271 10 10 CECE CO[C@@H]1C=C[C@H](NCc2ccc(Cl)cc2O)C1 2007118534 HQRDEEUMNZZMBS-NWDGAFQWSA-N 253.729 2.479 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H]3C[C@H](O)[C@H]3C2)cc1 2151390727 FGCSJIJLLCAWAC-XIRDDKMYSA-N 274.408 2.249 10 10 CECE CC1=C[C@@H](C)CN(c2cc3c(cc2N)OCC(=O)N3)C1 2152307485 XGKUZBNYHDPKME-SECBINFHSA-N 273.336 2.002 10 10 CECE CC[C@@H]1CO[C@H](C)CN1C(=O)Nc1ccc(N)cc1 48916595 ZDSHMJXCFOWYIX-ZWNOBZJWSA-N 263.341 2.300 10 10 CECE C[C@H]1[C@@H](CC(=O)O)CCN1[C@H](C)c1ccc(O)cc1O 2153492829 KZRCTBPDVBNAGH-HBNTYKKESA-N 279.336 2.344 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CC[C@H]2CNC[C@H]21 2016950518 ALYIPFPYFXFHBV-YGOYTEALSA-N 251.761 2.332 10 10 CECE NCc1ccc(N2C[C@@H]3COCC[C@H]32)cc1Cl 2017875861 HBERTEGLUMIJQX-ZWNOBZJWSA-N 252.745 2.024 10 10 CECE Oc1c(Br)cccc1CN[C@H]1C[C@]12CCOC2 2021239667 BEASSKYMQMVOMX-AAEUAGOBSA-N 298.180 2.423 10 10 CECE COC[C@](C)(NCc1cccc(O)c1O)C1CC1 2028616940 MTDHKCJZBAXCJQ-AWEZNQCLSA-N 251.326 2.003 10 10 CECE COc1ccc(O)c(CN(C)C[C@@]2(C)CCCN2C)c1 2154953959 VSWBMABXHMCUSN-MRXNPFEDSA-N 278.396 2.317 10 10 CECE CCN(C(=O)[C@@H](OC)C(C)C)c1ccc(N)cc1 2032754365 MIHGTZVJJCBESK-ZDUSSCGKSA-N 250.342 2.293 10 10 CECE O=S(=O)(C[C@@H]1CC[C@H](F)C1)Nc1ccc(O)cc1 2032991628 GUTZLOMJFFBWOU-ZJUUUORDSA-N 273.329 2.272 10 10 CECE 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10 10 CECE CNCc1ccc(N2[C@H]3CC[C@H]2[C@H]2CC[C@@H]3O2)cc1 1901386542 HQDURMZCOXDDNB-YHUYYLMFSA-N 258.365 2.305 10 10 CECE CN(c1ccc(CO)cc1)[C@@H]1C[C@H]2[C@@H]1[C@H]1CC[C@H]2O1 2132223472 NEGMSMNNWCLRTL-QCODTGAPSA-N 259.349 2.181 10 10 CECE COC[C@H]1CC[C@H](c2ccc3c(c2)CCN3C)NC1 1907829661 BYLLWKKOZNVADJ-SWLSCSKDSA-N 260.381 2.366 10 10 CECE CN(CCOC1CC1)c1ccc(CN)c(F)c1F 1914542023 QJWGUSWTEDSVCJ-UHFFFAOYSA-N 256.296 2.039 10 10 CECE CN(c1ccc(CO)cc1C(F)(F)F)C1CC(O)C1 1914576163 WXPSPIHHMVHJJK-UHFFFAOYSA-N 275.270 2.157 10 10 CECE COc1ccc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)cc1F 1912194907 CARBZOICUBVIQT-SECBINFHSA-N 264.260 2.359 10 10 CECE COCCCOCCN1CCC(CN=[N+]=[N-])CC1 1912145816 LPTJNWDZILDOLR-UHFFFAOYSA-N 256.350 2.062 10 10 CECE C[C@@H]1CN([C@H](C)C(=O)Nc2ccc(N)cc2)C[C@@H]1C 219595425 YFQUYIGXKGOIOP-GRYCIOLGSA-N 261.369 2.184 10 10 CECE Nc1ccc(CS(=O)(=O)N2CC3(CCCCC3)C2)cc1 1915317935 CTZMOYXDEMZNTB-UHFFFAOYSA-N 294.420 2.365 10 10 CECE CCC=C1CCN(c2ccc3c(c2)NC(=O)[C@H]3O)C1 1915318563 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264.369 2.290 10 10 CECE COc1cccc(CNC[C@]23C[C@](C)(CO2)C3)c1O 1879818512 BSWOQRKNVSHQQV-GASCZTMLSA-N 263.337 2.060 10 10 CECE CN(C)c1ccc2c(c1)CCN2C[C@@H](O)c1ccco1 2143373365 QKDMORMOZFXHEH-OAHLLOKOSA-N 272.348 2.442 10 10 CECE Nc1ccc(OCCC(=O)NC2CCSCC2)cc1 136302846 NJRVSJCBVXWDJD-UHFFFAOYSA-N 280.393 2.050 10 10 CECE CC1(C)SC(COc2ccc(N)cc2)=N[C@H]1C(=O)O 1882736552 SCJZHNVBJATFJJ-NSHDSACASA-N 280.349 2.025 10 10 CECE COc1cccc(O)c1CN[C@@H](CCO)C1CCCC1 897885895 RWWXZZLKIXHUPL-AWEZNQCLSA-N 279.380 2.432 10 10 CECE CN1CCCC[C@H]1CNCc1c(O)cccc1F 1964043508 QKNLEFHVSSJCLN-NSHDSACASA-N 252.333 2.105 10 10 CECE CC1(C)COC[C@H](CNCc2c(O)cccc2Cl)O1 1965913859 VEOOCIRWQYHTSI-JTQLQIEISA-N 285.771 2.329 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1CC(F)(F)CO1 1966157415 FDZIWHWTHGQELF-NSHDSACASA-N 257.280 2.248 10 10 CECE CCN[C@H](C)c1ccc(N(CCO)C2CC2)c(F)c1 42479854 KUCRYLCRSAYNBE-LLVKDONJSA-N 266.360 2.457 10 10 CECE CC(C)(CNC(=O)Cc1ccc(N)cc1)[C@@H]1CCCO1 1967299153 MXDZSBOSONQQOK-AWEZNQCLSA-N 276.380 2.133 10 10 CECE Oc1ccc(CCNC[C@H]2CC23CCOCC3)cc1O 2149707142 IVNDRTLKUWCOIW-CYBMUJFWSA-N 277.364 2.047 10 10 CECE CC(C)[C@H]1CCN1[C@@H](CN)c1ccc2c(c1)CCN2C 2144904446 PYWSIHFMJBWLFP-WBVHZDCISA-N 273.424 2.409 10 10 CECE CCN(Cc1c(C)cccc1O)[C@@H](C)CN(C)C 1971305427 PLMVNEUIMLHWTR-ZDUSSCGKSA-N 250.386 2.473 10 10 CECE Oc1ccc(F)cc1CNCC1CC2(CC(O)C2)C1 1972731736 LQIAJXMOPUBFNE-UHFFFAOYSA-N 265.328 2.172 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)C3CC(F)(F)C3)ccc21 2145870703 TUEVEOMDYVEMTD-GFCCVEGCSA-N 281.306 2.133 10 10 CECE CN1CCN(c2ccc([C@@H]3CCCCN3)cc2F)CC1 258652933 QHXQQSWPQPAHHN-HNNXBMFYSA-N 277.387 2.392 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)C2(Br)CCC2)C1 1980143253 MKMXRXLHQXYWAS-QMMMGPOBSA-N 287.161 2.463 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](O)C(F)(F)CC2)c(F)c1 2150043260 RUODNWHVPKOGSR-NOZJJQNGSA-N 289.297 2.475 10 10 CECE Oc1cc2c(cc1CNC/C=C/Br)OCO2 1980884776 JVGOQTRKWHBYPI-OWOJBTEDSA-N 286.125 2.119 10 10 CECE CN1CCCN(c2ccc(CNC3CC3)cc2F)CC1 34824316 FRUHTRLUZOGDMM-UHFFFAOYSA-N 277.387 2.220 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC[C@@H](C2CNC2)C1 2149002398 CHRLTONHFCYXLE-NWDGAFQWSA-N 276.380 2.090 10 10 CECE CC(C)C[S@](=O)CCCC(=O)Nc1ccc(N)cc1 40970090 FFEHNBJRSKGEFS-IBGZPJMESA-N 282.409 2.392 10 10 CECE Cn1c(Cl)cnc1C=C1[C@@H]2CCN[C@H]2C1(C)C 2007079382 WDRSXKWYMWXAAM-QPUJVOFHSA-N 251.761 2.475 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1COCC[C@@H]1C 2152556334 AYLSCKDJESYPFP-GWCFXTLKSA-N 278.352 2.282 10 10 CECE COC[C@H]1C=CCN1c1ccc(CN)c(Cl)c1 2011284606 GGUFMLMXLTXTDH-GFCCVEGCSA-N 252.745 2.190 10 10 CECE C[C@H]1C(=O)N(c2ccc(C(F)(F)F)cc2)N=C1C(=O)O 2154695607 GSUQVEKARLWBCA-ZCFIWIBFSA-N 286.209 2.129 10 10 CECE COc1ccc(N(CCCN)[C@@H]2CCCC[C@@H]2O)cc1 2155617945 ZKCFAFXCHBJRBE-CVEARBPZSA-N 278.396 2.154 10 10 CECE COc1ccc(N(CCN)CC(F)F)cc1Cl 2024012734 KRPZGTGCORCYNL-UHFFFAOYSA-N 264.703 2.379 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCOCC[C@H]1C 2031608479 UEHFLLDIKWDYSW-MNOVXSKESA-N 251.326 2.270 10 10 CECE C[C@H]1[C@@H](COC(=O)Cc2ccc(N)cc2)C1(F)F 2034368376 PQJZXVXFGGXFIK-GZMMTYOYSA-N 255.264 2.256 10 10 CECE Nc1ccc(OCCN2CCCC[C@H](F)C2)cc1 2034845381 QDBAHTGNYQDBTE-LBPRGKRZSA-N 252.333 2.472 10 10 CECE CC[C@@H]1CNCCCN1Cc1ccc2c(c1)CCN2C 2159166573 WQIZZKZELMHTBB-MRXNPFEDSA-N 273.424 2.253 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H]3OCCC[C@H]23)c1 187343061 GRBRRFOVURUJBQ-UMVBOHGHSA-N 263.337 2.058 10 10 CECE C[C@H](NC[C@@H]1CCCC[C@H]1O)c1c(O)cccc1O 300443763 ZBDATKWZEAFMTA-SDDRHHMPSA-N 265.353 2.300 10 10 CECE CCCN(C(=O)CCc1ccc(N)cc1)[C@H]1CCOC1 312874837 ZDOPRUCPMFMQJA-HNNXBMFYSA-N 276.380 2.229 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H]2COCC2(C)C)c1 313060181 MPTPGPNEHSVKHM-QMTHXVAHSA-N 265.353 2.476 10 10 CECE CC[C@H](CC(=N)NO)NCc1ccc2c(c1)CCCO2 2160559120 HNKKVEARIUVAKG-CYBMUJFWSA-N 277.368 2.226 10 10 CECE Cc1cccc(OCCC(=O)NCCN=[N+]=[N-])c1C 701271077 RINHFQBNFRXHHI-UHFFFAOYSA-N 262.313 2.499 10 10 CECE CN(CC(=O)NCc1cccs1)c1ccc(N)cc1 702110696 MXEOKXRNANWSHW-UHFFFAOYSA-N 275.377 2.083 10 10 CECE CN(CC1(C)COC1)c1ccc(CNC2CC2)cc1 702955106 KXPCYNIIHLHMAU-UHFFFAOYSA-N 260.381 2.411 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@@]3(C)C[C@H]3C)ccc21 704015769 FFJXODOSRIAVCD-FUEDEBDSSA-N 273.380 2.382 10 10 CECE Cn1nccc1[C@@H]1CCN(c2ccc(CN)cc2F)C1 2171776801 XPJDOBDBCXYMSE-GFCCVEGCSA-N 274.343 2.012 10 10 CECE CCCN(C(=O)[C@H]1COC[C@@H]1C)c1ccc(N)cc1 705289545 LUHDLOPFYNMQMF-FZMZJTMJSA-N 262.353 2.294 10 10 CECE O=C(N[C@@H]1CC[C@@H]2CCC[C@H]21)c1cccc(O)c1O 707966580 PVGSJVRWJDEDFB-HOSYDEDBSA-N 261.321 2.406 10 10 CECE CNCc1ccc(N2CCC[C@H](C)[C@H]2CO)c(F)c1 708430626 LNWMUEUTMSJUBR-XHDPSFHLSA-N 266.360 2.142 10 10 CECE CNCc1ccc(N(C)C[C@@H](COC)OC)cc1Cl 691357177 VSBJVUUUNQBKAY-ZDUSSCGKSA-N 286.803 2.157 10 10 CECE CN1CCCc2cc([C@H]3CCC[C@H](C(=O)O)N3)ccc21 2163111267 QCIPKVDZMJNBJZ-ZIAGYGMSSA-N 274.364 2.337 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CSCCN3C)ccc21 2163106780 LKSBRZGWDRAPQO-HOTGVXAUSA-N 292.448 2.150 10 10 CECE Nc1ccc(O)c(CN2CCC[C@H](N3CCCC3)C2)c1 382619275 XHWUXLYCWWSBRY-HNNXBMFYSA-N 275.396 2.035 10 10 CECE COC[C@H](CCN[C@H](C)c1cc(OC)ccc1O)OC 694363096 XYAIOXXBKBVNIO-YPMHNXCESA-N 283.368 2.103 10 10 CECE CNCc1ccc(N2C[C@@H](O)C[C@H]2C)c(Cl)c1 384792769 VJRGRGBMCDSICG-KOLCDFICSA-N 254.761 2.019 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](CO)[C@@H]2C)c(F)c1 385671899 NCSMSAQWIIIJAY-MDZLAQPJSA-N 266.360 2.313 10 10 CECE CCOC[C@H]1CCCN1C(=O)CCc1ccc(N)cc1 696580536 SFSFYWYAPGUKNI-OAHLLOKOSA-N 276.380 2.229 10 10 CECE OC[C@@H](NCc1cccc(O)c1O)C1CCCCC1 386184784 HZARZVWIGLVMBJ-CYBMUJFWSA-N 265.353 2.129 10 10 CECE C[C@H](Nc1c(N)cccc1C(=O)O)[C@@H]1C[C@H]2CC[C@H]1O2 386955526 JMKJNBKJNJXEAB-IZWKTGJZSA-N 276.336 2.335 10 10 CECE Cc1cc(N2CCC[C@@H](C(C)(C)O)C2)ccc1CO 719677110 SLWFOPJVAUCONQ-CQSZACIVSA-N 263.381 2.475 10 10 CECE COCC(COC)NCc1ccc(N2CCCC2)cc1 388420122 HDGDEDBLOYXBTE-UHFFFAOYSA-N 278.396 2.038 10 10 CECE CC[C@H](CN[C@H](C)c1ccc(O)cc1O)N(C)C 388701998 NXGKZUXKGIXQSJ-GHMZBOCLSA-N 252.358 2.089 10 10 CECE COc1ccc([C@H](C)NCc2nnc(C)s2)c(O)c1 391833705 IHBRSKIONSMMLB-QMMMGPOBSA-N 279.365 2.412 10 10 CECE CO[C@@H]1CCC[C@@H]1Oc1ccc(N2CCNCC2)cc1 394240325 MYEOFOIPOVBPCL-CVEARBPZSA-N 276.380 2.043 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@H]2C[C@H]3CC[C@H]2CNC3)cc1 2173242058 SXHQSXWWJORMJE-JWZBEHFJSA-N 274.408 2.422 10 10 CECE C[C@H](N[C@@H](CN(C)C)C(F)(F)F)c1c(O)cccc1O 2177720295 UGCCOJIPGGYXAY-KWQFWETISA-N 292.301 2.241 10 10 CECE COC[C@H]1CN(c2ccc(CN)c(Cl)c2)CC(C)(C)O1 2177735983 NKPOXOROPBBERV-CYBMUJFWSA-N 298.814 2.429 10 10 CECE O=C(COCC1CCCC1)Nc1ccc(O)c(O)c1 2062898410 PXZIPXAZAKFQJZ-UHFFFAOYSA-N 265.309 2.243 10 10 CECE COc1ccc(O)c([C@@H](C)n2ncnc2Br)c1 2070027471 OCZBHNBLXBITBR-SSDOTTSWSA-N 298.140 2.364 10 10 CECE COc1cccc(Cn2nc(C3CCC3)cc2N)c1O 2070159114 WZLPMKHLQMMJSM-UHFFFAOYSA-N 273.336 2.495 10 10 CECE CCc1cc(CNC)n([C@@H](C)c2c(O)cccc2OC)n1 2070171471 CSYICVHGOKXJKT-NSHDSACASA-N 289.379 2.488 10 10 CECE CN[C@H](C)c1ccc(N2Cc3cnn(C)c3C2)c(F)c1 2168502990 PSILADQEUNAVGN-SNVBAGLBSA-N 274.343 2.360 10 10 CECE CCCOc1cc(N(C)Cc2cncnc2)ccc1N 2178818303 NZNKFTXVJKHAHM-UHFFFAOYSA-N 272.352 2.484 10 10 CECE CNCc1ccc(N2CCNC(=O)[C@@H]2C(C)C)cc1Cl 2170045767 RIOQZPDHJOGKLK-AWEZNQCLSA-N 295.814 2.020 10 10 CECE CCc1nn([C@H](CC)c2ccc(C)cc2O)c(N)c1CN 2079130710 HOTOZNYGOXVJBM-CQSZACIVSA-N 288.395 2.500 10 10 CECE CC[C@@H]1CN(c2ccc(CCN)c(C)c2)C[C@@H]1N(C)C 2170465856 WBEWIUGDXVMODA-PBHICJAKSA-N 275.440 2.273 10 10 CECE C[C@H](NC(=O)[C@H]1CCCCCCN1)c1ccccc1O 2192623748 SNWATCIINNHOFC-GXTWGEPZSA-N 276.380 2.492 10 10 CECE Cc1cc(CN)ccc1N1CC(N2CCC[C@H](C)C2)C1 2188381532 CFJPTIIWAJKAMJ-ZDUSSCGKSA-N 273.424 2.374 10 10 CECE O=[N+]([O-])c1cc(N2C[C@H]3CC[C@@](F)(C3)C2)ccc1CO 2188571917 KZSCBLZFXYPGME-IINYFYTJSA-N 280.299 2.416 10 10 CECE CO[C@H]1CCN(c2ccc(CO)c([N+](=O)[O-])c2)[C@@H](C)C1 2188571513 GPJQODBIJLFHQS-GWCFXTLKSA-N 280.324 2.091 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3COCC[C@@H]32)cc1O 2193270534 SYFQJVDBZGFMLB-JMSVASOKSA-N 276.380 2.288 10 10 CECE Nc1ccc(O)c(CN2CC[C@H](c3ccncc3)C2)c1 2193611489 YYRZFQAOMRLMQA-ZDUSSCGKSA-N 269.348 2.359 10 10 CECE c1cc2c(cc1CN[C@H]1CCN[C@H](C3CC3)C1)CCO2 2194111976 NVFKPDIMPOCMPE-HOTGVXAUSA-N 272.392 2.242 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H](C)[C@@H](O)C[C@@H]3C)ccc21 2184711931 XZKLJHCROYRVGK-NQERCMRGSA-N 274.408 2.489 10 10 CECE CN1CCC[C@H](CN(C)c2ccc3c(c2)CC[C@@H]3N)C1 2184740329 RUNZKYWEBOTCJK-GUYCJALGSA-N 273.424 2.411 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@H]4COC[C@H]4C3)ccc21 2184728093 ZXHPQXMSVHMLKD-JKIFEVAISA-N 272.392 2.366 10 10 CECE N[C@@H]1CCc2cc(N3CCS[C@@H]4COCC[C@@H]43)ccc21 2184729045 FCEGPJPOVPGHIZ-OWCLPIDISA-N 290.432 2.343 10 10 CECE COc1cccc(O)c1CNc1cncc(Cl)n1 2042571414 REAOJEYQGHXPOP-UHFFFAOYSA-N 265.700 2.456 10 10 CECE C[C@H](O)c1cc(F)c(N(C)C[C@]23COC[C@@H]2C3)c(F)c1 2194511273 JXSCHQNGQJYHDG-CCUNJIBTSA-N 283.318 2.491 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2190902442 SENBNTPDCRXUAP-LJWYFPFNSA-N 270.376 2.314 10 10 CECE Cc1nc(Cl)ncc1C(=O)N(C)CCCN=[N+]=[N-] 2050323091 HMSSMZNEFLGHDY-UHFFFAOYSA-N 268.708 2.211 10 10 CECE COCc1cnccc1[C@@H](N)c1ccc(N(C)C)cc1 2185891588 VCLBCZZYVKFRIF-INIZCTEOSA-N 271.364 2.342 10 10 CECE CC1(C)C[C@@H](OC(=O)Nc2ccc(N)cc2)CO1 2052242314 PPDLYUJMECNOSD-LLVKDONJSA-N 250.298 2.385 10 10 CECE COC[C@H](CF)N[C@H](C)c1ccc(OC)cc1O 2053064362 CYGCOKSMJAZLEP-ZJUUUORDSA-N 257.305 2.036 10 10 CECE CO[C@@H]1CC[C@@H](CNCc2c(O)cccc2F)C1 2054473871 GEENMFIYNPOWNV-GHMZBOCLSA-N 253.317 2.436 10 10 CECE COCCOCCCN(C)Cc1ccc(F)c(F)c1O 2186325947 VMEBBIGNKPNECN-UHFFFAOYSA-N 289.322 2.155 10 10 CECE CCCOc1cc(N2C[C@@H]3CC[C@@H](N)[C@H]3C2)ccc1N 2191592963 MOKWGGAIKCNAPE-FPMFFAJLSA-N 275.396 2.231 10 10 CECE C[C@H]1C[C@H](O)CCN1c1cc(Cl)c(CN)cc1F 2057249593 PHIWJDHJTMWMKJ-WCBMZHEXSA-N 272.751 2.287 10 10 CECE CN1CC[C@@H](N(C)c2cc(Cl)c(CN)cc2F)C1 2057248096 COXLMGVFWGEVKA-SNVBAGLBSA-N 271.767 2.078 10 10 CECE CCCN(CC(C)(C)CN)C(=O)Cc1ccc(N)cc1 2191677326 BCRRCSVCQRRALR-UHFFFAOYSA-N 277.412 2.035 10 10 CECE Cc1cc(N)cc(C)c1S(=O)(=O)Nc1ccc(O)cc1 2191774454 QCJHHKWMHYJYDK-UHFFFAOYSA-N 292.360 2.392 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@](C)(O)c2cnsc2)cc1 2106860265 QZURLTUMMFZQMG-KGLIPLIRSA-N 277.393 2.117 10 10 CECE CN(Cc1ccccc1O)c1ccccc1C(=N)NO 2192596704 WAOSFBYGWGKFPA-UHFFFAOYSA-N 271.320 2.333 10 10 CECE CO[C@]1(CNCc2ccc(N)cc2)CCCSC1 2073895310 DJAXSFNYTPVJAE-AWEZNQCLSA-N 266.410 2.271 10 10 CECE C[C@@H](c1ccccc1O)N1C(=O)c2ccncc2C1=O 2192626727 JGRLRTHQCQFACZ-VIFPVBQESA-N 268.272 2.144 10 10 CECE Oc1cc(Cl)ccc1CN1CC([C@@H]2CCNC2)C1 2075884277 ORVOEUDIGYJLNO-SNVBAGLBSA-N 266.772 2.087 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1nc(Cl)cs1 2076463532 GSLKKUSVWMNETR-ZETCQYMHSA-N 289.748 2.301 10 10 CECE [N-]=[N+]=NCCCN[C@](C(=O)O)(C(F)F)C1CCC1 2077227789 QPONELXXHKKNTQ-JTQLQIEISA-N 262.260 2.165 10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2C[C@](C)(F)C2)cc1 2077735315 JWZOGAMLRFTTON-UBHSHLNASA-N 251.349 2.395 10 10 CECE CC[C@H](C)[C@@H](CO)N[C@@H](C)c1ccc(O)cc1O 2081309077 HAPLGVAFRHJMQH-OUJBWJOFSA-N 253.342 2.155 10 10 CECE CCN[C@@H](C)c1cnc(Sc2nc(O)cc(O)n2)s1 2103565151 AWILNXVBAHZIKV-LURJTMIESA-N 298.393 2.166 10 10 CECE Cc1ccc(CN(C)[C@H](CN)C(F)(F)F)c(O)c1 2084075502 OJJHEADEGDZRLD-LLVKDONJSA-N 262.275 2.022 10 10 CECE CCN1CCN(Cc2c(O)cccc2F)CC1(C)C 2104482401 RWGAGAGUQBIYEF-UHFFFAOYSA-N 266.360 2.447 10 10 CECE C[C@H](N)C1CCN(c2ccc3c(c2)OCCO3)CC1 2106334943 CXYGYHKGBXAKSI-NSHDSACASA-N 262.353 2.021 10 10 CECE COc1ccc(N(CCN)CC(F)(F)F)c(OC)c1 2106384622 YHDIVCIJGWSHMN-UHFFFAOYSA-N 278.274 2.031 10 10 CECE CC(C)C[C@H](CN)[C@@H](O)c1ccc2c(c1)CCN2C 2106797867 FLZPIIOTWFXLQZ-ZBFHGGJFSA-N 262.397 2.333 10 10 CECE CCN1CCc2cc([C@@H](O)C[C@H]3CCNC3)ccc21 2106793985 SCFSAMOCSRPJTB-WBMJQRKESA-N 260.381 2.102 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1C[C@H](F)CN1 2106821083 QSYSFXJVVGHHLX-AEGPPILISA-N 264.344 2.020 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3NCC[C@H]3C)ccc21 2106804528 CGCDNXDJPWNCJQ-RLCCDNCMSA-N 260.381 2.100 10 10 CECE Cc1nonc1CN1CCc2cc(N(C)C)ccc21 2087118793 PEAXNAGTENELEE-UHFFFAOYSA-N 258.325 2.007 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)C3(CCC3)C2)c(F)c1 2108768755 MDXMBMZYWPZODF-YGRLFVJLSA-N 265.328 2.230 10 10 CECE Oc1cccc2c1[C@H](N1CC[C@@H]3COCC[C@@H]31)CC2 2088706447 KVQFVXZYOSXAOY-HZSPNIEDSA-N 259.349 2.490 10 10 CECE O=C1Nc2cc(N3CC=CCCC3)c(Cl)cc2[C@@H]1O 2109561329 IMHVEFZBFWDKNG-ZDUSSCGKSA-N 278.739 2.482 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2CC(C)(C)CO2)cc1 2109983243 FYVIRCACHGLHIA-KBPBESRZSA-N 263.385 2.072 10 10 CECE C[C@H](NC[C@@H](CO)C(C)(C)C)c1ccc(O)cc1O 2090192235 PDXDIKZVRJCLDZ-QWRGUYRKSA-N 267.369 2.403 10 10 CECE COc1ccc(O)c([C@H](C)NCCCC[S@](C)=O)c1 2110339892 OSCUAEOVPWLQNX-WLRWDXFRSA-N 285.409 2.210 10 10 CECE CCNCc1ccc(N2CCOC3(CC3)C2)c(F)c1 2112009416 BPZGXUUCJMWYDS-UHFFFAOYSA-N 264.344 2.304 10 10 CECE Oc1ccc(CNC[C@@H]2C[C@H]3CCC[C@H]3O2)c(O)c1 2092565146 JTLRDSFGLFIRDI-RIEGTJTDSA-N 263.337 2.145 10 10 CECE CC(C)(O)[C@@H]1CCCCN1CCc1ccc(N)cc1 2093106327 XNSAZKDOIVKPRJ-HNNXBMFYSA-N 262.397 2.437 10 10 CECE CNCc1cc(F)c(N2CC[C@]3(CCO3)C2)c(F)c1 2097009339 FNWCUXJNYUBQPU-AWEZNQCLSA-N 268.307 2.053 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)C3)cc1 2098695445 SOUKFZJHRMAMGG-FWYOQMDTSA-N 260.381 2.459 10 10 CECE CN[C@H]1CCCc2cc(N3C[C@H]4C[C@@]4(CO)C3)ccc21 2200841198 DWBLTKRCCBEFFN-COXVUDFISA-N 272.392 2.102 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@@H]2CCCNC2=O)cc1Cl 2114630385 SZJLUUFLFYOWRN-NOZJJQNGSA-N 282.771 2.108 10 10 CECE CC(=O)C(=O)[C@@](C)(O)c1cc(Cl)cc(Cl)c1 2211981700 AWVNIYISSIOFSL-NSHDSACASA-N 261.104 2.359 10 10 CECE COc1cccc(O)c1CN1C[C@H](C)CC[C@H]1C(=O)O 2201058303 ARCBVRJQMGBHSC-PWSUYJOCSA-N 279.336 2.086 10 10 CECE COc1cc(N2CCC[C@](O)(C(C)C)C2)ccc1CN 2204549479 OCQOCSYNFGDJNH-MRXNPFEDSA-N 278.396 2.141 10 10 CECE CCNCc1ccc(N2CC[C@@](O)(CC)C2)cc1OC 2204534929 CKPCDQRMKSSRSH-INIZCTEOSA-N 278.396 2.156 10 10 CECE Cc1ccc(O)c(CN2C[C@H]3CC[C@@]3(CC(=O)O)C2)c1 2207535128 NCVDVYWWJGGTOJ-CZUORRHYSA-N 275.348 2.387 10 10 CECE CCO[C@@]1(CN[C@@H](C)c2cc(F)ccc2O)CCOC1 2208644244 OBBQIXDXVYDLLG-XHDPSFHLSA-N 283.343 2.378 10 10 CECE 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CC1(C)CNCCN1c1ccc(OC(F)F)cc1 2263915698 ICIMMMDGPIKNNI-UHFFFAOYSA-N 256.296 2.476 10 10 CECE COc1ccc(N2CC(F)(F)C[C@@H]2CN)cc1C 2264312242 AITRJEUQNCKDAJ-LLVKDONJSA-N 256.296 2.176 10 10 CECE CC(C)c1nnsc1COc1cccnc1N 2299428932 JHVXFEJJBDEORC-UHFFFAOYSA-N 250.327 2.218 10 10 CECE COc1cc(C)c(N2CC(F)(F)C[C@H]2CN)cc1C 2278981843 BCCANXSIVXQNGV-NSHDSACASA-N 270.323 2.485 10 10 CECE NC[C@H]1CC(F)(F)CN1c1ccc(OC(F)F)cc1 2278994991 HZRMXIUKTUMQEL-SECBINFHSA-N 278.249 2.461 10 10 CECE Cc1ccc(CN2C[C@H](S(C)(=O)=O)CC[C@@H]2C)c(O)c1 2279357412 YPHPLHZZURKOTN-GXTWGEPZSA-N 297.420 2.098 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)cc1C 2269665846 ILGCUTVEBOAMOH-OJDYBEQGSA-N 260.381 2.092 10 10 CECE CCN[C@H](C)c1ccc(N(C)CC[S@](C)=O)cc1C 2269664786 AYHIMRIMBSBZKG-YJYMSZOUSA-N 282.453 2.480 10 10 CECE COC[C@]1(C)[C@@H]2C[C@H]2CN1c1ccc([C@H](C)O)c(O)c1 2284509378 VVAPIEOHPWXWGL-FNNPODNZSA-N 277.364 2.307 10 10 CECE CCN(c1ccc([C@@H](C)N)c(C)c1)[C@@H]1CCS(=O)(=O)C1 2285148963 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Oc1cc2c(cc1O)CN(Cc1ccsn1)CC2 2318666318 XZCQOEDYFZKKMN-UHFFFAOYSA-N 262.334 2.113 10 10 CECE CSc1ncc(CN[C@]2(C(=O)O)C[C@@H](C)[C@@H]2C)s1 2323762284 URBNIKPHQVOLRR-RGNHYFCHSA-N 286.422 2.454 10 10 CECE O=C(O)[C@]1(Sc2nccs2)C[C@@H]2[C@H]3CC[C@H](O3)[C@@H]21 2326897870 UVNMOJVSIPIHDE-HHKWLRISSA-N 283.374 2.256 10 10 CECE CSc1cc(N2C[C@@H](O)CC2(C)C)ccc1CN 2328537442 YGQTYBALAHYETB-LBPRGKRZSA-N 266.410 2.217 10 10 CECE OC[C@]12CC[C@H](C[C@H]1NCc1cc(F)ccc1O)C2 2329387413 QVASVPTZJFYMGI-VCTAVGKDSA-N 265.328 2.172 10 10 CECE Nc1ccc(CN2CC[C@@H](O)C[C@H]2C(F)(F)F)cc1 2336329268 DSUFLWMXGNATTF-NEPJUHHUSA-N 274.286 2.156 10 10 CECE COc1cccc(CNC[C@@]2(C)CC=CCO2)c1O 2340198740 RGQHVOHGEGVYES-OAHLLOKOSA-N 263.337 2.226 10 10 CECE CNC[C@@H]1CN(Cc2cc(C)ccc2O)CC12CC2 2340452676 KULQQPUKDQKBQC-CQSZACIVSA-N 260.381 2.132 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@](C)(C(=O)O)C(F)F 2350852965 GWBMNQQHZAJZMT-AMIZOPFISA-N 273.279 2.493 10 10 CECE CCNCc1ccc(N(C)[C@@H](C)CN(C)C)c(F)c1 2351752829 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CCN[C@@](CSc1nccs1)(C(=O)OC)C1CC1 69188736 ZSTCCFJRHWLVCK-GFCCVEGCSA-N 286.422 2.167 10 10 CECE CCN(Cc1cc(C(C)=O)ccc1O)[C@H](C)COC 42775281 KDLZIPFCOUBFNH-LLVKDONJSA-N 265.353 2.452 10 10 CECE C[C@H](N[C@H]1C[C@H]2[C@@H]3CC[C@@H](O3)[C@@H]12)c1c(O)cccc1O 2356934137 LFCCSLFAMCWDJT-IOKVBFOVSA-N 275.348 2.314 10 10 CECE OCc1ccc(N2C[C@H]3C[C@H]3[C@H]2CO)cc1C(F)(F)F 2357563832 ZBROLBJMGKPDEI-IRUJWGPZSA-N 287.281 2.015 10 10 CECE CCC(CC)N(CCO)c1ccc(OC)cc1N 213406269 QTATVIZENMQFDH-UHFFFAOYSA-N 252.358 2.265 10 10 CECE CCCN1C(=O)CC[C@H](N)[C@H]1c1ccc2c(c1)CCN2C 70986293 XWUMMYXDKZJKNL-WMLDXEAASA-N 287.407 2.080 10 10 CECE CCN1C(=O)CCC[C@H](N)[C@@H]1c1ccc(N(C)C)cc1 70295016 NMCQWUKIKDAIKO-HOCLYGCPSA-N 275.396 2.153 10 10 CECE COc1ccc(O)c(CN[C@@H]2CCC[C@H]2n2ccnc2)c1 37106283 IIKQDEMHBIDJJD-HUUCEWRRSA-N 287.363 2.481 10 10 CECE Nc1ccc(CCc2nc3nccnc3s2)cc1 236391673 WRGZBJHBXZGOEG-UHFFFAOYSA-N 256.334 2.454 10 10 CECE Oc1cccc(CNc2ccc(-n3ccnc3)nc2)c1O 41117188 NKQROHUCKXXDRI-UHFFFAOYSA-N 282.303 2.291 10 10 CECE Nc1ccc(NC(=O)CCCN2C[C@H]3CC[C@@H]2C3)cc1 49715807 CORKJKMNHXWMLL-SWLSCSKDSA-N 273.380 2.472 10 10 CECE COc1ccc([C@@H](C)NCC(C)(C)CO)c(O)c1 135081784 DUTYBGFZIODXQC-SNVBAGLBSA-N 253.342 2.070 10 10 CECE Oc1ccc(CNc2ccc(Cl)nc2)c(O)c1O 226763318 MQFTULGNGSNYTM-UHFFFAOYSA-N 266.684 2.464 10 10 CECE Cc1cc(N2C[C@@H](C)[C@@H](N(C)C)C2)ccc1/C=C/C(=O)O 226090487 GLJMMCMFPLRUAK-PSYXSKQDSA-N 288.391 2.479 10 10 CECE N[C@H](CF)c1cc(Br)cc(F)c1O 238683712 WNRLBBCNAVDFEI-SSDOTTSWSA-N 252.058 2.263 10 10 CECE C[C@@H](O)CN(C)c1ccc([C@@H](C)N)c(Br)c1 235216636 ZAJHJETUTROAOA-RKDXNWHRSA-N 287.201 2.286 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CS[C@@H](C)C1 94474270 HNMWDAJMLKSPFN-GXSJLCMTSA-N 272.374 2.104 10 10 CECE Oc1cc(Cl)c(Br)cc1[C@H]1COCCN1 238688266 OIQXKMUPGMJBEX-SECBINFHSA-N 292.560 2.469 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1ccc(C)c(C)c1 90257040 KGYDJGJRHYSGHT-LBPRGKRZSA-N 262.313 2.417 10 10 CECE C[C@H](O)C1CCN(c2ccc(CN)c(Cl)c2)CC1 235568741 VJDLZBULCWCANG-JTQLQIEISA-N 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1942546363 JIKMKDDAOSHFMR-VIFPVBQESA-N 252.358 2.399 10 10 CECE C[C@H](NC[C@@H](C)N1CCCC1)c1c(O)cccc1O 235450877 URZRQKFKEGHZFR-NEPJUHHUSA-N 264.369 2.233 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1[C@@H]3[C@H]4C[C@H]5[C@@H]1[C@H]5[C@@H]43)CC2 2143321894 TYUFEDZSLQRMSM-OOSWJAOQSA-N 253.345 2.479 10 10 CECE C[C@]1(CN2CCc3cc(CN)ccc32)CCCOC1 1877695659 AJANBLULNLUNTL-MRXNPFEDSA-N 260.381 2.325 10 10 CECE Cc1cccc(CN(C)[C@H]2CCN3CC[C@H]2C3)c1O 1877839790 NEVPKOAXHHKWEH-ZFWWWQNUSA-N 260.381 2.227 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@H]3COCC[C@@H]32)c(Cl)c1 2143763098 AEAKAEBAHKQAHK-NZVBXONLSA-N 297.782 2.387 10 10 CECE C[C@H](NC[C@@]12CC[C@@H](CO1)C2)c1cc(O)ccc1O 1878828571 FIRDKWCHJDCUTA-RWSFTLGLSA-N 263.337 2.318 10 10 CECE Oc1cccc(F)c1CNCc1ccnn1C1CC1 1879739494 GLFKDNWSNDFKEE-UHFFFAOYSA-N 261.300 2.353 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@](C)(CO)C2)c(F)c1 1880483132 VKMLITXXDGQAIB-OTYXRUKQSA-N 271.307 2.227 10 10 CECE C[C@H](N)c1cc(F)c(N(C)CC2(O)CCC2)c(F)c1 1880931968 PRDLRRLOMNBGJL-VIFPVBQESA-N 270.323 2.336 10 10 CECE COc1ncsc1[C@H](O)Cc1ccc(N)cc1 1948422837 KPEZKHNLPSPRBO-SNVBAGLBSA-N 250.323 2.010 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1C[C@H]2O[C@H]1[C@H]1C[C@H]12 2144068678 MBKIUMIYAYRPQK-WGGGYHPKSA-N 281.302 2.183 10 10 CECE C[C@@H]1OCC[C@H]1CC(=O)N1CCC(CN=[N+]=[N-])CC1 1885779406 PNQBVXVAZGLEQK-JQWIXIFHSA-N 266.345 2.350 10 10 CECE C[C@H](Cc1nccn1C)N[C@@H]1CCc2cccc(O)c21 1964489065 NWUPHKBLJKBDJJ-DGCLKSJQSA-N 271.364 2.334 10 10 CECE Nc1ccc(OCCNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cc1 249999645 PSWZYTGBISBBBN-SLEUVZQESA-N 274.364 2.200 10 10 CECE CC[C@H](C)[C@H](NCc1ccc(F)cc1O)C(=O)OC 1964545718 MDSVVJDYKMUOLH-ZANVPECISA-N 269.316 2.209 10 10 CECE c1cc(N2CCN3CCC[C@H]3C2)ccc1CNC1CC1 250018818 ZOJITOLVXHHTCN-KRWDZBQOSA-N 271.408 2.223 10 10 CECE C[C@H](N[C@H]1C[C@H]2CCCCN2C1)c1cc(O)ccc1O 2144852995 YRRBJYOFMVTSFN-RWMBFGLXSA-N 276.380 2.375 10 10 CECE C[C@H](NCc1ccc2c(c1)CCO2)C12CC(CO1)C2 1966042517 UVMVVOXXMLWVGC-XOMBGVMMSA-N 259.349 2.279 10 10 CECE COc1ccc(CNC2CC(c3ncc[nH]3)C2)c(O)c1 1967764456 UGLIIMBGLUINKW-UHFFFAOYSA-N 273.336 2.160 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1C[C@H]2C[C@H]1C[C@H]2O 1967763987 KDTBQAIIWKBHNH-XKAARJIMSA-N 267.756 2.295 10 10 CECE O[C@@]1(CNCc2ccc3c(c2)CCO3)C[C@H]2CC[C@H]1C2 2145238348 DELQZGCCNGUPPR-YLQAJVPDSA-N 273.376 2.262 10 10 CECE CO[C@@H]1CCN([C@@H](C)c2ccc(F)cc2O)[C@H](CN)C1 252762879 DXWFGDBRAJHQIU-WCFLWFBJSA-N 282.359 2.030 10 10 CECE OC[C@@H](NCc1cc(F)ccc1O)[C@H]1CC=CCC1 1971211942 OJCRMHCXFJQYOT-SMDDNHRTSA-N 265.328 2.338 10 10 CECE CCOC1CC(NCc2c(O)cccc2OC)C1 1972066937 JVHSHNBDGNPPPS-UHFFFAOYSA-N 251.326 2.058 10 10 CECE CC1CC(CO)(NCc2cc(Cl)ccc2O)C1 1972488451 CESSQSXKFBITMY-UHFFFAOYSA-N 255.745 2.296 10 10 CECE Cc1noc(CN2CCCc3cc([C@@H](C)N)ccc32)n1 2145831903 UTNFUZYTAZSDMS-SNVBAGLBSA-N 272.352 2.351 10 10 CECE Oc1ccc(CNCc2cc(C(F)F)no2)c(O)c1O 2150708172 KABDVRUVCLVQER-UHFFFAOYSA-N 286.234 2.019 10 10 CECE CN(C(=O)CN1CCC[C@H]2CC[C@H]21)c1ccc(N)cc1 2151775365 HCTIBRLJFNJEOB-SWLSCSKDSA-N 273.380 2.106 10 10 CECE COCCOCCN1CCCc2cc([C@H](C)N)ccc21 162218004 GZBAZPJEXQOILI-ZDUSSCGKSA-N 278.396 2.122 10 10 CECE C[C@H](O)c1ccc(N2CCOC[C@H]2CN(C)C)c(Cl)c1 2153257226 HCUQSVDXMLRLDG-WCQYABFASA-N 298.814 2.160 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCNCC23CCC3)c1 2153344814 ACZPYZFSRGGPLF-GFCCVEGCSA-N 276.380 2.290 10 10 CECE CCN(CC[C@H]1CC(C)(C)NC1=O)c1ccc(N)cc1 2153370875 FJDIIYFHRJGYFV-LBPRGKRZSA-N 275.396 2.400 10 10 CECE Nc1ccc(CCC(=O)N2CC([C@H]3CC3(F)F)C2)cc1 2153704675 ZJUUSFCIDXMXEY-CYBMUJFWSA-N 280.318 2.315 10 10 CECE COC[C@@]1(C)CCN1c1ccc(CO)c(Cl)c1 2007189902 RQJINGHSXNJTSH-CYBMUJFWSA-N 255.745 2.448 10 10 CECE C[C@@H](N)c1ccc(N2CC=C[C@H]2CO)c(Br)c1 2007501328 RFWATMRONLUPOG-KOLCDFICSA-N 297.196 2.206 10 10 CECE OCc1cc(F)c(N2CC3(CC[C@@H]2CO)CC3)c(F)c1 2154156914 SVVDPOOZZWWOIO-LLVKDONJSA-N 283.318 2.198 10 10 CECE Oc1cc(Cl)ccc1CNC[C@H]1OCC[C@@H]1F 2009178779 SXRJXGUGYMWFOV-CMPLNLGQSA-N 259.708 2.262 10 10 CECE C[C@@H](N)c1ccc(N2CCCC[C@H](N(C)C)C2)cc1O 2154976390 DKAXMMSQNKLZPU-OCCSQVGLSA-N 277.412 2.332 10 10 CECE CNCc1ccc(OC[C@@H](OC)[C@@H]2CCOC2)c(C)c1 2155018465 GHOCHKBYHYOTIZ-GDBMZVCRSA-N 279.380 2.145 10 10 CECE CN1CCc2cc(CNCCCn3ccnc3)ccc21 50286408 BHUVHYYANAKJAH-UHFFFAOYSA-N 270.380 2.055 10 10 CECE CC[C@](CSc1nccs1)(NC(C)C)C(=O)O 2026504697 DSGQUDPOMPXNPG-LLVKDONJSA-N 274.411 2.467 10 10 CECE OCc1ccc(N2C[C@@H](CO)C3(CC3)C2)cc1Cl 2027540002 YHGMBSDWXXNCMK-NSHDSACASA-N 267.756 2.041 10 10 CECE CCO[C@H]1C[C@@H](N[C@@H](C)c2ccc(O)cc2O)C1 2029081271 QLJZNKJIOCOZOW-JBLDHEPKSA-N 251.326 2.316 10 10 CECE CN(CCN(C)C1CC1)c1ccc(CN)c(Cl)c1 2029089518 XDHGGTKDRFYXJK-UHFFFAOYSA-N 267.804 2.329 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3C[C@]3(CO)C2)cc1Cl 2029646437 OGOXBHCFJUNIEF-IMSIIYSGSA-N 266.772 2.178 10 10 CECE CCc1nc([C@H](O)[C@@H](N)c2ccccc2O)cs1 2031159479 LYNPDKFWQIETRS-STQMWFEESA-N 264.350 2.145 10 10 CECE CCCNCc1ccc(N2CC[C@H](C)[C@H](O)C2)cc1 299986105 AQZUAZXADKQRSD-XJKSGUPXSA-N 262.397 2.393 10 10 CECE COc1cc2c(cc1OC)N1C[C@@H](F)C[C@H]1CN2 2034474948 GMEBNTFMWUVFJY-IUCAKERBSA-N 252.289 2.046 10 10 CECE OCc1ccc(N2CC([C@@H]3CC3(F)F)C2)c(F)c1 2036009708 HAUBNZGKQVTMSC-JTQLQIEISA-N 257.255 2.409 10 10 CECE C[C@@H]1C[C@@H](CC(=O)N2CCC[C@H]2CN=[N+]=[N-])CO1 2041478648 KYEYRMCGYAYIQA-VWYCJHECSA-N 252.318 2.103 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@H]2CCCC(F)(F)C2)c1 312132661 GJBAYKHCTXJEGT-VIFPVBQESA-N 284.306 2.416 10 10 CECE CCNCc1ccc(N(C)CCOCCOC)c(F)c1 312544420 IUWNPGULRPQITJ-UHFFFAOYSA-N 284.375 2.034 10 10 CECE CN1C[C@@]2(C)CN(Cc3c(O)cccc3F)C[C@]2(C)C1 2160777241 YXAAYDLASRYQBX-HOTGVXAUSA-N 278.371 2.305 10 10 CECE Nc1ccc(CC(=O)Nc2cccc(C3OCCO3)c2)cc1 318615001 XOSYVRDUCDPJOC-UHFFFAOYSA-N 298.342 2.495 10 10 CECE CN[C@H](c1ccccc1O)C1(O)CCC(C)(OC)CC1 2161480432 ZSOLKWMNAQHCHZ-QQFBHYJXSA-N 279.380 2.363 10 10 CECE C[C@@]1(C(F)F)C[C@H]1NC(=O)CCOc1ccc(N)cc1 2177421326 JCIGXDGAZDQXNG-BXUZGUMPSA-N 284.306 2.198 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1ccc(CO)cc1 701291260 LGZNDHVPQFULIM-GFCCVEGCSA-N 260.297 2.094 10 10 CECE CNCc1ccc(N2CCO[C@@H]3C[C@@H]32)c(C(F)(F)F)c1 2171805347 MXQJYYPMZRPRQS-QWHCGFSZSA-N 286.297 2.402 10 10 CECE CC[C@@H](N)Cc1ccc(N2CCO[C@@H](CF)C2)cc1C 2172078108 WZPFAEXNGLCJDY-ZBFHGGJFSA-N 280.387 2.450 10 10 CECE C[C@H]1OCC[C@H]1CN(C)C(=O)CCc1ccc(N)cc1 2177629904 AGFGNODCSDUDKF-OCCSQVGLSA-N 276.380 2.085 10 10 CECE C[C@H]1OCC[C@@H]1CN(C)CCCOc1ccc(N)cc1 2177627305 GVIBBWSDEMXHBN-ZIAGYGMSSA-N 278.396 2.395 10 10 CECE CN1CCC[C@H]1CCNCc1ccc(F)c(F)c1O 703213118 GTTBTFZSFVPVRY-NSHDSACASA-N 270.323 2.244 10 10 CECE OC[C@@H]1CCCC[C@@H]1NCc1ccc(F)c(F)c1O 703347988 MPQJOJVEBJMXBL-JQWIXIFHSA-N 271.307 2.311 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)cc1 706997544 YCTPUYVCARTIIL-IJEWVQPXSA-N 259.397 2.094 10 10 CECE Cc1cc([C@@H](O)c2ccc3c(c2)CCCN3C)n(C)n1 686269924 RLNNFYZTROBFJX-INIZCTEOSA-N 271.364 2.193 10 10 CECE CCc1cccc(CN2CCN(C)[C@@H](CC)C2)c1O 709289799 JIQTYFUDHICANN-HNNXBMFYSA-N 262.397 2.481 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H](CN)C(F)(F)F)ccc21 2180000725 PEJGNCIXNQGTIF-WCQYABFASA-N 288.313 2.240 10 10 CECE Oc1c(F)cccc1CN1C[C@@H]2[C@@H](C1)[C@H]1CC[C@H]2O1 378500819 XWTVCIHYDGKHBP-HBJVGIJOSA-N 263.312 2.141 10 10 CECE CCc1c(O)c(=O)ccn1Cc1ccc(N(C)C)cc1 2173140441 PFTLYFZCHCWAEN-UHFFFAOYSA-N 272.348 2.231 10 10 CECE Oc1ccc(CN2CCC3(CCNCC3)CC2)cc1O 380355082 LYBAJDDGDXNWDI-UHFFFAOYSA-N 276.380 2.063 10 10 CECE Nc1ccc(CC(=O)OCC[C@@H]2CC2(F)F)cc1 691557876 PFKHIFMEVJQSJZ-SNVBAGLBSA-N 255.264 2.400 10 10 CECE CS[C@@H]1CCCN(C(=O)COc2ccc(N)cc2)C1 383043063 MYXUGOKWGFKUTF-CYBMUJFWSA-N 280.393 2.002 10 10 CECE CCCN(CC(N)=O)Cc1c(O)ccc2ccccc12 383344371 XNZDMUBVRLOVHW-UHFFFAOYSA-N 272.348 2.243 10 10 CECE C[C@@H]1CN[C@H](C2CC2)CN1c1ccc2c(c1)CCO2 383627206 AQVASXPRCPZGLG-ABAIWWIYSA-N 258.365 2.198 10 10 CECE CN1CCCc2cc(CNCC3[C@H]4COC[C@H]34)ccc21 385812492 LGJQRCGYLDHBDI-HZPDHXFCSA-N 272.392 2.051 10 10 CECE COc1cccc(CN[C@@H](C)c2nnc(C)s2)c1O 391815675 LSQXVSXHIUGCMQ-QMMMGPOBSA-N 279.365 2.412 10 10 CECE C[C@@H](CC(=O)N(C)C)N[C@H](C)c1ccc(F)cc1O 394061080 YAYFWSHFWVLYIZ-VHSXEESVSA-N 268.332 2.049 10 10 CECE COCC(C)(C)c1noc(COc2ccc(N)cc2)n1 395501699 QMKBRUSWNXMQHC-UHFFFAOYSA-N 277.324 2.155 10 10 CECE CC[C@@H](N)c1ccc(N(C)[C@H](C)C[S@](C)=O)cc1 398880344 HFLLBIGCIOFLGM-OMPKRAJASA-N 268.426 2.300 10 10 CECE CN(CCC(C)(C)C)C[C@@H](O)COc1ccc(N)cc1 399775124 HXPWWYLOAFCFGK-CQSZACIVSA-N 280.412 2.377 10 10 CECE CO[C@@H]1CC[C@@H](CN(C)CCOc2ccc(N)cc2)C1 2174863382 UXCKKBSZJUNBQR-CZUORRHYSA-N 278.396 2.395 10 10 CECE Nc1ccc(CCN2CC[C@](CO)(C(F)(F)F)C2)cc1 2167678871 RWOZVQKTBQOMIT-ZDUSSCGKSA-N 288.313 2.058 10 10 CECE Cc1ncncc1CN1CCc2cc([C@@H](C)N)ccc21 2178821659 JMRDDMOAZYPUTP-LLVKDONJSA-N 268.364 2.367 10 10 CECE COc1ccc([C@H](C)NC[C@]2(F)C[C@H](CO)C2)c(O)c1 2168691931 FURWXKOEXRUXFN-PGUXBMHVSA-N 283.343 2.162 10 10 CECE CCOC(=O)c1cnn([C@@H](C)c2ccc(C)cc2O)c1N 2070317159 YJNFZYAAENLEKR-JTQLQIEISA-N 289.335 2.265 10 10 CECE Nc1ccc(NC(=O)N2CC[C@H]3OCCC[C@@H]3C2)cc1 2170280954 VYPOCSKLFROGFX-BXUZGUMPSA-N 275.352 2.302 10 10 CECE CCN(CC)C[C@@H]1CCN(c2ccc(CO)cc2F)C1 2170249086 XOMLCWARTFTXQF-AWEZNQCLSA-N 280.387 2.486 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CCC(=O)N(C)C2)cc1Cl 2188487015 SFAANRJPXAGPMQ-CMPLNLGQSA-N 295.814 2.417 10 10 CECE C[C@H](CNC(=O)c1cc(O)c(O)c(O)c1)CC(F)(F)F 2188868744 WBSOSCSUUPEMCV-LURJTMIESA-N 293.241 2.122 10 10 CECE O=C(NC1(C2CC2)CCCC1)c1cc(O)c(O)c(O)c1 2188922099 FWHCZAQALOMYQZ-UHFFFAOYSA-N 277.320 2.256 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC=C[C@@H]2CO)cc1O 2182333260 SATLYSAHFOUTQK-GXTWGEPZSA-N 276.380 2.190 10 10 CECE Cc1cc(N(C)[C@@H]2COC3CC2C3)ccc1C[C@@H](C)N 2183083987 CICWVIPRDGTJSM-BZVDIIDJSA-N 274.408 2.498 10 10 CECE NCc1ccc2c(c1)CCN2C[C@H]1C[C@@H]2CC[C@H](C1)O2 2189927183 ZQFASPFKIHXCCF-MKZZRHPPSA-N 272.392 2.465 10 10 CECE C[C@H](O)c1ccc(N2CCN(C[C@@H](C)F)CC2)c(F)c1 2190002989 RMVLASKCGRMCTK-NEPJUHHUSA-N 284.350 2.359 10 10 CECE C[C@H](N)c1ccc(N(C)CC23CC(C)(CO2)C3)cc1O 2194275279 VQHDYXASEYUQJF-SOISORPOSA-N 276.380 2.417 10 10 CECE CN(C[C@H]1C[C@](C)(F)C1)c1ccc2c(c1)NC(=O)[C@@H]2O 2198456591 RPQVKHPLZUEVSB-XXLQHYSLSA-N 278.327 2.247 10 10 CECE COC[C@@H](CN(C)c1ccc2c(c1)CCC[C@H]2O)OC 2184687239 PLYMZPWEIJPQQB-GDBMZVCRSA-N 279.380 2.154 10 10 CECE CCN(C)[C@@H]1CCN(c2ccc3c(c2)CC[C@@H]3NC)C1 2184723588 OOONOHCDZYQFSC-WBVHZDCISA-N 273.424 2.424 10 10 CECE N[C@H]1CCc2cc(N3C[C@@H](O)CC4(CCC4)C3)ccc21 2184741770 OSILYACNHVVDHK-HOCLYGCPSA-N 272.392 2.374 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H]4COC[C@@H]4C3)ccc21 2184711984 YNOBDCHTMXOSJB-GRDNDAEWSA-N 272.392 2.366 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@@](O)(C(F)(F)F)C3)ccc21 2184729704 MFTMACNQTNRGCE-OLZOCXBDSA-N 286.297 2.136 10 10 CECE C[C@H](O)c1cc(F)c(N(C)C[C@H]2[C@H]3OCC[C@H]23)c(F)c1 2194511270 JXLCVWKNSCAHOG-DOKDZLDGSA-N 283.318 2.489 10 10 CECE C[C@@](NCCN=[N+]=[N-])(C(=O)O)c1cc(F)c(F)c(F)c1 2194686852 LKTQIGCAMPRULM-NSHDSACASA-N 288.229 2.304 10 10 CECE C[C@@H]1CCNC[C@H]1N(C)Cc1c(O)cccc1Cl 2045222939 UPNSTUXCOZELIG-ZWNOBZJWSA-N 268.788 2.475 10 10 CECE CO[C@@]1(CN(C)c2ccc([C@@H](C)O)cc2F)CCOC1 2186194758 IZSZDKVCQVCTFM-IAQYHMDHSA-N 283.343 2.121 10 10 CECE COc1cccc(O)c1CN[C@H]1C[C@@]12CC2(F)F 2052016361 CPJKNDAGJPDPBM-NWDGAFQWSA-N 255.264 2.288 10 10 CECE CNCc1ccc(N2C[C@@H](C)NC(=O)C2(C)C)cc1Cl 2186210220 KSWCLVYSSXORGM-SNVBAGLBSA-N 295.814 2.163 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCC[C@H](N)C1 2191726968 KPQOICJNOUOONA-QWRGUYRKSA-N 277.368 2.127 10 10 CECE CCCC1(O)CN(c2cc(Cl)c(CN)cc2F)C1 2057252155 FVDCCTFRYNZKME-UHFFFAOYSA-N 272.751 2.289 10 10 CECE OCc1ccc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)cc1Cl 2058371113 WSUSMMAVOHGKPB-CHIMOYNISA-N 267.756 2.182 10 10 CECE CN[C@@H](c1cnnc(C)c1)c1ccc2c(c1)CCN2C 2186839888 SMFFNLSNOURAGG-MRXNPFEDSA-N 268.364 2.086 10 10 CECE O=C(NCc1cscc1F)c1cccc(O)c1O 2061490382 JMDMESSZCZCKGC-UHFFFAOYSA-N 267.281 2.228 10 10 CECE C[C@@H]1C[C@@H](C(=O)N2CCC(N=[N+]=[N-])CC2)CCO1 2062834051 JORKRKPGCPHOKL-ZJUUUORDSA-N 252.318 2.103 10 10 CECE CN1C[C@@H]2C[C@H]1CN2c1ccc(CN)cc1C(F)(F)F 2187595621 TYMSQFQYBZMBJR-QWRGUYRKSA-N 285.313 2.057 10 10 CECE CCN=c1ccc([C@@H](O)c2ccc(N(C)C)cc2)c[nH]1 2187578307 OPCQSLAOQMHXOM-INIZCTEOSA-N 271.364 2.083 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3C[C@@H]2CN(C)C3)cc1Cl 2067427078 OSRRVILTSRNVNB-JLLWLGSASA-N 265.788 2.252 10 10 CECE C[C@@]1(CCO)CCN(c2ccc(CN)c(Cl)c2)C1 2068171227 QXXGBZZDVGZFTM-AWEZNQCLSA-N 268.788 2.398 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H](N)[C@H](C)F)cc1 2069829872 BUYVVBVKNYSACD-GDLCADMTSA-N 254.349 2.252 10 10 CECE CO[C@H]1CCN(c2ccc([C@@H](C)O)cc2)C[C@@]1(C)OC 2201548688 AUXTXKRUWMSIJJ-UHOFOFEASA-N 279.380 2.370 10 10 CECE Oc1cccc(CNC[C@@H]2CC[C@H]3[C@H]2C3(F)F)c1O 2102154646 YSYLHCMWUVFCQT-PEXQALLHSA-N 269.291 2.479 10 10 CECE CC[C@@H]1CNCCCN1[C@@H](C)c1ccc(O)cc1O 2102929327 BLPVWJJFMXDGHV-NWDGAFQWSA-N 264.369 2.233 10 10 CECE C[C@H](N)c1ccc(N(C)CCOC(F)F)cc1O 2082817110 IXGKTTQKGDEORX-QMMMGPOBSA-N 260.284 2.087 10 10 CECE C[C@@H](N)[C@H]1CCCN(Cc2ccc(F)cc2O)C1 2084081166 YFQQVOCAGHXNQJ-MNOVXSKESA-N 252.333 2.091 10 10 CECE 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CO[C@@H]1C[C@H]2C[C@H]1CN2c1ccc2c(c1)CC[C@@H]2O 2340740271 PDFRLNIVBWAAEL-RUAUBTSSSA-N 259.349 2.280 10 10 CECE CCO[C@@H]1CN(c2ccc(OC(C)C)cc2)C[C@H]1CN 2354603520 LRJVRWRXEXILSH-CZUORRHYSA-N 278.396 2.274 10 10 CECE COc1ccc(CNC2CC2)cc1Cn1nc(C)nc1C 50125623 ZFQHPCSYIDEBET-UHFFFAOYSA-N 286.379 2.204 10 10 CECE CC1=NN(c2ccccc2)C(=O)/C1=C\c1ccn(C)n1 101609509 ACTYHOCVPRETJJ-UVTDQMKNSA-N 266.304 2.226 10 10 CECE Nc1ccccc1OC[C@@H](O)CSc1nccs1 51329277 FSEQAROXHPCSGA-SECBINFHSA-N 282.390 2.257 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(Br)c2)CCO1 228146679 FMEVCEHSFUXMFW-SECBINFHSA-N 285.185 2.133 10 10 CECE Oc1c(Cl)cc(Cl)cc1CNCC1OCCO1 1892567043 JIEGEGCDPSRGCB-UHFFFAOYSA-N 278.135 2.162 10 10 CECE CCCN(CCC)c1ccc(CN2CCNC(=O)C2)cc1 179594830 GLFHNKNNNXXTOS-UHFFFAOYSA-N 289.423 2.245 10 10 CECE CCN(CCO)c1ccc([C@@H](C)NC)cc1Cl 61695955 NVLNBAGZLXVTFS-SNVBAGLBSA-N 256.777 2.439 10 10 CECE CC(C)(C)OC(=O)N[C@]1(C)CCN(CCN=[N+]=[N-])C1 1893401222 GKLFQFREPKEEFD-GFCCVEGCSA-N 269.349 2.286 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)C2)cc1Br 300519426 USQXYUSHOQEIPH-MWLCHTKSSA-N 299.212 2.301 10 10 CECE Nc1ccc(CN2[C@H]3CC[C@@H]2C[C@@]2(C(=O)O)C[C@@H]32)cc1 2357514985 ARNBGYLGLGNOTB-ORIJERBGSA-N 272.348 2.096 10 10 CECE Oc1cccc(Br)c1[C@H]1NCCCC[C@H]1O 1952130902 BSTHZNMXITVWOS-PWSUYJOCSA-N 286.169 2.330 10 10 CECE CNC[C@H]1CCN([C@H](C)c2ccc(F)cc2O)C1 71142584 VQOXNSHBVFQIAO-GHMZBOCLSA-N 252.333 2.134 10 10 CECE Cc1occc1CN(C)C[C@H](O)COc1ccc(N)cc1 48912057 PCVUCMFVUVAQII-HNNXBMFYSA-N 290.363 2.042 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H]3C2)cc1Br 379515782 WCIBGEJULWLMIJ-AOOOYVTPSA-N 267.170 2.364 10 10 CECE COc1ccc(N(CCCN)CCCN2CCCC2)cc1 49332069 HIVFYAHLMQWGIE-UHFFFAOYSA-N 291.439 2.336 10 10 CECE CN(C)C(=O)c1ccc(NCc2cccc(O)c2O)cc1 41116971 MJOWGRCWLWYAOQ-UHFFFAOYSA-N 286.331 2.412 10 10 CECE O=C(CNCc1ccccc1O)NC1CCCCCC1 228415129 WMEDKXTZMNHGJI-UHFFFAOYSA-N 276.380 2.321 10 10 CECE C[C@H]1CCC[C@@H](C)C12NC(=O)N(CCN=[N+]=[N-])C2=O 48804705 NWQWBGWEAPIYHS-USUYBEQLSA-N 265.317 2.043 10 10 CECE CC[C@@]1(C(=O)O)CCCN(Cc2ccc(OC)cc2O)C1 86783988 VXLKJHXZCAJNBM-MRXNPFEDSA-N 293.363 2.478 10 10 CECE C[C@@H]1C[C@H](N)CN(Cc2cc(Cl)ccc2O)C1 94548526 PKTVGFAXJJMZTE-SKDRFNHKSA-N 254.761 2.215 10 10 CECE CC(=O)N(C(=O)Nc1nccs1)c1ccc(N)cc1 243136270 JLDLUKCPPVMVFF-UHFFFAOYSA-N 276.321 2.310 10 10 CECE CCCN(Cc1ccccc1O)C[C@@H](C)CS(C)(=O)=O 163378747 MILMJWOJTGHMSR-CYBMUJFWSA-N 299.436 2.285 10 10 CECE Cc1cn2c(n1)CN(Cc1ccc(N(C)C)c(F)c1)CC2 359892439 BLPSFGSNCLHFEK-UHFFFAOYSA-N 288.370 2.412 10 10 CECE COC(=O)[C@H](C)c1cc(O)c(O)c(Br)c1 260346466 TTYKHDXRYNXNQC-RXMQYKEDSA-N 275.098 2.137 10 10 CECE C[C@@H]1C[C@@H](NCc2ccc(N3CCOCC3)cc2)[C@@H](C)O1 296476802 PTWWVQHUXKNQIE-CKEIUWERSA-N 290.407 2.179 10 10 CECE CN1CCc2cc([C@H](O)[C@@H](CN)C3CCCC3)ccc21 2163064522 UXAUGPKQQATGCF-RDJZCZTQSA-N 274.408 2.477 10 10 CECE O[C@@]1(c2ccc(N3CCCC3)cc2)C[C@@H]2CNC[C@@H]2C1 2163105598 FUDOEIHHPSLBOK-HALDLXJZSA-N 272.392 2.104 10 10 CECE Cc1cnn(C[C@@H](O)c2ccc3c(c2)CCCN3C)c1 2163111474 RYMAOPSWEFINFE-MRXNPFEDSA-N 271.364 2.308 10 10 CECE C[C@@H]1COC[C@@H]1[C@H](NN)c1ccc(N2CCCC2)cc1 2163158573 QLKCITSIMXCEJI-UHOFOFEASA-N 275.396 2.074 10 10 CECE CNCc1cc(F)c(N2C[C@H]3C[C@@]3(COC)C2)c(F)c1 2165468662 UETMTSGGJCPHDT-ABAIWWIYSA-N 282.334 2.157 10 10 CECE COC[C@]12CN(CCOc3ccc(N)cc3)C[C@@]1(C)C2 2165472636 TXAUKXKCAHEAKV-CVEARBPZSA-N 276.380 2.006 10 10 CECE C[C@@H]1CC(C(=O)N(C)Cc2ccc(N)cc2)C[C@@H](C)O1 724415346 WPZDNWRDAWXZOP-VXGBXAGGSA-N 276.380 2.431 10 10 CECE Nc1ccc(OCC(=O)N2CCC(C3CC3)CC2)cc1 724801603 CWXMXZJPWCKEQY-UHFFFAOYSA-N 274.364 2.296 10 10 CECE COCC[C@@H](COC)N(C)[C@@H]1CCc2cccc(O)c21 2165961116 WMQMYWMVSSUYRG-UONOGXRCSA-N 279.380 2.363 10 10 CECE CC(=O)C(=O)COc1cc(Br)ccc1F 808031128 JAAYQPWBEFBMDP-UHFFFAOYSA-N 275.073 2.125 10 10 CECE CO[C@H]1C[C@H](CN)N(c2ccc(OC3CCC3)cc2)C1 2162660073 WVAZUYQXOSAPCY-CJNGLKHVSA-N 276.380 2.170 10 10 CECE Cc1cc(O)c(CN2CC[C@]3(CNC(=O)C3)C2)cc1Cl 825732066 OCQAPBRWFBNEIN-HNNXBMFYSA-N 294.782 2.066 10 10 CECE COc1ccc(O)c(CNC(=O)[C@H](C)Cc2ccco2)c1 830544836 UKHVAVJQORXUJY-LLVKDONJSA-N 289.331 2.489 10 10 CECE C[C@@H](CN(C)C/C=C\c1ccc(N(C)C)cc1)C(=O)O 840999054 NJHXNFYLYZWJEF-SZZPACECSA-N 276.380 2.418 10 10 CECE CCC[C@H](C)[C@H](CO)NCc1cc(F)ccc1O 846017895 RBXUQBSZSORFCQ-GWCFXTLKSA-N 255.333 2.418 10 10 CECE COc1ccc(N(C)CCN(C)CCCNC2CC2)cc1 923388658 SXDVCCUWVZIKTG-UHFFFAOYSA-N 291.439 2.205 10 10 CECE C[C@H](NC[C@@H]1CCN1C1CCOCC1)c1ccccc1O 927105295 DOKBLDWIHZIMJS-ZFWWWQNUSA-N 290.407 2.296 10 10 CECE Cc1cncc(CCNCc2cc(Cl)ccc2O)n1 850390606 KVYFTAQLDBSGRZ-UHFFFAOYSA-N 277.755 2.476 10 10 CECE CN(C)c1ccc(/C=C/CNCCOCCF)cc1 853091718 NXWOSPNQWWPCEC-ONEGZZNKSA-N 266.360 2.342 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@H](C)[C@@H]1CCO 697210556 XFZDIQSJZLOWOY-WBMJQRKESA-N 262.397 2.441 10 10 CECE O=[N+]([O-])c1ccc(O)c(CN[C@H]2CCCn3nccc32)c1 850429590 GRHKCXMRPYXZFB-LBPRGKRZSA-N 288.307 2.122 10 10 CECE CCN(CC)c1ccc(CNC[C@@H]2CCC(=O)N2)cc1F 850388396 AHZQEZQJSBGKKB-ZDUSSCGKSA-N 293.386 2.040 10 10 CECE CCOc1ccc(CN[C@H](C)[C@H](O)C(F)(F)F)c(O)c1 865710497 AWBCGMCXYNTHCV-PELKAZGASA-N 293.285 2.192 10 10 CECE COc1ccc(CNCC(C)(C)n2cccn2)c(O)c1 697589967 QKZXCPFXVIITNC-UHFFFAOYSA-N 275.352 2.122 10 10 CECE CCN(C)c1ccc(CN2C[C@H](C(N)=O)CC[C@@H]2C)cc1 773749290 SASSSWBXWUOPFA-DZGCQCFKSA-N 289.423 2.229 10 10 CECE CCOc1cccc(CN2CCSC[C@@H]2CCO)c1O 770305714 JIYZEODFKBBEHM-ZDUSSCGKSA-N 297.420 2.091 10 10 CECE COc1cc2c(c(O)c1OC)[C@@H](C1CCC1)NCC2 75823224 BSBYZLTVMGIJLV-CYBMUJFWSA-N 263.337 2.396 10 10 CECE COc1ccc(O)cc1C(=O)NCc1ccccc1O 780930020 AOENTFYZVRPGFC-UHFFFAOYSA-N 273.288 2.036 10 10 CECE Oc1ccc(CNCCCCN2CCCC2)cc1O 83478840 KKOPSEAYYSIKAX-UHFFFAOYSA-N 264.369 2.063 10 10 CECE COC(=O)c1csc(NCc2ccccc2O)n1 83463388 ZPLSJPHXUHBBOB-UHFFFAOYSA-N 264.306 2.247 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)c1cc(F)cc(F)c1 702080760 BGTQTVLHGSEQHK-UHFFFAOYSA-N 298.314 2.372 10 10 CECE C[C@@H]1CC[C@H](O)CN1Cc1cc(F)cc(F)c1O 895033815 KLMSAFJZYVNVNK-KCJUWKMLSA-N 257.280 2.016 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C23CCCN(CCC2)C3)C1 705924824 ZVRKUCZNDLUAMS-LBPRGKRZSA-N 277.372 2.164 10 10 CECE CNCc1ccc(N2C[C@@H](C)[C@H](CO)C2)c(Cl)c1 708075175 KAHLPDUUWOQPBR-PWSUYJOCSA-N 268.788 2.124 10 10 CECE CC[C@]1(C)COCCN1c1ccc(CN)c(F)c1F 708253549 FQHUWUBURIXSGS-CQSZACIVSA-N 270.323 2.429 10 10 CECE NCc1ccc(N2CC(n3ccnc3)C2)c(Cl)c1 708255500 BIGBTYODMBRJFQ-UHFFFAOYSA-N 262.744 2.057 10 10 CECE CCN[C@H](C)CC(=O)N(C)[C@@H](C)c1ccccc1O 61272808 CQZZANXMBOXPBW-NEPJUHHUSA-N 264.369 2.300 10 10 CECE COc1ccc(N(C)[C@@H](C)C(OC)OC)c([N+](=O)[O-])c1 714441138 DYXVGPJPPYBSST-VIFPVBQESA-N 284.312 2.047 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1CCCC13OCCO3)CC2 715637641 YOSXPSAXKFOQRA-TZMCWYRMSA-N 275.348 2.265 10 10 CECE Cc1conc1C(=O)N(Cc1ccc(N)cc1)C1CC1 720497542 PSJNFHWKRVJVNP-UHFFFAOYSA-N 271.320 2.370 10 10 CECE C[C@H]1CCN(CCN2CCc3cc([C@H](C)N)ccc32)C1 692576108 LXVIPAKOTCMRGZ-KBPBESRZSA-N 273.424 2.411 10 10 CECE C[C@H]1C[C@@H](N)CN(Cc2ccc3c(c2)CCCN3C)C1 94548157 PXDWPRJIRSFUNO-XJKSGUPXSA-N 273.424 2.238 10 10 CECE Cc1cc(N2C[C@@H](CO)CC(C)(C)C2)ccc1CN 2115965190 RSSBRIFQEHOLGG-ZDUSSCGKSA-N 262.397 2.299 10 10 CECE CC(C)[C@H](NCc1ccc(O)c(O)c1O)C(F)(F)F 2117446592 YBZPVYNOFDBVEO-NSHDSACASA-N 279.258 2.480 10 10 CECE CN(Cc1cc(Cl)ccc1O)C[C@@]1(C)COCCO1 2117637454 CIHGNSDBEQYLBN-AWEZNQCLSA-N 285.771 2.283 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@@H]1CC=CCC1 2118506869 JHYDHBABTJSTMF-GFCCVEGCSA-N 261.321 2.321 10 10 CECE CCNCc1ccc(N2CC3(C=CCO3)C2)c(C)c1 2127305094 DLFOOTDJEOQYTN-UHFFFAOYSA-N 258.365 2.250 10 10 CECE C[C@]1(O)CCCN(c2ccc3c(c2)CC[C@@H]3N)CC1 2128324234 BHBNLONPBUOYQS-HOTGVXAUSA-N 260.381 2.374 10 10 CECE Cc1cc(N2CC[C@](O)(C(C)(C)C)C2)ccc1CN 2121098948 SWFPZHIZNJMWSC-MRXNPFEDSA-N 262.397 2.441 10 10 CECE CC(C)(C)[C@@H](CCO)NC(=O)CCc1ccc(N)cc1 231066400 NIDCZDUUBUSQON-CQSZACIVSA-N 278.396 2.115 10 10 CECE COC[C@H]1C=CCCN1c1ccc([C@H](C)O)c(O)c1 2125946522 FOQPTEMSNCZCPP-WCQYABFASA-N 263.337 2.227 10 10 CECE C[C@@H]1C[C@@H](N(C)c2ccc(CO)cc2[N+](=O)[O-])CS1 2132953498 PRDDCUPMZCMAOW-MWLCHTKSSA-N 282.365 2.417 10 10 CECE CC(C)N1[C@H](C)CN(c2ccc(CN)cc2)C[C@H]1C 2130399856 CDNIEDNQNHXNOP-ZIAGYGMSSA-N 261.413 2.453 10 10 CECE Cc1cc(N2CCNCC2)ccc1OC[C@@H]1C[C@@H]1F 2131815429 XOQXUAAUQINIAU-JSGCOSHPSA-N 264.344 2.141 10 10 CECE Nc1ccc(COc2cccc(C(=O)O)c2N)cc1 1905737441 DFNCLJBKBFUVFD-UHFFFAOYSA-N 258.277 2.128 10 10 CECE Cc1nnc(N(C)Cc2ccccc2O)n1C1CC1 1693457908 KGEWWFVIDZWEQA-UHFFFAOYSA-N 258.325 2.263 10 10 CECE Cc1cc(CNC(C)C)ccc1N(C)C1CC(O)C1 1914596144 OPGVXSWPIMXVRW-UHFFFAOYSA-N 262.397 2.453 10 10 CECE Cc1ccc(C(=O)NC2([C@H]3CCCO3)CCC2)c(O)c1O 1348265530 CFDFGFIHWCJRQP-GFCCVEGCSA-N 291.347 2.238 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2134364446 ZJIBSHMOLNRCOT-PXSMZSCLSA-N 257.337 2.292 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)CCOC2CC2)C1 1912198598 IUFQVYUWCSPJGA-SNVBAGLBSA-N 252.318 2.104 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CC(=O)Nc2cccc(F)c2)C1 1912191525 SIRGVDYZGFEQTR-JTQLQIEISA-N 277.303 2.396 10 10 CECE [N-]=[N+]=NC1CCN(S(=O)(=O)Cc2ccccc2)CC1 1912193866 QYLLXGGBPDMPPR-UHFFFAOYSA-N 280.353 2.291 10 10 CECE COc1ccncc1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912149865 MGMJOSAMFCOBDC-VIFPVBQESA-N 261.285 2.005 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)N1CCCc2ccccc21 1912189068 TYTUVPHXOWVWFK-UHFFFAOYSA-N 273.340 2.208 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(N)=O)CC[C@H]2CCCC[C@H]21 1912206957 VHXKLEZSYYYESR-NQBHXWOUSA-N 265.361 2.101 10 10 CECE NCc1ccc(N2CC3(CCOC3)C2)cc1C(F)(F)F 1915829158 XUDDUFOLEXXOTP-UHFFFAOYSA-N 286.297 2.391 10 10 CECE CNCc1ccc(N2CC3(CCOCC3)C2)c(F)c1 1915827390 BSOLSIUOWRUMAS-UHFFFAOYSA-N 264.344 2.162 10 10 CECE NC1(c2ccc(N3CCOCC3)cc2)CC(F)(F)C1 1536104362 HFUDCMHDFJKXPO-UHFFFAOYSA-N 268.307 2.106 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4CCCC[C@@H]43)ccc21 226617338 NHKPNELAOYDDGW-LKTVYLICSA-N 271.364 2.407 10 10 CECE O=C(O)[C@@H]1[C@H]2CC[C@H](C2)N1Cc1ccc(Cl)cc1O 2136397836 NSZZVSRYNMVAOM-KDDOJWQBSA-N 281.739 2.483 10 10 CECE CC[C@@H]1CC[C@@H](CNCc2ccc(OC)cc2O)O1 2136766019 FBNVUYHPXSVYFI-OCCSQVGLSA-N 265.353 2.448 10 10 CECE O=C(Cc1ccc2c(c1)CCC2)NCc1c(O)cccc1O 1558533518 DSUUYJBYHIGFDL-UHFFFAOYSA-N 297.354 2.445 10 10 CECE OC[C@@H](CC1CCCC1)NCc1ccc(O)cc1O 1926791399 CWPQGLXAYDSXML-CYBMUJFWSA-N 265.353 2.129 10 10 CECE Cc1cc(F)cc(C(=O)NCc2ccc(O)cc2O)c1N 1638356740 NDZKXIXPUBECHW-UHFFFAOYSA-N 290.294 2.058 10 10 CECE COCc1ccnc(NC(=O)c2cc(O)cs2)c1 1640620711 HEPCYGMQQMRCOE-UHFFFAOYSA-N 264.306 2.247 10 10 CECE COc1ccc(C(=O)NCc2c(O)cccc2F)cc1 1652295256 FBFKEEBGPSJORU-UHFFFAOYSA-N 275.279 2.470 10 10 CECE Cn1ncc([N+](=O)[O-])c1NCc1ccc2cccnc2c1O 1651161015 NGBJZKPVYMDLTQ-UHFFFAOYSA-N 299.290 2.194 10 10 CECE CC(C)CNCc1nnc(-c2ccc(O)c(O)c2)s1 232621469 KOOOWCLTQVXUKP-UHFFFAOYSA-N 279.365 2.362 10 10 CECE Cc1cccc(CN[C@@H]2CCC[C@@]23CCNC3)c1O 2139744050 RWZJOADFBBSGCX-ZBFHGGJFSA-N 260.381 2.322 10 10 CECE Nc1ccc(CC(=O)Nc2n[nH]c3cccc(F)c23)cc1 153212421 NQIQLNYQBQJVSY-UHFFFAOYSA-N 284.294 2.465 10 10 CECE Nc1ccc(CN2[C@H](C(=O)O)CCC23CCC3)cc1 2140823089 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264.369 2.043 10 10 CECE Cc1cc(N2C[C@@H]3CC[C@H](C2)C3O)ccc1[C@H](C)O 2269679366 PQSCQZNHHHZQEL-RAGMHUQYSA-N 261.365 2.255 10 10 CECE NCc1ccc(N2CC[C@]3(O)C[C@@H]3C2)c2ccccc12 2279936393 JOATZHVFQVYQJZ-DYVFJYSZSA-N 268.360 2.260 10 10 CECE COc1ccc(N2CC[C@H]3[C@H](C[C@H]3O)C2)c2c1CCC2 2284525151 QUKZJGGWIGAMOS-BFQNTYOBSA-N 273.376 2.391 10 10 CECE Cc1cc(N2CCc3nnccc3C2)ccc1[C@@H](C)N 2285126389 BAYYEVRMBIVURQ-GFCCVEGCSA-N 268.364 2.367 10 10 CECE Cc1cc(N2CCO[C@H](CO)C2(C)C)ccc1[C@@H](C)O 2285149951 JNWORAQNCLEIFU-IUODEOHRSA-N 279.380 2.024 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)[C@@H]1COC2(COC2)C1 2286269805 NUNYIJOZDSSDGP-OCCSQVGLSA-N 277.364 2.042 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCn3cncc3C2)c(F)c1 2286545462 NXDAWLSTACOSIC-SECBINFHSA-N 279.290 2.235 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)c2c(N)cc(F)cc2F)CC1 2286947790 VIENNIKXDRKQQW-UHFFFAOYSA-N 281.266 2.462 10 10 CECE COc1ccnc(C(=O)N[C@@H](C)c2ccccc2O)c1 1151899533 DTOCPVLXVLHIMK-JTQLQIEISA-N 272.304 2.287 10 10 CECE COc1ccc(N(C)[C@@H]2CNC[C@@H]2F)cc1Cl 2303680783 SRFGHKWMGJPOAS-WDEREUQCSA-N 258.724 2.095 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)N1C[C@H]2CCC[C@H]2C1 2307989564 CIZQOMAHUGPMIF-BETUJISGSA-N 273.332 2.370 10 10 CECE CCC[C@@H](CCO)CNC(=O)C=Cc1ccc(O)c(O)c1 2308002182 CUBXJPRZAUTNEQ-ZDUSSCGKSA-N 293.363 2.026 10 10 CECE COC(=O)[C@@](CC1CC1)(NCCN=[N+]=[N-])C1CC1 2320783763 JMXOKCQCCISUTE-LBPRGKRZSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)[C@@H]1C(F)(F)C12CC2 2312334279 QTTKVRCENMIDRU-CSMHCCOUSA-N 256.256 2.379 10 10 CECE C[C@@H](CN(C)C)N(C)[C@H](C)c1cc(F)ccc1O 2326775611 SYJDFUPWAAXVCQ-WDEREUQCSA-N 254.349 2.474 10 10 CECE O=C(O)[C@H]1[C@@H]2CC[C@@H]2CN1Cc1c(O)cccc1Cl 2329040389 ONXRZXBMGLTSPG-JRKPZEMJSA-N 281.739 2.341 10 10 CECE C[C@H]1Cc2cc(N3CC[C@@H]4CCN[C@@H]4C3)ccc2O1 2329481893 MJWAXSRYLPEJDR-SLEUVZQESA-N 258.365 2.198 10 10 CECE CNCc1ccc(N(C)C[C@H]2[C@@H]3CCO[C@@H]32)c(F)c1 2330707835 DVAWNKBCZNVWSZ-HUBLWGQQSA-N 264.344 2.016 10 10 CECE C[C@@H](N[C@@H]1CC[C@@H]2C[C@H]1CO2)c1c(O)cccc1O 2334122444 HNYRJPHXYKELSC-WRWGMCAJSA-N 263.337 2.316 10 10 CECE COc1ccc(N2C[C@@]3(CO)CC[C@H]2C3)cc1OC 2336477818 JCFJSWLUXQUPTP-SWLSCSKDSA-N 263.337 2.055 10 10 CECE CO[C@@H]1CN(c2ccc(CN)c(C3CC3)c2)C[C@H]1F 2339161763 VLNPCQFXVJBVPZ-HUUCEWRRSA-N 264.344 2.196 10 10 CECE Cc1cc(CN)ccc1N(C)C[C@@H]1O[C@H]2CC[C@H]1C2 2352619729 ISEKZDGWHAOZTH-DZKIICNBSA-N 260.381 2.457 10 10 CECE C[C@H](C[C@@H]1CCOC1)N1CCc2cc(CN)ccc21 2353014915 ZDCDRJUZQAPJEK-OCCSQVGLSA-N 260.381 2.323 10 10 CECE CC1=NN(c2ccccc2)C(=S)/C1=C/Nc1nc[nH]n1 101460089 HTZRYTUOSJHOQP-YRNVUSSQSA-N 284.348 2.324 10 10 CECE CNC1C[C@H]2CC[C@H](C1)N2c1ccc(OC)cc1OC 107908040 FAHVFARZGUEIER-CHWSQXEVSA-N 276.380 2.423 10 10 CECE CN1CCc2cc(CNCCCCn3ccnc3)ccc21 50286950 NDQYSLNUORQLLU-UHFFFAOYSA-N 284.407 2.445 10 10 CECE CN(C)c1ccc2c(c1)CN(C(=O)C1CCC1)CCO2 409420225 RAYWZIDTEBIILS-UHFFFAOYSA-N 274.364 2.274 10 10 CECE CN[C@@H]1CCN(c2cc(Cl)c(OC)cc2OC)C1 37635693 YNAUEKIADDZZBK-SECBINFHSA-N 270.760 2.155 10 10 CECE Cc1cccnc1COc1ccc(N2CCNCC2)cc1 122362851 PIVDGSGKNKIOJT-UHFFFAOYSA-N 283.375 2.379 10 10 CECE C[C@H](O)C[C@@H](C)NC(=O)/C=C/c1ccc(N(C)C)cc1 228175620 GVTVLFXICNGAKF-HKCLJGFPSA-N 276.380 2.041 10 10 CECE C[C@@H]1CCCC[C@H]1OC[C@@H](O)CNCc1ccccc1O 228415709 YJXWMFGIVXOULA-UKPHBRMFSA-N 293.407 2.438 10 10 CECE CC(C)(C)OC(=O)[C@@H]1C[C@@]1(N)c1ccc(F)cc1O 1952760096 FGXWYZXXAWTOHI-IINYFYTJSA-N 267.300 2.047 10 10 CECE C[C@H]1CO[C@H](C)CN1CCCC(=O)Nc1ccc(N)cc1 223166263 QBVXVUWISXATBB-QWHCGFSZSA-N 291.395 2.097 10 10 CECE C[C@@H](Cc1ccco1)NC(=O)c1ccc(O)c(O)c1 227018368 MZWZPGKDICXBDF-VIFPVBQESA-N 261.277 2.052 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(N)=O)CCCCc2ccccc21 90260326 BAIVOOYRNVEKBF-OAHLLOKOSA-N 287.367 2.384 10 10 CECE CN[C@H](C)c1ccc(N2CCOC(C)(C)C2)cc1O 93670558 IXMFBMJLWLKOMM-LLVKDONJSA-N 264.369 2.288 10 10 CECE CO[C@H]1CC[C@H](N(C)c2c(F)cc(CO)cc2F)C1 2130731983 GZDPOVMJTCAEOT-QWRGUYRKSA-N 271.307 2.461 10 10 CECE C[C@H](Sc1ncc[nH]1)C(=O)Nc1ccc(N)cc1 235537052 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NN[C@H](COCC(F)F)c1ccc(N2CCCC2)cc1 2163100232 PEXWREDEECJISM-CYBMUJFWSA-N 285.338 2.073 10 10 CECE CN(C)c1ccc([C@H](NN)C(C)(C)[C@H]2CCCO2)cc1 2163103696 WVDSJZMUJNSGRB-CABCVRRESA-N 277.412 2.462 10 10 CECE NC[C@]1(F)C[C@@H]([C@H](O)c2ccc(N3CCCC3)cc2)C1 2163105173 DAKLCESWZIFTPG-BMFZPTHFSA-N 278.371 2.397 10 10 CECE Cc1nscc1[C@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2163122751 DNEWNUCONDMFLL-CABCVRRESA-N 289.404 2.177 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@@H]1C[C@@H]2OCC[C@H]2O1 2163175442 CTKMEOYGSOWUAE-KOZAUXTDSA-N 277.364 2.331 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@](C)(O)CSC 2163228756 HNBYCNRGSJUZPZ-JKSUJKDBSA-N 294.464 2.444 10 10 CECE CN1CCCc2cc([C@@H](N)[C@@](C)(O)C3(F)CC3)ccc21 2163241231 AMIFJJGHLHRPLV-HUUCEWRRSA-N 278.371 2.322 10 10 CECE CN(CC1(C)COC1)c1ccc(/C=C\C(=O)O)cc1 705586418 VCIMPTQWUMDADH-YVMONPNESA-N 261.321 2.257 10 10 CECE CN1CCc2cc(CN3CC[C@H]3CCC(=O)O)ccc21 2165706655 FSVNEUGOAVNRAD-CQSZACIVSA-N 274.364 2.118 10 10 CECE C[C@H](CNCc1ccc(O)c(O)c1O)CC(F)(F)F 396900427 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10 10 CECE CO[C@H](CNCc1ccc(O)cc1O)C1CCCC1 692933758 AXWYKQDWPHEKMG-OAHLLOKOSA-N 265.353 2.393 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)C1CC(C(=O)O)C1 693007753 JTCXYHKNNVBEKB-FKTRJACZSA-N 267.300 2.387 10 10 CECE C[C@H]1CC(NCc2ccc(O)cc2O)C[C@H](C)O1 694773599 UPAKJCQTFAJIAJ-UWVGGRQHSA-N 251.326 2.143 10 10 CECE COCCNCc1ccc(N2CC[C@H]3C[C@@H]3C2)c(F)c1 699146362 PLLUKJVPPJHPNV-UONOGXRCSA-N 278.371 2.408 10 10 CECE Cc1nccnc1CN(C)c1ccc(CO)cc1F 699541219 HFKYKSPNUIUYRI-UHFFFAOYSA-N 261.300 2.053 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1ccc(F)c(F)c1 90259334 ZNWNAWXDKGXGBW-NSHDSACASA-N 284.266 2.469 10 10 CECE CNCc1ccc(N2C[C@H]3CCCCN3C[C@@H]2C)cc1 94446597 BDGPKQZIVKAJMT-WMLDXEAASA-N 273.424 2.469 10 10 CECE Cc1cc(N(C)C(=O)/C=C/c2cn(C)cn2)ccc1O 1302300653 ZLLRPYPOZIKQRF-QPJJXVBHSA-N 271.320 2.110 10 10 CECE O=C(c1cccc(O)c1O)N1CCCC[C@H]1c1ncccn1 1303233380 AYWWBUCUEDDKND-LBPRGKRZSA-N 299.330 2.255 10 10 CECE Cn1ccnc1[C@H]1CCCN1Cc1ccc(N)cc1 2115093951 DQFYBNULCBEBLM-CQSZACIVSA-N 256.353 2.339 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2cnn(C)n2)cc1Cl 2115765416 YREJIGCFNHDLEY-VIFPVBQESA-N 280.759 2.158 10 10 CECE C[C@@H]1CN(c2ccc(CN)cc2F)CC[C@H]1CCO 2115822462 VLMPKBNNKREJOR-YPMHNXCESA-N 266.360 2.129 10 10 CECE Nc1ccc(CNc2cccc(N)c2[N+](=O)[O-])cc1 2117256798 GCJSQXYNRAOGEM-UHFFFAOYSA-N 258.281 2.371 10 10 CECE C[C@H]1Cc2cc(N3C[C@H]4CC[C@@](N)(C4)C3)ccc2O1 2117628864 VDAXCNONIMPPHX-MQIPJXDCSA-N 258.365 2.328 10 10 CECE C[C@H](c1ccc(F)cc1O)N1[C@H]2CC[C@H]1[C@@H](CN)C2 2117663166 KXXOPJLKGPJUSX-KLTVKPSUSA-N 264.344 2.404 10 10 CECE CNCc1ccc(N2CCOC[C@H]2C(F)F)cc1C 2119021640 ADJVVYBLKNMORB-ZDUSSCGKSA-N 270.323 2.185 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)CC1COC1 2119998207 GPDHTVFUEUDPDA-UHFFFAOYSA-N 262.353 2.042 10 10 CECE Cc1ccc(O)c(CN2CCC[C@H]3[C@@H]2CCN3C)c1 2127341017 GWRLKULOFWFLDY-GJZGRUSLSA-N 260.381 2.369 10 10 CECE Cc1cc(N2CC[C@@H]2[C@H](C)O)ccc1CNC1CC1 2125825640 YINUGCWHRPPJKS-BLLLJJGKSA-N 260.381 2.207 10 10 CECE COC[C@@H](CCNCc1ccc(Cl)cc1O)OC 1652813262 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10 CECE CC(C)(C)OC(=O)NC1CC(N)(c2ccccc2O)C1 1933872106 OODFMJFMCMQTMH-UHFFFAOYSA-N 278.352 2.233 10 10 CECE COc1cc(N(C)C[C@@H](OC)C(C)C)ccc1CN 2139697924 BPGXFLOTCILVII-OAHLLOKOSA-N 266.385 2.261 10 10 CECE C[C@H](CNCc1ccc(F)cc1O)c1cnn(C)c1 2139880663 XGUNYFCDFXTCHL-SNVBAGLBSA-N 263.316 2.158 10 10 CECE COC(=O)[C@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 164351255 CPYQMDFHEQOAPM-ZDUSSCGKSA-N 277.364 2.394 10 10 CECE CNC(=O)C1CCN(c2ccc3c(c2)CC[C@@H](C)N3)CC1 168355928 XPZVYKNJZJQQMI-GFCCVEGCSA-N 287.407 2.396 10 10 CECE CC[C@H]1CN(c2ccc([C@H](C)O)cc2F)C[C@@H]1CO 2140786855 QDPLSYCWNRNSNG-GMXVVIOVSA-N 267.344 2.334 10 10 CECE CNCc1ccc(N2[C@H](CO)CCC2(C)C)cc1C 2140773418 DISOYWDSIFTSDZ-HNNXBMFYSA-N 262.397 2.454 10 10 CECE CNCc1ccc(N2CC[C@@](C)(O)C2)cc1C(F)(F)F 234374227 WEWYUTIZZOQYPY-CYBMUJFWSA-N 288.313 2.386 10 10 CECE CN[C@H](c1cc(OC)ns1)c1ccccc1O 1942405152 GVUOWEVNOKEMNY-LBPRGKRZSA-N 250.323 2.166 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)[C@H]2CC[C@@]2(C)C1=O 2142221112 RALOKJNDHPLDIJ-XDMRBOTDSA-N 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271.364 2.265 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CCOC[C@H]1CF 2182603763 BPLWLRRJDCQQQM-OAHLLOKOSA-N 278.371 2.422 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@H]1CNC(C)(C)C1 2193374302 DDRCAEYMVGJDGN-HOCLYGCPSA-N 273.424 2.328 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CO[C@@](C)(CC)C1 2189436477 GJDFNHCYBNWCID-STQMWFEESA-N 284.360 2.167 10 10 CECE CNCc1ccc(N(CC(F)(F)F)C2COC2)c(C)c1 2196631429 BMYJDOCSOJDFBA-UHFFFAOYSA-N 288.313 2.482 10 10 CECE Nc1ccc(OCCCN(CC(F)F)C2COC2)cc1 2196637537 BZMDCQNBNNQULJ-UHFFFAOYSA-N 286.322 2.004 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)[C@@H]1CC[C@H]2C[C@@H]1C2 2189621737 WQFZJSOLDJTWHV-MMDVMMEASA-N 271.364 2.263 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H](C(F)(F)C(=O)O)C1 2184102032 KXMJVNBAFWJMSH-UWVGGRQHSA-N 285.290 2.495 10 10 CECE O[C@@H]1CCCc2cc(N3CCn4ccnc4C3)ccc21 2184688200 DCKARNILWGLMCK-OAHLLOKOSA-N 269.348 2.273 10 10 CECE Cc1nc(CN(C)c2ccc3c(c2)CCC[C@@H]3N)no1 2184689379 OGFMMXPUCMLXID-AWEZNQCLSA-N 272.352 2.351 10 10 CECE 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[N-]=[N+]=NCCCCN1C(=O)[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C1=O 2264972344 KPKSSFLFXDXHCI-CKIJPRSSSA-N 262.313 2.108 10 10 CECE CNC[C@@H]1CN(c2cc(F)c(OC)c(F)c2)C[C@@H]1C 2268033106 SHNOVWOQWXMVKH-VHSXEESVSA-N 270.323 2.265 10 10 CECE Cc1cc(N2CC(n3ccnc3)C2)ccc1[C@H](C)O 2269673351 SHEAQJJHCQSBGZ-LBPRGKRZSA-N 257.337 2.306 10 10 CECE Cc1cc(N2CC3(CC(CO)C3)C2)ccc1[C@H](C)O 2269679712 STBHAZVETDICOE-LBPRGKRZSA-N 261.365 2.257 10 10 CECE Nc1ccc(CN(C(=O)N2CC(F)(F)C2)C2CC2)cc1 2280054407 GNHHDDUFGFGESU-UHFFFAOYSA-N 281.306 2.304 10 10 CECE CNCc1ccc(OC)c(C[S@](=O)CC(C)(C)OC)c1 2280282356 TXEXYOMNLOGUGE-FQEVSTJZSA-N 299.436 2.088 10 10 CECE CCc1nn(C)c([C@@H](O)[C@@H](N)c2ccccc2O)c1Cl 2284547074 SJMJBOYYYOXBHN-JSGCOSHPSA-N 295.770 2.075 10 10 CECE c1cc(N2CCNCC2)ccc1CN1CCC[C@H]2C[C@@H]21 2286067633 CXLSNPMYPOLKLC-RDJZCZTQSA-N 271.408 2.081 10 10 CECE O=C1N=C(N2CCCC2)SC1=Cc1cccnc1 2297471351 LZEUIXUHOFHIIQ-UHFFFAOYSA-N 259.334 2.148 10 10 CECE CS[C@H](C(=O)NCc1ccc(N)cc1)C1CC1 2299416100 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CC1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 802650939 FRAAQKZPXZBZTE-UHFFFAOYSA-N 256.689 2.406 10 10 CECE COC[C@]1(C)COCCN1c1ccc([C@H](C)O)cc1F 2168258024 XRVPYPHBONFIOG-XHDPSFHLSA-N 283.343 2.121 10 10 CECE C[C@H]1CN[C@@H](C)CN(c2ccc3c(c2)OCCCO3)C1 2162641006 WXKOZXUHMOIBDN-STQMWFEESA-N 276.380 2.282 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1nc(C)cc(C)n1 2163067518 XOWHYJKRQMMTPE-OAHLLOKOSA-N 270.380 2.468 10 10 CECE CN1CCCc2cc([C@@]3(O)C[C@@H](N)C34CCC4)ccc21 2163096970 KDVWPNDNEWWKMW-WBVHZDCISA-N 272.392 2.158 10 10 CECE Cc1ccc([C@H](NN)c2ccc(N(C)C)cc2)nc1C 2163134211 VYYXXJZZIPSFGT-MRXNPFEDSA-N 270.380 2.317 10 10 CECE CCN1CCc2cc([C@H](N)C3(O)C[C@@H]4C[C@H]4C3)ccc21 2163140215 HCEDYPKSUCGORJ-DZKIICNBSA-N 272.392 2.230 10 10 CECE CN(C)c1ccc([C@@H]2COCC(=N)N2)c(Cl)c1 575260948 SPXSFZHVZCOQCR-NSHDSACASA-N 253.733 2.044 10 10 CECE CC[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CCO1 817643185 JRKVBRQCBOMSAN-FSMZVQOTSA-N 291.347 2.185 10 10 CECE CN(C)c1ccc(OCc2nsc(N(C)C)n2)cc1 810001064 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COc1cccc(CN2CC(CO)(c3ccccc3)C2)c1O 840970276 SQAUUNYGVSIQMX-UHFFFAOYSA-N 299.370 2.147 10 10 CECE CO[C@@](C)(CO)CN[C@H](C)c1c(C)cc(C)cc1O 848556491 ZEVRCLXPTRHTNE-IUODEOHRSA-N 267.369 2.057 10 10 CECE COCc1n[nH]c(CN[C@H](C)c2c(C)cc(C)cc2O)n1 850513203 FPNUDFQWOMHKSM-LLVKDONJSA-N 290.367 2.124 10 10 CECE COc1ccc(N(C)CCOC2CCOCC2)c(OC)c1 859204989 RDCKMFQMXDMWBC-UHFFFAOYSA-N 295.379 2.336 10 10 CECE Cc1cc(CN[C@@H]2C[C@@H](O)C23CCC3)ccc1N(C)C 852580184 BGDZMXLUBGIDMA-HZPDHXFCSA-N 274.408 2.454 10 10 CECE COC1(CCNC(=O)NCc2c(O)cccc2F)CCC1 922609475 IYRCTPVVUUBIGD-UHFFFAOYSA-N 296.342 2.290 10 10 CECE C[C@@H](NCC[S@@](=O)C(F)(F)F)c1ccccc1O 931554543 QNSJCPZDQMKTKF-NTCNTBNZSA-N 281.299 2.311 10 10 CECE Oc1ccc(CNC[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1O 693353048 PVMOCCAALIWPSN-JGPRNRPPSA-N 269.291 2.479 10 10 CECE CCO[C@H](CS(=O)(=O)Nc1ccc(O)c(C)c1)C1CC1 863406245 ZAGLAUSDAFLBRM-CQSZACIVSA-N 299.392 2.257 10 10 CECE CC[C@H](C(=O)Nc1ccc(N)cc1)N1CCCCC1 62460949 QEIOBADECPFUNU-CQSZACIVSA-N 261.369 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Nc1ccc(CCN2[C@H]3CCC[C@H]2CC(O)C3)cc1 1922777286 CYLUYJFEVDMSRM-GJZGRUSLSA-N 260.381 2.189 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)CC(C)(C)C2)cc1O 1923175806 QIEKRUXBWPOTBS-ZYHUDNBSSA-N 265.353 2.043 10 10 CECE C[C@@H]1C[C@@H](C)[C@@H](C(=O)O)N(Cc2ccccc2O)C1 2136409846 WOVTZVMZPQRTSI-GYSYKLTISA-N 263.337 2.323 10 10 CECE C[C@@H](N[C@@H]1CCN(C)C1(C)C)c1ccc(O)cc1O 1924315064 RJUJPEPIEIPTPW-QMTHXVAHSA-N 264.369 2.231 10 10 CECE C[C@@H]1Cc2cc(N3C[C@@H]4CC[C@@]4(CN)C3)ccc2O1 2136689020 ZMQTXRXLELWBMW-PVXIVEMSSA-N 258.365 2.185 10 10 CECE CC1(C)CCC[C@]1(O)CNCc1cccc(O)c1O 2136830253 GCJJDRAOYSHNGG-HNNXBMFYSA-N 265.353 2.129 10 10 CECE COc1cc(C)ncc1C(=O)Nc1ccc(N)cc1 1927270995 QALJBKKVZIGTCH-UHFFFAOYSA-N 257.293 2.233 10 10 CECE Cc1cc(CNC(=O)c2cc(O)cs2)cc(C)n1 1630268037 XPDDNZCPESXROG-UHFFFAOYSA-N 262.334 2.396 10 10 CECE COCCC(=O)NCc1c(O)ccc2ccccc12 1645440560 JLNDOEMTADHIMO-UHFFFAOYSA-N 259.305 2.198 10 10 CECE Nc1ccc(CCNc2nnc3ccccc3n2)cc1 232319806 TYKBLWGNCHQYPH-UHFFFAOYSA-N 265.320 2.262 10 10 CECE CCN(C)c1nnc(C)n1Cc1ccc2c(c1)CCCN2C 1764709876 OCJPWLQPICRGMR-UHFFFAOYSA-N 299.422 2.473 10 10 CECE CCCOc1cc(N2CC[C@@](C)(O)C2)ccc1[N+](=O)[O-] 233250758 CVWOJTXCRWRDJL-CQSZACIVSA-N 280.324 2.345 10 10 CECE Nc1ccc(-n2nccc2NC(=O)C2[C@H]3CCC[C@H]23)cc1 161566550 RPPKRCJVJUSAPZ-STQMWFEESA-N 282.347 2.439 10 10 CECE Oc1cc(F)ccc1CN1CCOc2ncccc21 2139791212 XVUHFZIKTYJFGT-UHFFFAOYSA-N 260.268 2.325 10 10 CECE CCN(CC(=O)NC(C)C)[C@@H](C)c1c(O)cccc1O 233459427 WFBKPEFHBXYWSH-NSHDSACASA-N 280.368 2.005 10 10 CECE O=C1N=C(NO)S/C1=C\c1cccc(Br)c1 6191551 KIUXYBPKDVNUOZ-YVMONPNESA-N 299.149 2.398 10 10 CECE C[C@@H]1CC[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)O1 159818447 YERSLWUBCUIJKI-BDJLRTHQSA-N 289.375 2.455 10 10 CECE Cc1cc2c(cc1N(C)[C@@H]1CNC(C)(C)C1)OCO2 258778440 KPLFZVSAZHGRNF-NSHDSACASA-N 262.353 2.300 10 10 CECE CC(=O)CCN(C)c1ccc2c(c1)CCC(=O)N2C 258832619 BJBHGPIHIIYZTM-UHFFFAOYSA-N 260.337 2.011 10 10 CECE Cc1cccc(=O)n1C(C)(C)C(=O)Nc1ccc(N)cc1 33512782 MEDQBIWZLVQTIH-UHFFFAOYSA-N 285.347 2.113 10 10 CECE COc1ccc([C@H](C)NC2CCOCC2)c(O)c1 36308464 XPWHISSURCZJCC-JTQLQIEISA-N 251.326 2.230 10 10 CECE CN(C)c1cccc(NCc2ccc(O)c(O)c2O)c1 234269024 GXMWEXMMSWXPPZ-UHFFFAOYSA-N 274.320 2.482 10 10 CECE OC[C@H]1CC[C@@H](NCc2cccc(Cl)c2O)C1 1942376327 YYPBXUKXPBBQFX-GXSJLCMTSA-N 255.745 2.296 10 10 CECE CCCN1CC(NCc2ccc(Cl)cc2O)C1 1942491790 PUEYNWIFFUFYSD-UHFFFAOYSA-N 254.761 2.229 10 10 CECE Nc1ccc(NC(=O)CSc2cncs2)cc1 1944161268 GJNOURDKMKLELQ-UHFFFAOYSA-N 265.363 2.456 10 10 CECE CC[C@@H](CN(C)c1ccc(OCCN(C)C)cc1)OC 2143458157 VQNIMNHWNQUABI-HNNXBMFYSA-N 280.412 2.488 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1C[C@H]2C[C@@H]2CO1 1875662837 NGENGDYYRLNGCR-UISBYWKRSA-N 269.291 2.185 10 10 CECE N[C@]12CC[C@H]1CN(Cc1ccc(Br)cc1O)C2 1946409667 ANBXTIOQYNKMMF-GWCFXTLKSA-N 297.196 2.078 10 10 CECE Cc1cccc(O)c1CN1CCC[C@H](CC(=O)O)C1 1963063875 IERCAVDZSCYQJZ-GFCCVEGCSA-N 263.337 2.387 10 10 CECE C[C@H](O)c1cc(F)c(N2CCCC[C@@H]2CO)c(F)c1 1880486313 NQEOXWQJJFMFQX-GXSJLCMTSA-N 271.307 2.369 10 10 CECE C[C@H](O)c1cc(F)c(N2CCCC[C@@H](O)C2)c(F)c1 1880480672 YHEDICHNOFTBQU-GXSJLCMTSA-N 271.307 2.369 10 10 CECE C[C@H](N)c1cc(F)c(N(C)[C@H](C)C[S@@](C)=O)c(F)c1 1880924672 AIRDSZFHGZLEHH-BLBZPCKPSA-N 290.379 2.188 10 10 CECE CN[C@H](C)c1cc(F)c(N2CC3(COC3)C2)c(F)c1 1880929631 XVCLYJZNBTZDGV-SECBINFHSA-N 268.307 2.082 10 10 CECE CCN(Cc1ccc(O)cc1O)[C@@H]1CCC[C@H]1CN 249717261 VWIGJJKMJBSKBZ-SMDDNHRTSA-N 264.369 2.047 10 10 CECE C[C@H](NC[C@@H]1CCCOC1)c1ccc(O)cc1O 38044102 RZSCIBSXHDNFSM-QWRGUYRKSA-N 251.326 2.175 10 10 CECE CC(C)(CC(=O)NCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1963817943 SASZXTBRFFCSAA-UHFFFAOYSA-N 285.348 2.106 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H]3OCCC[C@@H]23)cc1 249958476 JKTBDALNCIHXEQ-ARFHVFGLSA-N 260.381 2.410 10 10 CECE CO[C@H]1C[C@@H](N(C)c2ccc(CO)cc2Cl)C1 1950456980 JUSADWGYKGFFBT-PHIMTYICSA-N 255.745 2.446 10 10 CECE CC[C@@H]1CNCC[C@@H]1NCc1ccc(N(C)C)cc1 1964667816 MJKBYMIFYCSXKL-ZBFHGGJFSA-N 261.413 2.230 10 10 CECE CC(C)[C@H](O)CN(C)c1ccc(CO)c(Cl)c1 2002415814 PZWGGOWVJCMIMD-CYBMUJFWSA-N 257.761 2.285 10 10 CECE OC[C@H](CNCc1cccc(Cl)c1O)C(F)(F)F 1967743806 SMBZGVMOLAUJJV-QMMMGPOBSA-N 283.677 2.306 10 10 CECE COc1cc(Cl)cc(CN[C@@H](CO)C2(C)CC2)c1O 1967841361 IFBSGBWSULJHAC-LBPRGKRZSA-N 285.771 2.305 10 10 CECE CC1(C)CCN(Cc2ccc(F)cc2O)C[C@@H]1C(=O)O 1968207241 ISWYRGMTSFQYME-GFCCVEGCSA-N 281.327 2.464 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](N)C1CCCC1 2149307755 GHVFASFMOCVGHF-XHDPSFHLSA-N 276.380 2.429 10 10 CECE COc1ccc([C@@H](C)NCCc2cnn(C)c2)c(O)c1 148804414 BRABOUGJQALRNK-LLVKDONJSA-N 275.352 2.028 10 10 CECE COc1ccc(N2CC[C@H](C)[C@H](CN)C2)c([N+](=O)[O-])c1 253180851 DVZGCGNUSHEDHR-WDEREUQCSA-N 279.340 2.025 10 10 CECE C[C@H](F)[C@@H]1CCCN1Cc1cc2c(cc1O)OCO2 1972795974 GZVZJUJVGARXPH-ONGXEEELSA-N 267.300 2.443 10 10 CECE Nc1ccc(OCCC(=O)N2CC[C@H]2C2CCC2)cc1 2144902651 ZRSRFSZURAGMLL-HNNXBMFYSA-N 274.364 2.439 10 10 CECE NCc1ccc(N2CCC3(CCC(=O)N3)CC2)cc1Cl 2145417735 CPYBURCBIOAOJZ-UHFFFAOYSA-N 293.798 2.048 10 10 CECE C[C@@H](c1ccccc1O)N(C)S(=O)(=O)c1ccn(C)c1 2145852301 WLABPKKLXOCNPD-NSHDSACASA-N 294.376 2.112 10 10 CECE Cc1cccc(CN[C@H](CC(C)C)C(=O)N(C)C)c1O 158121691 PGKTUQBAGRFOSD-CQSZACIVSA-N 278.396 2.293 10 10 CECE CCC[C@H](Nc1c(N)cccc1Br)C(N)=O 1987127184 BLDSRFSESMVSER-VIFPVBQESA-N 286.173 2.097 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3CCN(C)C[C@@H]3C2)c1 2148886582 AQPXEAWASDBXJQ-GDBMZVCRSA-N 274.408 2.474 10 10 CECE CC(C)C[C@H]1CCN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2148951236 MVHLESAWFZMNQU-YMTOWFKASA-N 278.327 2.436 10 10 CECE COC[C@@H]1CN(c2ccc(CO)c(Cl)c2)C[C@@H]1COC 2149259285 KZRUPACCPXTUIL-BETUJISGSA-N 299.798 2.178 10 10 CECE CCCN(CC(=O)NC)c1ccc(CNC)cc1Cl 164002522 ZXMBVSARUCFJRG-UHFFFAOYSA-N 283.803 2.022 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)CC(F)(F)CO 2150981925 PMMVJKIOBWEUEA-UHFFFAOYSA-N 284.350 2.311 10 10 CECE Cc1cc(NCCc2ccc(N)cc2)n2ncnc2c1 40675835 IURINSVWOPZVFL-UHFFFAOYSA-N 267.336 2.275 10 10 CECE OCc1ccc(N2CC=CC[C@@H]2CO)c(Br)c1 2007528396 GIMKZNLXJUUJIS-LLVKDONJSA-N 298.180 2.069 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCn1cc(Br)cn1 2009447608 ZJIHYZOKWNEEOP-JTQLQIEISA-N 299.176 2.420 10 10 CECE CC1(C)SC[C@H]1NCc1cc2c(cc1O)OCO2 282696169 LNUYGGUDWJEMSM-GFCCVEGCSA-N 267.350 2.105 10 10 CECE COc1ccc(O)c([C@@H](C)NCC23CC(CN2C)C3)c1 2152102973 JDBLZEPDGJMUMO-OPGSHWCFSA-N 276.380 2.146 10 10 CECE CCCOc1cc(N2CC(C)(CN)C2)ccc1[N+](=O)[O-] 2152235169 DVKUNVJONCCJGI-UHFFFAOYSA-N 279.340 2.169 10 10 CECE C[C@@H]1CCOC[C@@H]1OC(=O)CCOc1ccc(N)cc1 2152507817 HSNRAIRXSWEASM-RISCZKNCSA-N 279.336 2.006 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]2[C@H](C)O)c(Cl)c1 2011147403 WDYYVYQNHPQJFN-HOTUBEGUSA-N 254.761 2.319 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C1CC(C(F)F)C1 2153230988 OFMPAGCIEFTPJK-UHFFFAOYSA-N 283.322 2.183 10 10 CECE Nc1ccc(CCC(=O)Nc2cnn(C3CC3)c2)cc1 2153309578 IWUBILHTOUDUHQ-UHFFFAOYSA-N 270.336 2.372 10 10 CECE CP(C)(=O)CCNC(=O)Nc1ccc(N)cc1 2018333449 WVOKWUJUDWYRBM-UHFFFAOYSA-N 255.258 2.013 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@]1(N)CCSC1 2153966054 NOYDAENPMTUTNE-IAQYHMDHSA-N 294.420 2.136 10 10 CECE CCNCc1ccc(OCCC(=O)NC(C)C)c(C)c1 2155012180 FIMXGMJCJNCGRE-UHFFFAOYSA-N 278.396 2.398 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](F)[C@H](OC)C2)cc1 2029819426 XNWDLOIVWFMLDG-DDTOSNHZSA-N 252.333 2.140 10 10 CECE C[C@H](O)c1ccc(N2CC3(CN(C)C3)C2)cc1Cl 2034815261 PABVVQLCWSQUQY-JTQLQIEISA-N 266.772 2.145 10 10 CECE C[C@H](N)c1ccc(N2CC3(CN(C)C3)C2)c(Cl)c1 2034801659 GTCDZYPHALWBIN-JTQLQIEISA-N 265.788 2.112 10 10 CECE CC(C)Oc1cncc(NCc2ccc(N)cc2)n1 71176401 VXFHKKCKUHYHQD-UHFFFAOYSA-N 258.325 2.458 10 10 CECE Cc1ccc(O)c(CN[C@@H](C)C(=O)N2CCCCC2)c1 71408159 DAFRGHWFXNAALF-ZDUSSCGKSA-N 276.380 2.191 10 10 CECE COc1ccc(O)c([C@H](C)NCCc2cncn2C)c1 401891965 YCPKRNBIYQMEDL-NSHDSACASA-N 275.352 2.028 10 10 CECE C[C@@H]1CC[C@@H](N[C@H](C)c2c(O)cccc2O)CO1 402087726 ZAEWNJNXEQWLRY-GMTAPVOTSA-N 251.326 2.316 10 10 CECE Oc1c(F)cccc1CN1CCN(CCCF)CC1 403020523 XDGHAJZQVIBUQP-UHFFFAOYSA-N 270.323 2.009 10 10 CECE Cc1cc(N2CCC[C@H](CN(C)C)C2)ccc1CN 405045284 RMWYUUOKGVPHOA-CQSZACIVSA-N 261.413 2.232 10 10 CECE CNCc1ccc(N2CC[C@@H](OCCOC)C2)c(Cl)c1 2158686036 WJCRUDFCCFTBDK-CYBMUJFWSA-N 298.814 2.301 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)cc1 312508770 DENMEQZHFOVRTM-OYARWULLSA-N 272.392 2.302 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]4CC[C@@]43C)ccc21 2157294795 NROUHIZZMGYPSR-OOVXXXAESA-N 271.364 2.278 10 10 CECE CN1[C@H]2CC[C@H]1CC(NC(=O)Nc1ccc(N)cc1)C2 322881323 BMKQGHZNNGGXFH-KBPBESRZSA-N 274.368 2.016 10 10 CECE CCn1nc(C(C)C)cc1C(=O)NCCCN=[N+]=[N-] 701296927 OJUFYCGRMOWRMW-UHFFFAOYSA-N 264.333 2.457 10 10 CECE C[C@@H]1CCCN(C(=O)NCCOc2ccc(N)cc2)C1 91972352 KZZKCHCHKNUBRZ-GFCCVEGCSA-N 277.368 2.089 10 10 CECE CCCN1CC[C@@H](NCc2ccc(F)c(F)c2O)C1 703233152 KNNQNDSZVGHNPC-LLVKDONJSA-N 270.323 2.244 10 10 CECE CCN(CC)c1ccc([C@@](C)(N)[C@H](C)S(C)(=O)=O)cc1 2170652937 PCMUMBMQBUUAGA-WFASDCNBSA-N 298.452 2.140 10 10 CECE CC[C@@]1(C)COCCN1c1ccc(OC)cc1N 707351043 GHQKSTXVNZZHEA-AWEZNQCLSA-N 250.342 2.283 10 10 CECE c1cnn(C2CN(c3ccc(CNC4CC4)cc3)C2)c1 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RXHAEDBHPXFUEQ-JKSUJKDBSA-N 279.380 2.220 10 10 CECE CCNCc1ccc(N2C[C@@H]3CCCN3C[C@H]2C)cc1 250161180 GHDCSYSKCKPUFJ-PBHICJAKSA-N 273.424 2.469 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@H]3CCC[C@H]32)cc1O 251508540 HRPJPLXKTAQSLG-ZBINZKHDSA-N 262.353 2.170 10 10 CECE C[C@@H](NCCN1CCCOC1=O)c1cc(F)ccc1O 1969511759 VNVLYACHZHIOON-SNVBAGLBSA-N 282.315 2.024 10 10 CECE Nc1ccc(O)c(CNC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)c1 252448207 TZFQXYUYNRGLIQ-SDDRHHMPSA-N 274.364 2.417 10 10 CECE OC[C@H](NCc1ccc(F)c(F)c1O)[C@@H]1CC=CCC1 1971223418 XLVUQVGXHRAOBG-MFKMUULPSA-N 283.318 2.477 10 10 CECE Oc1c(CN[C@@H]2C[C@@H]3OCCC[C@H]32)ccc(F)c1F 1972246815 WSDOYPXBOSCTFX-WCQGTBRESA-N 269.291 2.328 10 10 CECE Cc1cc(N2CCOC[C@H]2C(F)(F)F)ccc1CCN 2150363144 SUUXTDQWTYUFSI-ZDUSSCGKSA-N 288.313 2.264 10 10 CECE COc1cc(N)c(N2C[C@@H](C)OCC[C@H]2C)cc1OC 2148899832 SMFWFLOGKBTDPC-GHMZBOCLSA-N 280.368 2.290 10 10 CECE COc1ccc(N2CCC[C@](N)(CF)CC2)cc1 258183765 MVIZNNSADXEIFY-CQSZACIVSA-N 252.333 2.353 10 10 CECE Cc1ccc(O)c(CN[C@@H](C)[C@H]2CCCS(=O)(=O)C2)c1 2146111880 KHZVGWZIPOBAOF-STQMWFEESA-N 297.420 2.004 10 10 CECE CCOC(=O)CC1(c2c(O)c(O)cc(OC)c2F)CC1 260659296 LEHHSHHZZRRERH-UHFFFAOYSA-N 284.283 2.230 10 10 CECE COCCNCc1ccc(N(C)[C@@H]2CCOC2)c(Cl)c1 160110976 FEVFUPQVLTVIAO-CYBMUJFWSA-N 298.814 2.301 10 10 CECE C[C@@H](NC[C@@H]1CN2CCC1CC2)c1c(O)cccc1O 2150797749 MPHLNFRYLJGGOE-DGCLKSJQSA-N 276.380 2.090 10 10 CECE COC[C@@H]1[C@@H]2CCN(CCCc3ccc(N)cc3)C[C@H]21 2149558119 RFWLBYSKGDIFFZ-BRWVUGGUSA-N 274.408 2.416 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@](O)(C(C)C)C2)cc1O 2150763401 IFJPLUQXMOCCMZ-BLLLJJGKSA-N 278.396 2.270 10 10 CECE C[C@H](O)c1ccc(N2CCC23COC3)cc1Cl 2004448459 LMHXMNFPCGMKCC-VIFPVBQESA-N 253.729 2.372 10 10 CECE COCCN(C(=O)Cc1ccc(N)cc1)[C@@H](C)C1CC1 37814715 VLSNFXJOMVFUGQ-LBPRGKRZSA-N 276.380 2.085 10 10 CECE CNCc1ccc(N2CC3(CCO3)C2)c(Br)c1 2004422524 KCRDAFKZASJOMX-UHFFFAOYSA-N 297.196 2.148 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1nc[nH]n1 37919362 KVXDRHYKJKSZLI-UWVGGRQHSA-N 258.325 2.157 10 10 CECE COC[C@@]1(OC)CCCN(c2ccc(CO)cc2C)C1 2151854833 BOZUZRLXNGRDQS-MRXNPFEDSA-N 279.380 2.119 10 10 CECE CN[C@H](c1cnc(OC)s1)c1ccccc1O 2000301888 MYGKWUVXSSYBAB-NSHDSACASA-N 250.323 2.166 10 10 CECE Nc1ccc(O)c(CN2CCO[C@@H]3CCCC[C@@H]32)c1 43424002 RKAKYRZQBFMKJK-DZGCQCFKSA-N 262.353 2.118 10 10 CECE c1cc(N2CCCNCC2)ccc1OC[C@@H]1CCCO1 43461574 YKRMSALEAYLYLM-INIZCTEOSA-N 276.380 2.044 10 10 CECE OCc1cc(F)c(N2CC[C@@H]([C@@H]3CCCO3)C2)c(F)c1 2153070035 KSYSAHZPKXCEFV-RISCZKNCSA-N 283.318 2.462 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@H]4CC[C@H](C4)C3)ccc21 2153256269 DHPIXIXLMIPFFP-RWSFTLGLSA-N 271.364 2.136 10 10 CECE CNC(=O)CCCOc1ccc(CNC(C)C)cc1C 2155011062 PJBVKRIJRCZSPO-UHFFFAOYSA-N 278.396 2.398 10 10 CECE CO[C@]1(CN(C)c2ccc(N)cc2)CCSC1 2013415258 QIENDEACFYEAIW-ZDUSSCGKSA-N 252.383 2.227 10 10 CECE CN(C[C@H]1CCCCO1)c1cc2c(cc1N)OCCO2 48947433 FWTDTAZIROQTBV-LLVKDONJSA-N 278.352 2.045 10 10 CECE COc1cccc(O)c1CN[C@H]1CCCC[C@H]1N(C)C 2160710965 BFAICGGTDQIQOO-UONOGXRCSA-N 278.396 2.363 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccnc(Cl)c2F)C1 2024147122 LKJPRBPDUFRBCU-UHFFFAOYSA-N 255.640 2.009 10 10 CECE CO[C@H]1CCCC[C@H]1NCc1ccc(O)c(O)c1 2027932923 NALSQTOZOFEUOG-RISCZKNCSA-N 251.326 2.145 10 10 CECE CCc1nnc([C@H](O)CCc2ccc(N)cc2)s1 2029163673 UAJRYPREPCKWPY-LLVKDONJSA-N 263.366 2.349 10 10 CECE C[C@H]1CN(c2ccc(CO)cc2F)[C@@H](C)CCO1 2031695742 WWGXETSYFKKQCG-QWRGUYRKSA-N 253.317 2.322 10 10 CECE COc1ccc(CN[C@@H](C)CNC(C)C)cc1C 2033020025 VUKUWARJNZDXBR-ZDUSSCGKSA-N 250.386 2.480 10 10 CECE CC[C@@H](N)c1ccc(N(C)CC(F)(F)CO)cc1 2033568931 MWZUKNYSMOMZRY-GFCCVEGCSA-N 258.312 2.160 10 10 CECE O=C(c1cccc(O)c1O)N1CCCC[C@H](F)C1 2034824655 LJLCWNUCILTQOO-VIFPVBQESA-N 253.273 2.062 10 10 CECE CNCc1ccc(N(CCO)CC(C)C)c(C)c1 2036717555 KFNSDVPWVBUXMC-UHFFFAOYSA-N 250.386 2.169 10 10 CECE CC(C)[C@H](N)CCN(C)[C@H](C)c1c(O)cccc1O 300439449 FJUSPXLNICSLGA-VXGBXAGGSA-N 266.385 2.464 10 10 CECE CC[C@H](NCc1cccc(Cl)c1O)C(=O)N(C)C 2038816578 XOIPMAAHZANFBG-NSHDSACASA-N 270.760 2.002 10 10 CECE CN(C)[C@@H]1CC[C@H]1NCc1ccc(N2CCCC2)cc1 2157700406 LSUIOLLBXORYJR-IAGOWNOFSA-N 273.424 2.469 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@H](C4CC4)C3)ccc21 400154350 GJLXDSGHIQWZMO-XHDPSFHLSA-N 271.364 2.136 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCCN3)C[C@@H](C)S1(=O)=O 400836117 IBEMZUUEDJXGCV-VXGBXAGGSA-N 294.420 2.057 10 10 CECE Oc1ccc(CNC[C@H]2C[C@H]3C=C[C@H]2CC3)c(O)c1O 402454281 AMYDQLYMZPETFX-GMXVVIOVSA-N 275.348 2.495 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C2CCSCC2)C1 403648027 SHGVHEFSMBWFOC-JTQLQIEISA-N 254.359 2.431 10 10 CECE CCc1nc(C)c(CNCc2ccc(O)c(O)c2)o1 311843337 NWXFJBCTJSYRLV-UHFFFAOYSA-N 262.309 2.246 10 10 CECE Nc1ccc(-n2ccc(C(=O)OCCCCF)n2)cc1 312542686 FUJXDSXNHAXSHY-UHFFFAOYSA-N 277.299 2.361 10 10 CECE CCc1nn(C)c(NCc2ccc(N(C)C)cc2)c1N 2160467435 HIZFFLYTCIURGF-UHFFFAOYSA-N 273.384 2.243 10 10 CECE OCc1cc(F)c(N2CCC[C@H]2c2ncon2)c(F)c1 2160433065 IOIUHMUHDLKQSK-NSHDSACASA-N 281.262 2.182 10 10 CECE CCCNCc1ccc(OC)c(CS(=O)(=O)CC)c1 81924725 XPPGOIAXLQTLOI-UHFFFAOYSA-N 285.409 2.130 10 10 CECE CCN(Cc1c(O)cccc1OC)[C@@H]1CCC[C@@H]1CN 2160725534 VCQXOGFTCBHGJZ-TZMCWYRMSA-N 278.396 2.350 10 10 CECE CCN(CC)C(=O)CCCN(C)c1ccc(CN)cc1 2161265832 IORILABDKPZKJW-UHFFFAOYSA-N 277.412 2.230 10 10 CECE Nc1ccc(CCN2CCO[C@H](c3ccco3)C2)cc1 2171748855 GGBRCHYSMXXOQK-INIZCTEOSA-N 272.348 2.478 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@]23COC[C@@H]2C3(F)F)cc1 2161870408 JTMAYTDOZISTOA-DDTOSNHZSA-N 282.334 2.424 10 10 CECE COc1cc(C(=O)NCCN=[N+]=[N-])cc(Cl)c1OC 701304899 DNWPWVMTNNBXTK-UHFFFAOYSA-N 284.703 2.397 10 10 CECE CC(=O)c1ccc(O)c(CN(C)[C@@H]2COC[C@H]2C)c1 688235314 FZEKQXAPLIELQI-QMTHXVAHSA-N 263.337 2.062 10 10 CECE CN(C)c1ccc([C@H](O)[C@]23C[C@@H]2[C@H]2CC[C@H](C3)N2)cc1 2163063913 UAQXDCFKBZLMPK-FYNNLBNCSA-N 272.392 2.317 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@](C)(O)C(C)(C)OC 2163132345 AWTGMWUDXNQXOY-GDBMZVCRSA-N 280.412 2.189 10 10 CECE C[C@H](c1cn(C)cn1)N(C)C(=O)Nc1ccc(N)cc1 710136285 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CC[C@H](N)c1ccc(N2C[C@H]3C(N(C)C)[C@@H]3C2)cc1 384681504 DTAPXIXKVDIIGN-KFWWJZLASA-N 259.397 2.093 10 10 CECE CCNCc1ccc(N2C[C@H]3COC[C@@H]3C2)c(F)c1 718237928 YYVJDGXGCCYYLX-STQMWFEESA-N 264.344 2.018 10 10 CECE Nc1ccc(N2CCC[C@](O)(C(F)(F)F)C2)cc1 718901826 BPSXESXXGXQRGE-LLVKDONJSA-N 260.259 2.162 10 10 CECE C[C@@H]1CN(C)C[C@@H]1NCc1c(O)cccc1Cl 722259936 AKUGOXNCBXAYHA-SKDRFNHKSA-N 254.761 2.085 10 10 CECE CO[C@H]1CC[C@@H]1N(C)c1ccc([C@@H](C)O)cc1F 724148534 URZJERDXEWRQSR-IIMNLJJBSA-N 253.317 2.493 10 10 CECE C[C@H]1C[C@@H](C)[C@@H](CN)CN1[C@H](C)c1ccc(O)cc1O 397350276 BIHUGNADOQJHEW-XQHKEYJVSA-N 278.396 2.464 10 10 CECE C[C@@H]([C@@H]1CC1(C)C)N(C)S(=O)(=O)Cc1ccc(N)cc1 397735073 XLYKGSVIBKPXIG-FZMZJTMJSA-N 296.436 2.465 10 10 CECE C[C@@H]1C[C@@H](CO)CN(c2ccc(CN)c(Cl)c2)C1 398783076 KXHKAUUYPFWHQB-GHMZBOCLSA-N 268.788 2.253 10 10 CECE C[C@@H]1CC[C@@H](CNCc2cc3c(cc2O)OCO3)OC1 2174061994 ZQTIZQWQHBQWBJ-PWSUYJOCSA-N 279.336 2.026 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H](O)CCC23CCC3)cc1O 2174535051 LYUIODODGILJPF-DGCLKSJQSA-N 276.380 2.296 10 10 CECE CC(C)NCc1ccc(N2CCN(C)[C@@H]3CC[C@H]32)cc1 2168355045 NKKIPGBTEGWXMU-IAGOWNOFSA-N 273.424 2.467 10 10 CECE CCNC(=O)c1ccnn1Cc1cccc(Cl)c1O 2069939296 YZBAYXLOHWZLRV-UHFFFAOYSA-N 279.727 2.040 10 10 CECE CSc1cnn(Cc2ccc([N+](=O)[O-])cc2O)c1 2070219313 QVCWKVBJUGBIJN-UHFFFAOYSA-N 265.294 2.267 10 10 CECE CCOc1cccc(CNC[C@@H]2[C@H]3CCCO[C@@H]23)c1O 2176446401 AXIDPFUTSGICIJ-XJKCOSOUSA-N 277.364 2.306 10 10 CECE C[C@@H](C[C@H](C)C(=O)N(C)Cc1ccccc1O)C(=O)O 2176682080 JZFJUXNINPBPHG-QWRGUYRKSA-N 279.336 2.098 10 10 CECE O=C(O)[C@@H]1CCCN[C@@H]1c1ccc(N2CCCC2)cc1 2176728072 AYTSUFVKOOHKDH-HUUCEWRRSA-N 274.364 2.412 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N1CCN2C(=O)OC[C@H]2C1 2170719615 DDLWEFZNLPJIED-MWLCHTKSSA-N 296.754 2.243 10 10 CECE Nc1ccc(NC(=O)N2CCC[C@@]3(CCOC3)C2)cc1 2171165015 IFCYLFZQFPAPSE-OAHLLOKOSA-N 275.352 2.303 10 10 CECE Nc1ccc(NC(=O)N2CCC[C@]3(CCOC3)C2)cc1 2171165014 IFCYLFZQFPAPSE-HNNXBMFYSA-N 275.352 2.303 10 10 CECE 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CCc1nsc(CNCc2cc(OC)ccc2O)n1 2273038090 GEOKVVBWRQSFJZ-UHFFFAOYSA-N 279.365 2.105 10 10 CECE CCCN[C@@H](c1ccccc1O)c1ncncc1F 2273706675 SCOTUOSJHRZZIH-ZDUSSCGKSA-N 261.300 2.410 10 10 CECE CC[C@@H](C)[C@H](NCc1ccc(Cl)cc1O)C(N)=O 2264150409 RLUAWNNTWJVTTB-PELKAZGASA-N 270.760 2.035 10 10 CECE OCc1ccc(N2CCC[C@H](OCC(F)F)C2)cc1 2264577906 QLKJVTYNQBQZHN-ZDUSSCGKSA-N 271.307 2.429 10 10 CECE Cc1cc(N2CC(O)(C(F)(F)F)C2)ccc1[C@H](C)N 2269666636 MGMLRNXERSZFCK-VIFPVBQESA-N 274.286 2.128 10 10 CECE N[C@@H]1C[C@H]2CC[C@H]1C[C@H]2NCc1ccc2c(c1)CCO2 2284884204 VJYVDJRPLJCQGF-SJXGUFTOSA-N 272.392 2.227 10 10 CECE N[C@H]1C[C@H]2CC[C@H]1C[C@H]2NCc1ccc2c(c1)CCO2 2284884203 VJYVDJRPLJCQGF-LQKXBSAESA-N 272.392 2.227 10 10 CECE Cc1cc(N(CC(N)=O)C2CCCC2)ccc1[C@@H](C)O 2285164879 NSLXQYHPVPLHFE-GFCCVEGCSA-N 276.380 2.283 10 10 CECE C[C@H](CF)N(C)[C@@H](CN)c1ccc2c(c1)CCCN2C 2285704401 ABOJSDVZECEIGA-WBMJQRKESA-N 279.403 2.359 10 10 CECE COCCNCc1ccc(OCC[C@H]2CCO2)c(C)c1 2296027021 LQSJDZACNGNFCM-OAHLLOKOSA-N 279.380 2.289 10 10 CECE NC[C@@]12C[C@@H]1CN(c1ccc(OCC(F)(F)F)cc1)C2 2288268317 QYTCGNYNCVKSPP-ZWNOBZJWSA-N 286.297 2.413 10 10 CECE Oc1ccc(Cl)cc1CN1CCOC[C@H](F)C1 2299883683 UNACDAVRFIRGNN-LLVKDONJSA-N 259.708 2.216 10 10 CECE COc1ccc(C)cc1N=NN1CCC(C(N)=O)CC1 2318775691 GRDIDEMHXWYAJY-UHFFFAOYSA-N 276.340 2.200 10 10 CECE CC1(C)[C@H]2CO[C@]1(CN1CC[C@@H](CN=[N+]=[N-])C1)C2 2313302865 SUVRRCMSSBAKLN-LOWVWBTDSA-N 250.346 2.434 10 10 CECE CC(C)S(=O)(=O)N(C)Nc1nc2ccccc2s1 2317484343 FEJXKYWWNCFDED-UHFFFAOYSA-N 285.394 2.293 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@H]1CCO[C@@H]1C 2329488789 IIAFKHUTLNATOQ-XFJVYGCCSA-N 260.381 2.364 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NS(=O)(=O)C[C@H]1CC[C@@H](F)C1 2333612186 HKAXHDJENBTPMK-ZRUFSTJUSA-N 290.364 2.275 10 10 CECE COc1cccc(CN[C@H]2C[C@@]3(C)CO[C@@H]2C3)c1O 2334544672 QMZQZXXPKQUARU-NJZAAPMLSA-N 263.337 2.058 10 10 CECE OCc1ccc(N2C[C@H]3C[C@H]2C[C@H]3O)cc1C1CC1 2339144584 ZIIWSSZABSMDJF-IVMMDQJWSA-N 259.349 2.016 10 10 CECE CC(=O)N(C)CCN(C)[C@H](C)c1cc(C)ccc1O 2339456800 UOHZRDYDBPXFQY-GFCCVEGCSA-N 264.369 2.172 10 10 CECE CC1(C)C[C@H]1C(=O)N1CCc2cc(O)c(O)cc2C1 2341193456 DAMZHLMSLYYCGU-NSHDSACASA-N 261.321 2.029 10 10 CECE CC(=O)c1ccc(O)c(CN(C)[C@H](CO)C(C)C)c1 2341317940 GCOUWSPBDWNDMC-CQSZACIVSA-N 265.353 2.044 10 10 CECE C[C@@H]1CC2CC(C(=O)N3CC[C@@H](CN=[N+]=[N-])C3)(C2)O1 2342229983 MVYGPCSDYTTWMN-CFGSLIKFSA-N 264.329 2.103 10 10 CECE O=C(N[C@H]1C[C@@H]2C[C@H]1CC2(F)F)c1ccc(O)c(O)c1 2354288935 JAODQKFSONWDPK-GUBZILKMSA-N 283.274 2.261 10 10 CECE O=C1Nc2cc(N3C[C@@H]4C[C@H]3[C@@H]3C[C@@H]43)c(Cl)cc2[C@H]1O 2354424050 MHOBXZADLAXING-VVDJIFHRSA-N 290.750 2.170 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@]34C[C@@H](N)C[C@@H]3C4)ccc21 2354608891 NBWWJBBODOUDQO-WTTBNOFXSA-N 272.392 2.230 10 10 CECE CN(C[C@H]1C[C@@H]2CC[C@H]1O2)C(=O)Nc1ccc(N)cc1 2355004542 HURJKGCNXSVHPC-DDTOSNHZSA-N 275.352 2.300 10 10 CECE O=C(NC1=NN(c2ccccc2)C(=O)C1)c1cccc(F)c1 8906442 OWINIFPQVMPGLA-UHFFFAOYSA-N 297.289 2.306 10 10 CECE CN1CCCc2cc([C@H](NC3CCCC3)C(N)=O)ccc21 50287651 JNEDAOFLWKNCHS-INIZCTEOSA-N 287.407 2.128 10 10 CECE CNCc1ccc(N2CCN(c3ccccn3)CC2)cc1 34823684 YHGPNZGPVLBEST-UHFFFAOYSA-N 282.391 2.128 10 10 CECE Cc1ccc(O)c(CN2CCC[C@@H](n3cncn3)C2)c1 179469779 QCHQLTIHFFNXEL-CQSZACIVSA-N 272.352 2.129 10 10 CECE CN(C[C@@]12CCC[C@@H]1C2)c1ccc2c(c1)NC(=O)[C@H]2O 2357112849 GYWXONOOJGXEAH-OOVXXXAESA-N 272.348 2.299 10 10 CECE C[C@H](N)c1ccc(N2CCC(O)CC2)cc1Cl 78902676 AFPZKMLZVRNQRM-VIFPVBQESA-N 254.761 2.321 10 10 CECE CC(C)c1cc(O)c([C@@H](N)CO)cc1Br 218861847 YCRTWTQJLVGGQZ-JTQLQIEISA-N 274.158 2.270 10 10 CECE C[C@@H]1CN(c2ccc([C@@H](C)N)cc2F)[C@H](C)CO1 35787004 PVTFGTXRDIRQEH-GMTAPVOTSA-N 252.333 2.459 10 10 CECE CN(CCN1CCCC1)c1ccc(/C=C\C(=O)O)cc1F 213972126 XULISDHKVOKFIL-ALCCZGGFSA-N 292.354 2.456 10 10 CECE O=C(O)[C@@H]1CCCCN1Cc1c(O)cccc1Cl 128808513 GVGLMDPMZXBXEK-NSHDSACASA-N 269.728 2.485 10 10 CECE [N-]=[N+]=NCCNS(=O)(=O)c1cccc(C(F)(F)F)c1 42012822 RBHWQHZUIURFMT-UHFFFAOYSA-N 294.258 2.294 10 10 CECE CS[C@@H]1CC[C@H](NCc2cccc(O)c2O)C1 226759018 BQSVUYMKAWDHCT-WDEREUQCSA-N 253.367 2.472 10 10 CECE CNCCc1ccccc1C(=O)NCc1ccccc1O 228421585 DXNQEXYUVFEZHN-UHFFFAOYSA-N 284.359 2.084 10 10 CECE CCn1cc(C[C@@H](NC)c2ccc(N(C)C)cc2)cn1 137549154 CBQLVPHEGRXOHB-MRXNPFEDSA-N 272.396 2.472 10 10 CECE C[C@@H]1CN([C@H](C)C(=O)Nc2ccc(N)cc2)CC(C)(C)O1 223341876 RKLKJUBDLPBWKP-VXGBXAGGSA-N 291.395 2.095 10 10 CECE CCc1nnc(C)cc1C(=O)NCCCCN=[N+]=[N-] 231730630 PALMYFSMMLLQAJ-UHFFFAOYSA-N 262.317 2.168 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1cc(F)ccc1C 234562821 BADSKHAEHOKAKP-LLVKDONJSA-N 266.276 2.248 10 10 CECE CC[C@H]1COCCN1c1ccc(CN)c(F)c1F 234097099 OMNXJHLMJKOWTD-JTQLQIEISA-N 256.296 2.039 10 10 CECE C[C@@H]1OCC[C@@H]1SCC(=O)c1ccc(O)c(O)c1 235297182 GNDFJGGBRYJADV-SDBXPKJASA-N 268.334 2.191 10 10 CECE O=C(O)C1(c2c(F)cc(O)c(O)c2Br)CC1 258598859 QZPWEQKMJXNVBN-UHFFFAOYSA-N 291.072 2.116 10 10 CECE CN(C)c1ccc(CN2CCN3CCC2CC3)cc1 377702023 TWDGLTFCZYFUMO-UHFFFAOYSA-N 259.397 2.033 10 10 CECE C[C@@H]1CCN(Cc2cc(Cl)ccc2O)[C@H]1C(=O)O 299987260 XJQFXEZKOHTZCU-PRHODGIISA-N 269.728 2.341 10 10 CECE CCCn1cc(NCc2cc3c(cc2O)OCO3)cn1 90191922 MZCOGOWVDWPOEB-UHFFFAOYSA-N 275.308 2.340 10 10 CECE COc1cc(C)c(N2C[C@H](OC)C[C@@]2(C)CN)cc1C 2162856449 JPPZDOVDZKFDQL-CJNGLKHVSA-N 278.396 2.255 10 10 CECE CC(C)Cn1cc([C@@H](O)c2ccc(N(C)C)cc2)nn1 2163079742 PLHUIWDCVVCMCR-HNNXBMFYSA-N 274.368 2.082 10 10 CECE CC(C)OCC[C@@H](NN)c1ccc2c(c1)CCCN2C 2163095333 RPBOELQMAXNJNN-OAHLLOKOSA-N 277.412 2.389 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1CNCCSC1 2163098260 BKXGMPYJZRZESC-HOCLYGCPSA-N 292.448 2.273 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C2(CO)CC(C)C2)c1 2164587902 SDXXOZSCSFJUCH-UHFFFAOYSA-N 277.364 2.188 10 10 CECE CCC(CC)N1C(=O)CN(Cc2ccccc2O)C1=O 819165541 BIPMEZPHOFHVDD-UHFFFAOYSA-N 276.336 2.345 10 10 CECE CCC[C@@H](CCO)NCc1ccc2c(c1)CCN2C 716930863 RIYBAPFKKFIYAO-HNNXBMFYSA-N 262.397 2.320 10 10 CECE CNC(=O)CCN(C)c1ccc([C@@H](C)NC)cc1Cl 723191252 HPCNVESQEUXIAW-SNVBAGLBSA-N 283.803 2.193 10 10 CECE CCN1C[C@@H](N[C@H](C)c2c(O)cccc2O)C(C)(C)C1 722261707 JRJBJBSPWISHRQ-BXUZGUMPSA-N 278.396 2.479 10 10 CECE O=C(O)[C@@H]1CCN[C@@H]1c1cc2ccccc2cc1O 1952825283 IAPNPVUYYNFATN-RISCZKNCSA-N 257.289 2.281 10 10 CECE COc1ccc(N2CC[C@H](CNC(=O)C3(F)CC3)C2)cc1 843608036 JXOUPMQEGDGGCR-GFCCVEGCSA-N 292.354 2.140 10 10 CECE CC1(C)CCC[C@@](O)(C(=O)NCc2ccc(O)cc2O)C1 910944958 ZYKXAKUQCZADIY-INIZCTEOSA-N 293.363 2.045 10 10 CECE c1cc(COc2ccc(N3CCNCC3)cc2)co1 131855322 BUPWDGAMRNVZQN-UHFFFAOYSA-N 258.321 2.268 10 10 CECE O=C(NC[C@@H]1CCc2cccnc21)c1cc(O)cs1 857971368 QINKMJFBBABQTD-JTQLQIEISA-N 274.345 2.309 10 10 CECE Cc1ccc(C(=O)NC[C@@H]2C(C)(C)C2(F)F)c(O)c1O 856068911 XWOFWWHPQCOCFB-SECBINFHSA-N 285.290 2.427 10 10 CECE C[C@@H](NC[C@@H]1CC[C@H](N)C1)c1cc(F)ccc1O 925881721 FCTKLSICDHFYQA-FOGDFJRCSA-N 252.333 2.309 10 10 CECE CC[C@H](NCc1nc(COC)n[nH]1)c1ccc(C)cc1O 850514374 MNHFKAAXEXJSTN-LBPRGKRZSA-N 290.367 2.206 10 10 CECE Cc1ccc(O)c(CNCc2cc3n(n2)CCC3)c1 858239662 RTDMBCQFKFMRHO-UHFFFAOYSA-N 257.337 2.133 10 10 CECE CCC[C@H](O)CC(=O)NCc1ccc2cccnc2c1O 862027430 RUXLXPWEIIBMJW-ZDUSSCGKSA-N 288.347 2.108 10 10 CECE CCCC[C@@H](C)NC(=O)COc1ccc(N)cc1 50886657 XGLLJDVOYMOZST-LLVKDONJSA-N 250.342 2.343 10 10 CECE O=C(CC[C@H]1CCCO1)N1Cc2cccc(O)c2C1 871197950 AVXYDSVNKVWIOL-GFCCVEGCSA-N 261.321 2.194 10 10 CECE CC(C)N(CCC(=O)O)c1ccc2c(c1)OCO2 71719242 SRVCSEMRFKNABI-UHFFFAOYSA-N 251.282 2.105 10 10 CECE CC1(C)CO[C@@H](CCNCc2cc3c(cc2O)OCO3)C1 886307626 XWDGKMJWEACJDF-LBPRGKRZSA-N 293.363 2.416 10 10 CECE CC(C)[C@H]1C[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 784787926 TVHIIRPRKWTSTA-MNOVXSKESA-N 278.304 2.116 10 10 CECE CCCN(CCC)S(=O)(=O)N(C)c1ccc(N)cc1 702070071 GWFGHVRSZBLCBW-UHFFFAOYSA-N 285.413 2.072 10 10 CECE CN(C)c1ccc(CNCC[C@H]2CCCN2C)cc1 83449800 JZQXUYIOGZMBKD-MRXNPFEDSA-N 261.413 2.327 10 10 CECE CCN1C[C@H](C(C)C)NC[C@@H]1c1ccc(O)cc1O 83479595 IUECEYJLMIXGLO-ZIAGYGMSSA-N 264.369 2.089 10 10 CECE CCCCc1nnc([C@H](N)c2cccc(OC)c2O)o1 83581048 WSOJBUTZNPLCTR-GFCCVEGCSA-N 277.324 2.175 10 10 CECE Oc1ccc2c(c1O)CCN[C@H]2c1ccccc1F 83655939 RHKLEXXLQHLXFJ-CQSZACIVSA-N 259.280 2.472 10 10 CECE Oc1cc2c(cc1O)[C@H](CC1CCOCC1)NCC2 83724458 SSOQTXPDLALWDB-ZDUSSCGKSA-N 263.337 2.101 10 10 CECE CCS(=O)(=O)C1(CN[C@@H](C)c2ccc(C)cc2O)CC1 703545328 FKJRQINPGXOLAG-LBPRGKRZSA-N 297.420 2.319 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)Cc2ccsn2)cc1 705692482 ZHPWIOVHFXLXHE-HNNXBMFYSA-N 290.436 2.341 10 10 CECE CN(C)C1CC(NCc2c(O)cccc2Br)C1 706812847 CVPGVXZKDRLWJZ-UHFFFAOYSA-N 299.212 2.337 10 10 CECE CC[C@H](C[C@H](C)O)NCc1cc(F)cc(F)c1O 708421426 SJPOLVYRFNTKIA-GZMMTYOYSA-N 259.296 2.310 10 10 CECE CC[C@@H](NCCCc1nnc[nH]1)c1ccccc1O 80570145 NQTFDOGWNAOKLZ-GFCCVEGCSA-N 260.341 2.184 10 10 CECE CNCc1ccc(N2CCC[C@H](C)[C@@H]2CO)c(C)c1 688779599 SAQIXAPJBVTWLY-LRDDRELGSA-N 262.397 2.312 10 10 CECE CNCc1cc(F)c(N(C[C@@H](C)O)C2CC2)c(F)c1 691393031 XWLFMICZSHKJOO-SECBINFHSA-N 270.323 2.034 10 10 CECE CC[C@H]1CN[C@@H](C)CN1c1ccc2c(c1)CN(C)C2 689441397 CXQMIGIZJJKYRQ-WFASDCNBSA-N 259.397 2.209 10 10 CECE CCS(=O)(=O)CCNCc1c(O)ccc2ccccc12 69172928 HTQJCBBLVYRXAV-UHFFFAOYSA-N 293.388 2.070 10 10 CECE Oc1ccccc1CN[C@H]1CCCN2CCSC[C@H]12 718430293 AXTYMUYXPSDUNG-UONOGXRCSA-N 278.421 2.062 10 10 CECE C[C@H]1CSCCN1CCC(=O)Nc1ccc(N)cc1 70219105 AMPJATXOMBXHRR-NSHDSACASA-N 279.409 2.035 10 10 CECE CCn1nccc1[C@@H](NC)c1ccc(N(C)C)cc1 97186726 DMCUQTXQGZSMAX-HNNXBMFYSA-N 258.369 2.278 10 10 CECE CCC[C@@H](OC)C(=O)C(=O)CC(C)(C)CC(=O)OCC 1157101603 BPUGENPVSVMTFK-GFCCVEGCSA-N 286.368 2.309 10 10 CECE C[C@@H](N[C@H](CCO)C(F)(F)F)c1cc(O)ccc1O 1918555239 XLCWALQTFFYZON-RDDDGLTNSA-N 279.258 2.062 10 10 CECE O=C(CCCc1nccs1)NCc1c(O)cccc1O 1304053063 BDHZFLXDTSXECJ-UHFFFAOYSA-N 292.360 2.193 10 10 CECE COc1c(C)cccc1CNC(=O)c1cccc(O)c1O 1300116417 LKKAKGHSMVCECP-UHFFFAOYSA-N 287.315 2.345 10 10 CECE Cc1cccc(O)c1CN[C@@H](C)Cc1ccnn1C 2117693765 YKEDBFJXTBNAEU-LBPRGKRZSA-N 259.353 2.155 10 10 CECE C[C@@H](N[C@H]1CC[C@H](CO)CC1)c1cc(O)ccc1O 2118466683 WMCUCVBLELUFPK-IJLUTSLNSA-N 265.353 2.300 10 10 CECE Nc1ccc(OCCN2CCC23CC(CF)C3)cc1 2125801182 YOFWZQPAHNXKEU-UHFFFAOYSA-N 264.344 2.472 10 10 CECE COC[C@@H]1C=CCCN1c1ccc([C@H](C)N)c(O)c1 2125977306 YWBDOEXMYPCBBN-AAEUAGOBSA-N 262.353 2.193 10 10 CECE CN[C@@H](C)c1ccc(N2CCOC[C@H]2CF)c(F)c1 2126208017 RGXHRFKIFVHDBU-CMPLNLGQSA-N 270.323 2.281 10 10 CECE C[C@]1(CN)CCCN1c1ccc2c(c1)OC(F)(F)O2 2126302019 KSAKVUDFLCTRLO-GFCCVEGCSA-N 270.279 2.326 10 10 CECE C[C@@H](c1ccccc1O)N1CCN[C@@H](CC(F)F)C1 2120811033 CSUKGSAUQNNXHA-QWRGUYRKSA-N 270.323 2.382 10 10 CECE N[C@@H]1CCCc2cc(N3CCC[C@H](O)CC3)ccc21 2128272955 IQWZNQBOYJKCEG-GOEBONIOSA-N 260.381 2.374 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3N)C[C@@H]1CO 2128275736 WDDBHZKNYSTZLO-AXAPSJFSSA-N 260.381 2.087 10 10 CECE C[C@H]1C[C@H](O)CCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128327780 OKUGJOBPCDJQDY-PEYYIBSZSA-N 261.365 2.263 10 10 CECE CN(C)[C@@]1(C)CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128319062 PGRMNZRHMKWUSW-CVEARBPZSA-N 260.381 2.197 10 10 CECE CC[C@@H](N)C(C)(C)[C@@H](O)c1ccc2c(c1)CCN2C 2131857476 IFOLHMZTQIMPJP-CABCVRRESA-N 262.397 2.476 10 10 CECE CO[C@@H]1C[C@@H](CF)N(c2c(F)cc(CO)cc2F)C1 2133713583 OOSRDEAMNYNXMO-VHSXEESVSA-N 275.270 2.020 10 10 CECE C[C@@H]1C[C@@H](N(C)c2cc3c(cc2N)OCCO3)CS1 2132937452 SVMDXTITAGCMDL-NXEZZACHSA-N 280.393 2.370 10 10 CECE CCNCc1ccc(N(C)C2(CO)CCC2)c(C)c1 1914993297 XMDAPAXJXVNBEH-UHFFFAOYSA-N 262.397 2.456 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@@H]2CC[C@H]21 1912196867 YWSCLXKYOOEXDX-UMNHJUIQSA-N 252.318 2.008 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)N1CCC[C@H]2CCCC[C@@H]21 1912156163 LFEXDMMNJXEKSR-OLZOCXBDSA-N 279.388 2.410 10 10 CECE C[C@@H]1CCS[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1912161305 HRPZMZFPXQNRJV-OPRDCNLKSA-N 254.359 2.429 10 10 CECE C[C@H]1CC(C(=O)N2CCC(N=[N+]=[N-])CC2)C[C@H](C)O1 1912169404 KEKHZDZOVAPBHX-UWVGGRQHSA-N 266.345 2.491 10 10 CECE C[C@H]1COCC[C@@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 1912152835 XYMUSVVXWYENSU-JQWIXIFHSA-N 266.345 2.208 10 10 CECE Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCN=[N+]=[N-] 1912201586 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C[C@H](NCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]2CCO[C@@H]12 1926221049 AILYTERKZRWZSG-AVNXNWIJSA-N 263.337 2.001 10 10 CECE Cc1cc(N)c(Cl)cc1N1C(=O)[C@H]2[C@@H](C1=O)C2(C)C 229134715 AOLPEHJVOQOGOG-PHIMTYICSA-N 278.739 2.376 10 10 CECE O=C(Nc1nccn1C1CC1)c1c(F)ccc(O)c1O 1638790516 GUZNFQURMGZDQD-UHFFFAOYSA-N 277.255 2.021 10 10 CECE CO[C@@H]1CN(c2c(F)cc(CN)cc2F)CC[C@@H]1C 230222054 WZFWVBQJKFTMHN-TVQRCGJNSA-N 270.323 2.285 10 10 CECE Cc1cccc(CNCc2cc(C(=O)O)co2)c1O 2139759895 LUJUPGPHWFHOHV-UHFFFAOYSA-N 261.277 2.282 10 10 CECE CC[C@@H]1COCCN1c1ccc(CNC)c(OC)c1 2139696462 HXNKIFKFLWAHGX-CYBMUJFWSA-N 264.369 2.030 10 10 CECE Cc1cccc(CNC(=O)c2cc(Cl)ncn2)c1O 2139742669 DQHRIWIDGAQPMG-UHFFFAOYSA-N 277.711 2.074 10 10 CECE CC(C)N(Cc1ccc(O)cc1O)C[C@H]1CCCNC1 232905875 LKMADNYDQQILNE-ZDUSSCGKSA-N 278.396 2.308 10 10 CECE CCOC(=O)[C@](C)(N)c1c(O)ccc2ccccc12 1951727365 WCSWBENSOBUYGM-OAHLLOKOSA-N 259.305 2.282 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2CC(=O)N1CCCC1 162203539 NJBISIQTKVEIMX-ZDUSSCGKSA-N 287.407 2.081 10 10 CECE CC(=O)N[C@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 164137911 UWGAGLLJCDCJOX-HNNXBMFYSA-N 276.380 2.110 10 10 CECE C[C@H]1CCc2cc(N3CCN4C(=O)CC[C@@H]4C3)ccc2N1 168576412 SKAQJYIJKBJRLC-SWLSCSKDSA-N 285.391 2.244 10 10 CECE CC[C@@](C)(O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 154459140 XDAOSZPGRXDFBU-WMLDXEAASA-N 292.423 2.335 10 10 CECE CC[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2)CCO1 208949310 SMNLOVQGUZWKFS-BMWLXYDHSA-N 261.321 2.400 10 10 CECE CC[C@@H](C)NCc1nc(-c2ccc(O)c(O)c2)no1 233864159 OXSJCXHINGRQGD-MRVPVSSYSA-N 263.297 2.036 10 10 CECE CC[C@H]1OCC[C@H]1C(=O)N(CC)c1ccc(N)cc1 234121468 MTABNESBGZNMMY-ZIAGYGMSSA-N 262.353 2.437 10 10 CECE COc1cccc(O)c1CN[C@H]1COC2(CCC2)C1 850367917 RXGQFPGVCYVXFH-LLVKDONJSA-N 263.337 2.202 10 10 CECE Cc1nscc1NC(=O)c1ccc(O)c(O)c1 1945156923 DKMDXWXEAOYFFW-UHFFFAOYSA-N 250.279 2.115 10 10 CECE Nc1ccc(NC(=O)NCC2(N)CCCCC2)cc1 1876150221 RTDJUTDNGRMARC-UHFFFAOYSA-N 262.357 2.052 10 10 CECE CNC1CCC(N(C)c2ccc(OC)cc2N)CC1 1876277122 FKSPMSRLIGZKOT-UHFFFAOYSA-N 263.385 2.244 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)[C@H]1CC[C@@H]1C1CC1 1876563098 XGSNMCBVDCAMRC-CABCVRRESA-N 258.365 2.458 10 10 CECE CN(C)C[C@H]1CN(Cc2ccc(N)cc2)C(C)(C)C1 1878142116 BGNZQHKRTCIPPC-AWEZNQCLSA-N 261.413 2.431 10 10 CECE CCNCc1ccc(N2C[C@H]3COCC[C@H]32)cc1C 1878823343 FQXWCMKORXNXEY-GOEBONIOSA-N 260.381 2.330 10 10 CECE CCc1c(NCc2cccc(OC)c2O)cnn1C 1963190000 JJWFQVAZRYJSQT-UHFFFAOYSA-N 261.325 2.309 10 10 CECE Oc1c(F)cccc1CNCc1ccnn1C1CC1 1879755288 ALUWXHXZMLIFDA-UHFFFAOYSA-N 261.300 2.353 10 10 CECE COc1ccc(CN[C@H]2CC[C@H]3CC[C@H]2OC3)c(O)c1 2144529517 GVPHNAROZLKGGD-HZUKXOBISA-N 277.364 2.448 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](C)[C@H]2CO)c(F)c1 1880480668 YGYUYDFGVDKHOE-MWODSPESSA-N 271.307 2.225 10 10 CECE COC1(OC)CC(CNCc2ccc(N(C)C)cc2)C1 1963416104 YEHFAVDBQPFPGR-UHFFFAOYSA-N 278.396 2.241 10 10 CECE C[C@@H](NCc1cc(=O)cc[nH]1)c1ccc(N(C)C)cc1 2144610493 BOEYBWDNWLAOIG-GFCCVEGCSA-N 271.364 2.292 10 10 CECE CN1CCCc2cc(CN(CCN)CC(F)F)ccc21 2145280153 LIRZZGDCNAWLHK-UHFFFAOYSA-N 283.366 2.095 10 10 CECE O=C(O)[C@]1(Sc2nccs2)C2C[C@@H]3C1[C@@H]3C2 1904813495 FVRPUHVAEXJHOP-XFIGXLCTSA-N 253.348 2.344 10 10 CECE CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1885563354 TVOHDLFEINRCIP-SNVBAGLBSA-N 297.359 2.203 10 10 CECE CN(CCC(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(=O)OC(C)(C)C 1885563007 NVJRVZDMWQKCSU-SNVBAGLBSA-N 297.359 2.155 10 10 CECE CN(C)c1nc(CNCc2c(O)cccc2F)cs1 1964035436 RGLNGOXAXTXJKB-UHFFFAOYSA-N 281.356 2.344 10 10 CECE Cc1oc(-c2ccc(N(C)C)cc2)nc1CC(=O)O 41346823 HEZDJNZTNHPLOP-UHFFFAOYSA-N 260.293 2.343 10 10 CECE CC(C)(C)OC(=O)NC1CC(CC(=O)NCCN=[N+]=[N-])C1 1965102933 VWFOKFLTKCLMFD-UHFFFAOYSA-N 297.359 2.106 10 10 CECE O=C(O)[C@@H]1CC12CCN(Cc1c(O)cccc1F)CC2 1964726549 NDJMOVBJBBRDPF-NSHDSACASA-N 279.311 2.218 10 10 CECE CC(C)(C)OC(=O)C[C@@](C)(N)Cc1ccc(O)c(O)c1 1951857246 CHZCLALUHYEYTA-HNNXBMFYSA-N 281.352 2.090 10 10 CECE C[C@@H](NC[C@@H](CO)C(F)(F)F)c1ccc(F)cc1O 1967500669 LIRYDXDFGRORPC-SFYZADRCSA-N 281.249 2.353 10 10 CECE C[C@H]1CC[C@H](CCNCc2cc3c(cc2O)OCO3)O1 1967776122 QHZVYPZZUMYINP-CMPLNLGQSA-N 279.336 2.168 10 10 CECE CCOc1cccc(CNC[C@@H]2C[C@@H](C)CO2)c1O 1973145142 ZTKXTEGFCJEMMG-YPMHNXCESA-N 265.353 2.306 10 10 CECE CSc1cccc(O)c1[C@@H]1C[C@H](CN)CN1C 258548889 GDJDBGCKFWOWLU-ZJUUUORDSA-N 252.383 2.066 10 10 CECE CC(C)(C)c1cc(O)c(O)c([C@H](N)CCC(=O)O)c1 258533880 KXTJTOSVISBAOE-SNVBAGLBSA-N 267.325 2.260 10 10 CECE C[C@@H]1CCN(C(=O)[C@H]2CNc3ccccc3N2)C[C@H]1F 2152262971 XVMZZLLFCQPCDP-JTNHKYCSSA-N 277.343 2.099 10 10 CECE O=C([C@H]1CNc2ccccc2N1)N1CCCC[C@@H](F)C1 2152294881 RYGCYJVUEQWNNF-BXUZGUMPSA-N 277.343 2.243 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC(CCO)C2)cc1O 2152302577 YBLYNYAHJVJKBC-LBPRGKRZSA-N 278.396 2.271 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CCC[C@H](F)C2)cc1 2152314188 CETCVIMICHXGAX-WCQYABFASA-N 280.343 2.435 10 10 CECE CCN[C@H](c1ccccc1O)[C@@]1(O)COCC[C@H]1CC 2152492774 YALDSJSATAKVME-DAXOMENPSA-N 279.380 2.220 10 10 CECE CCCN(CC(=O)N(C)c1ccc(N)cc1)C(C)C 37273296 QNCPCEYJGQKGHW-UHFFFAOYSA-N 263.385 2.352 10 10 CECE Cc1cc(N(C)CC(F)(F)CO)ccc1CNC1CC1 2150981325 LWLFFNQIYASUNQ-UHFFFAOYSA-N 284.350 2.311 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@@H]1C=CCC1 2153115191 WBWBJUNTTCSWBV-QWHCGFSZSA-N 273.380 2.494 10 10 CECE C[C@H]1CCCN(c2cnn(CCCN=[N+]=[N-])c(=O)c2)C1 165309811 PQLIJXYLSPGRGM-NSHDSACASA-N 276.344 2.180 10 10 CECE COc1ccc(CNC[C@@H](O)c2ccccc2)c(O)c1 40906132 MMMGZVQEAHHAKB-MRXNPFEDSA-N 273.332 2.224 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@H]1OCC[C@@H]1F 2009184601 CSMBSBTWTKVXRM-JQWIXIFHSA-N 259.708 2.262 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2C[C@H]2c2ccccc2)cc1 44660603 NKJDJTJZIZOWEM-JKSUJKDBSA-N 266.344 2.484 10 10 CECE CCS(=O)(CC)=NC(=O)Nc1ccc(N)cc1 2016891045 XWTIZBPNHUQKFR-UHFFFAOYSA-N 255.343 2.309 10 10 CECE CCN(CC(=O)N[C@H](C)C(C)C)Cc1ccc(N)cc1 49308676 KISQOMAJPDNIPB-CYBMUJFWSA-N 277.412 2.251 10 10 CECE COc1cc(N2CCC(=O)[C@@H](C)C2)cc(OC)c1OC 49693423 KVEWMULEXWRHPH-JTQLQIEISA-N 279.336 2.128 10 10 CECE C[C@@H]1CCO[C@@H]1CCN(C)C(=O)Cc1ccc(N)cc1 2157290279 JENVWSMHFMTCKE-IUODEOHRSA-N 276.380 2.085 10 10 CECE CN(Cc1cc(Cl)ccc1O)C1(C(=O)O)CC1 2022966469 WIZDTIOMDGGGJL-UHFFFAOYSA-N 255.701 2.095 10 10 CECE CCCNCc1ccc(N2CCC[C@](F)(CO)C2)cc1 2157521291 ZRRMZMCBUKNDMM-MRXNPFEDSA-N 280.387 2.487 10 10 CECE CCCCC[S@](=O)CC(=O)c1ccc(O)c(O)c1 2029188583 OYKUZURRGROQLK-SFHVURJKSA-N 270.350 2.219 10 10 CECE CO[C@H]1CCN(c2ccc(CO)cc2F)C[C@@H]1C 2031979501 URJOFGSWYGPWFV-HZMBPMFUSA-N 253.317 2.179 10 10 CECE Nc1ccc(CN=c2ccc(C(F)F)n[nH]2)cc1 2033030436 STSBXVMMCWIPLJ-UHFFFAOYSA-N 250.252 2.030 10 10 CECE C[C@H]1CC[C@@H](CCN(C)C(=O)Cc2ccc(N)cc2)O1 2161113163 KWHQCZKPNZGZCL-WFASDCNBSA-N 276.380 2.227 10 10 CECE CC[C@H]1CCN(Cc2ccc(O)c(O)c2)[C@H](CN)C1 300112754 WTCMLZAZEXKDAI-AAEUAGOBSA-N 264.369 2.047 10 10 CECE CCCNCc1cnc(Sc2nccc(O)n2)s1 2037780604 CURVRRLWSCZFPC-UHFFFAOYSA-N 282.394 2.290 10 10 CECE CC[C@H](NC)c1ccc(N2CCNC(=O)[C@H]2CC)cc1 300507411 HSYWYDPWPOBKOY-LSDHHAIUSA-N 275.396 2.072 10 10 CECE COCCC1(C(=O)N2CCC(N=[N+]=[N-])CC2)CC1 2040266200 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294.464 2.452 10 10 CECE CCNCc1ccc(N2CC(CN(C)C)C2)cc1Cl 382319069 VPRVVUZDSHQGET-UHFFFAOYSA-N 281.831 2.447 10 10 CECE CC[C@H](C[C@@H](C)O)NCc1cc(OC)ccc1O 716915425 KJYWECTXIMETTL-ZYHUDNBSSA-N 253.342 2.040 10 10 CECE CN(C)c1ccc([C@H](O)c2cnc(Cl)n2C)cc1 696485397 PKDZUPVHGIWEDJ-LBPRGKRZSA-N 265.744 2.221 10 10 CECE CCOc1cccc(CN(CCF)CCOC)c1O 697056035 QOPXWIIPEIJSQO-UHFFFAOYSA-N 271.332 2.209 10 10 CECE CN1CCCc2cc([C@@H]3NCCC[C@@H]3C(=O)O)ccc21 2176729887 PFNVDFFJDLYXHS-ZFWWWQNUSA-N 274.364 2.194 10 10 CECE COc1ccc(CNCCC2(OC)CCC2)c(O)c1 388906672 MGWKCTDCYIUGDX-UHFFFAOYSA-N 265.353 2.450 10 10 CECE COCCNCc1ccc(N2CC=CC2)cc1Cl 723156820 KCHZNEBSKLQBLP-UHFFFAOYSA-N 266.772 2.452 10 10 CECE C[C@H]1COCCCN1c1c(F)cc(CN)cc1F 399416864 SUIMHSCGRFMXTG-VIFPVBQESA-N 256.296 2.039 10 10 CECE C[C@H](N[C@H]1CO[C@@]2(CCOC2)C1)c1ccc(F)cc1O 2178982902 OUGIEYGPMJARTM-NVBFEUDRSA-N 281.327 2.130 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@H](O)[C@H]2C3)cc1O 2177160831 WQSLRAJRTXAPSW-JDOCFBBISA-N 276.380 2.022 10 10 CECE CN1CC[C@@H]2[C@@H](CCN2c2cc(Cl)c(CN)cc2F)C1 2177381522 OCJFUMLFUQULRK-IINYFYTJSA-N 297.805 2.468 10 10 CECE C[C@@H](CN(C)c1ccc(OCCN(C)C)cc1)N(C)C 2177608189 PNNUTQKRMXQARL-AWEZNQCLSA-N 279.428 2.013 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1cc(=O)n2ccsc2n1 2179611061 CKPZOERACVERNL-JTQLQIEISA-N 290.352 2.031 10 10 CECE CCNCc1ccc(N2C[C@@H]3CCC[C@H](C2)C3O)cc1 2167792071 LCKUDIWVNMLVRL-FKEKPDDDSA-N 274.408 2.393 10 10 CECE COC(=O)c1cnn([C@H](C)c2cc(C)ccc2O)c1 2069952563 BJUJIWGYOLSYKE-SNVBAGLBSA-N 260.293 2.293 10 10 CECE CN1C[C@H]2C[C@H]1CN2c1ccc(CO)c(C(F)(F)F)c1 2187612512 ISRVVWWVZHJPCJ-NWDGAFQWSA-N 286.297 2.090 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@]12C[C@H](CCN1)C2 2192493626 KHXVHLARTZPFQK-RRQGHBQHSA-N 272.392 2.462 10 10 CECE CN1CCc2cc([C@H]3N[C@H](C(=O)O)C(C)(C)S3)ccc21 2195333011 DKAPMBJJIYMMFG-OLZOCXBDSA-N 292.404 2.246 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](C(N)=S)C1CC1 2192592742 DDYNWHPNCNFPGP-ZANVPECISA-N 292.404 2.224 10 10 CECE CNCc1ccc(N2CC(=O)NC[C@@H]2C(C)C)cc1Cl 2181164238 WIVFNKSWQKJRKE-CQSZACIVSA-N 295.814 2.020 10 10 CECE C[C@@H](NC(=O)CC[C@H]1CCCCN1)c1ccccc1O 2192624836 GIVANEASWFIXNM-CHWSQXEVSA-N 276.380 2.492 10 10 CECE Cc1ccnnc1[C@H](O)c1ccc(N2CCCC2)cc1 2192722292 XIPGDPLIQJYQRA-MRXNPFEDSA-N 269.348 2.467 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CC(=O)N3CCC[C@H]23)c1 2188499331 MZPYXBMHKAQHFZ-FPMFFAJLSA-N 274.364 2.115 10 10 CECE NCc1ccc(N2CCC=C[C@H]2CO)c2ccccc12 2182329959 FCAQPSBFLLMEMK-AWEZNQCLSA-N 268.360 2.426 10 10 CECE CN1CCCc2cc([C@@H](N)[C@@H]3CNC(C)(C)C3)ccc21 2193395239 PPPUAMYTTWPANH-GOEBONIOSA-N 273.424 2.457 10 10 CECE C[C@H]1C[C@@H](N(C)CC(=O)N(C)c2ccc(N)cc2)CS1 2189475532 XTKODPYYHLCXHT-SMDDNHRTSA-N 293.436 2.057 10 10 CECE [N-]=[N+]=NCCNC1(C(=O)O)C[C@H]2CC=CC[C@@H]2C1 2042348060 QHSLFNCJTWBCOR-NXEZZACHSA-N 250.302 2.086 10 10 CECE Cc1nc(CN(C)c2ccc(CO)c(Cl)c2)no1 2042301729 JLRWQIQGGYYWQT-UHFFFAOYSA-N 267.716 2.160 10 10 CECE OC[C@H]1CCC[C@H]1CNCc1c(O)cccc1F 2042625680 LIUJWSZYSVRILS-WDEREUQCSA-N 253.317 2.030 10 10 CECE CN[C@@H]1CCCc2cc(N3CC(C(C)(C)O)C3)ccc21 2184679520 JBUNJAXRJHRWPA-MRXNPFEDSA-N 274.408 2.491 10 10 CECE C[C@@H]1CN(C)CCN(c2ccc3c(c2)CCC[C@H]3N)C1 2184683750 DNJZZDAMRCJJQA-CXAGYDPISA-N 273.424 2.411 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H](C[C@@H]3O)C2)c(Cl)c1 2045146380 GNWSOIHJJSVCRF-SUNKGSAMSA-N 266.772 2.006 10 10 CECE C[C@@H]1C[C@H]2CN(c3ccc4c(c3)CC[C@H]4O)CCN2C1 2184732569 AOLPVJRPDWJBNR-ISTRZQFTSA-N 272.392 2.197 10 10 CECE CCN[C@@H]1CCc2cc(N(C)[C@@H](C)C[S@](C)=O)ccc21 2184710349 DMCUIJJBTLZHOA-KRYHZZBUSA-N 294.464 2.487 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](O)C34CCC4)ccc21 2184723664 PLHPIJALMCQKNY-CVEARBPZSA-N 272.392 2.387 10 10 CECE COCC[C@@H](COC)N(C)c1ccc2c(c1)CC[C@H]2O 2184736368 SISXCACMSQDRHA-GOEBONIOSA-N 279.380 2.154 10 10 CECE C[S@](=O)CCCCN[C@H]1CCc2cccc(O)c21 2047840871 IACSMSQZZORQII-SGTLLEGYSA-N 267.394 2.128 10 10 CECE CN1CCc2cc(CNCC3CC(N(C)C)C3)ccc21 2184918055 FXKCSUISDGGFGR-UHFFFAOYSA-N 273.424 2.109 10 10 CECE CCCOc1cc(N2C[C@H]3C[C@H](O)C[C@H]3C2)ccc1N 2185205989 GONDHKDGUHSHSG-IMRBUKKESA-N 276.380 2.265 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1 2050495322 SENDAXFRJWOZES-RYUDHWBXSA-N 250.277 2.244 10 10 CECE C[C@@H](CNCc1ccc(O)c(O)c1O)C(C)(F)F 2051839795 KRDGJVSNHVFITO-ZETCQYMHSA-N 261.268 2.184 10 10 CECE Oc1cccc(CNOCC(F)(F)C(F)F)c1O 2053776011 ZIXANPDQGAJDNH-UHFFFAOYSA-N 269.194 2.019 10 10 CECE Cn1ncc(COCCc2ccc(N)cc2)c1Cl 2056190388 YHAXGIXSTOAEPJ-UHFFFAOYSA-N 265.744 2.415 10 10 CECE C[C@H]1CN(c2c(F)cc([C@@H](C)O)cc2F)C[C@H](C)C1O 2194513407 UOMWEYGILDGQEQ-LPEHRKFASA-N 285.334 2.471 10 10 CECE C[C@@H](O)c1cc(F)c(N2[C@H]3CC[C@H]2[C@@H](CO)C3)c(F)c1 2194508891 GCJORGDDHPHGRZ-GJTWSCIVSA-N 283.318 2.368 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)C[C@H](O)C2CC2)c(F)c1 2194693391 ALJNLOZOXINGFS-XPTSAGLGSA-N 284.350 2.452 10 10 CECE Cc1cocc1CN(C)C(=O)COc1ccc(N)cc1 2186478350 KHVDYBXIPWCXRJ-UHFFFAOYSA-N 274.320 2.208 10 10 CECE CCC[C@H]1C[C@@H](NCc2ccc(O)c(O)c2)CO1 2065801796 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COc1cc(C)cc([C@@H](O)[C@@H](N)c2ccccc2O)c1 2201188681 CQRBEZKSXSSVAC-JKSUJKDBSA-N 273.332 2.443 10 10 CECE C[C@H](c1ccccc1O)N1CCC[C@]12CC[S@@](=O)C2 2102291591 OFVCOHKNUMVFOV-KPAZRMRSSA-N 279.405 2.440 10 10 CECE NC[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1cc(F)ccc1O 2102963761 BBQKJKIFXZYEFP-ZOZIMZAQSA-N 264.344 2.233 10 10 CECE COc1ccc(N2C[C@H]3CNC[C@@]3(C)C2)cc1Cl 2082860370 AWEKCLKTXWBNOJ-YGRLFVJLSA-N 266.772 2.394 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@H](C)C[C@@H]1C(=O)O 2103020170 VTCQLKRSBXPZEL-VDDIYKPWSA-N 267.300 2.387 10 10 CECE CC(C)N1CC[C@@H](N(C)c2ccc(CN)c(F)c2)C1 2103806749 CDRLXJFGXQQRNI-CQSZACIVSA-N 265.376 2.203 10 10 CECE CN1CCc2cc([C@@H]3N[C@@](C)(C(F)F)CO3)ccc21 2105086182 LIMSCJQCJMIYDC-TZMCWYRMSA-N 268.307 2.321 10 10 CECE COc1ccc(N2C[C@H](C)[C@@H](CCN)C2)cc1OC 2106391071 XEMQQOFHVGEPKV-RYUDHWBXSA-N 264.369 2.125 10 10 CECE COc1ccc(N2CCNC[C@@]2(C)C2CC2)cc1F 2106376078 IVBQHJCTLCMYGS-HNNXBMFYSA-N 264.344 2.413 10 10 CECE Cc1nccnc1[C@@](C)(N)c1ccc(N(C)C)cc1 2106792363 CGNWZKTYFYFJAB-HNNXBMFYSA-N 256.353 2.073 10 10 CECE CCN(CC)c1ccc([C@]2(O)C[C@@H]3NCC[C@H]32)cc1 2106831003 MFSXYAZOTCZWJY-OWCLPIDISA-N 260.381 2.102 10 10 CECE CCN(CC)c1ccc([C@@H](O)c2ncccn2)cc1 2106823379 OMTAZYQKHZYUCD-CQSZACIVSA-N 257.337 2.405 10 10 CECE CCN(CC)c1ccc([C@@H](NN)[C@@H]2CCCO2)cc1 2106861441 YSZGSIQIPMARNX-LSDHHAIUSA-N 263.385 2.216 10 10 CECE CN(C)c1ccc([C@H](N)[C@]2(O)CC[C@@H]3C[C@@H]3C2)cc1 2106852816 KAFKJQKGJMULDU-VDERGJSUSA-N 260.381 2.304 10 10 CECE C[C@@H]1C[C@](O)([C@@H](N)c2ccc3c(c2)CCN3C)[C@@H]1C 2106858248 UKPQWFAEVHIWQN-NSLUBLRVSA-N 260.381 2.086 10 10 CECE CCC[C@H](O)[C@H](NC)c1ccc2c(c1)CCN2CC 2106852518 GXFSKHIDYCVRDB-JKSUJKDBSA-N 262.397 2.491 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)[C@H](O)C1CC1 2106942085 CIMSFTFLBHYQFK-HZPDHXFCSA-N 260.381 2.318 10 10 CECE CCCN(Cc1ccc(N)cc1)S(=O)(=O)[C@H]1C[C@@H]1C 2107400959 SXTQOGLQAUGICN-FZMZJTMJSA-N 282.409 2.219 10 10 CECE O=C1NCCCC[C@@H]1CNCc1c(O)cccc1Cl 2087735010 WKRWWWDSAQBQPN-SNVBAGLBSA-N 282.771 2.052 10 10 CECE COc1ccc([C@@H](N)c2ccccc2O)c(OC)c1 2090036865 HNGXLRDSHOVMDB-HNNXBMFYSA-N 259.305 2.458 10 10 CECE Cc1cc(C(=O)[C@@H](O)c2ccc(N(C)C)cc2)sn1 2090865813 YGFZOGIIASUVSP-ZDUSSCGKSA-N 276.361 2.434 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H](N)CC3CC3)ccc21 2091242014 MVKAWWLASUCTHI-HOCLYGCPSA-N 260.381 2.230 10 10 CECE CO[C@@H]1CCCC[C@@H]1NCCc1ccc(O)c(O)c1 2091746783 GWKAITVPZPXGRB-SWLSCSKDSA-N 265.353 2.188 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)C1C[C@@H]2C[C@H]2C1 2091863677 OTYKJOMRJLSUBO-DPDCMNJDSA-N 261.365 2.450 10 10 CECE CCNCc1ccc(N(C)[C@H](C)CC(N)=O)cc1Cl 2094989407 IRFGHNCWVIWUOW-SNVBAGLBSA-N 283.803 2.150 10 10 CECE C[C@H]1CC[C@@H](CNCc2cc(F)cc(F)c2O)N1C 2095273104 BEDJXOROCBRXKR-CABZTGNLSA-N 270.323 2.243 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)COCC3)[C@H](C)CN1 2096487131 CCJRQNOSXUCNFY-DOMZBBRYSA-N 260.381 2.336 10 10 CECE Cc1cc(N2CCOC[C@H](C3CC3)C2)ccc1CO 2096561111 QMJCZKGOHVOXMB-OAHLLOKOSA-N 261.365 2.350 10 10 CECE CCNCc1ccc(N2CC[C@]3(CCO3)C2)c(F)c1 2097010635 LTYHORFPPJVQNQ-HNNXBMFYSA-N 264.344 2.304 10 10 CECE CN[C@H](C)c1ccc(N2CC3(CC3)C[C@H]2CO)cc1 2099123838 AUAOQAJVAFUZDU-DOMZBBRYSA-N 260.381 2.318 10 10 CECE CCN(c1ccc(CO)cc1[N+](=O)[O-])[C@H]1CCSC1 2113799419 HTDZCWXIEJJJKH-NSHDSACASA-N 282.365 2.419 10 10 CECE NCc1ccc(N2CCC[C@@H]3COCC[C@@H]32)cc1F 2113899793 AKZFIKLYHPPQQP-DOMZBBRYSA-N 264.344 2.290 10 10 CECE COc1cc(N(C)CC2(C)CCOCC2)ccc1CN 2204539453 PGWUECISRLYWRK-UHFFFAOYSA-N 278.396 2.407 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CC[C@@H](C)O2)cc1OC 2204549914 LFGKGYVPKUSPIH-DOMZBBRYSA-N 278.396 2.418 10 10 CECE Cc1cccc(CNc2c([N+](=O)[O-])c(C)nn2C)c1O 2204619680 FIWFNSVFRNHSJI-UHFFFAOYSA-N 276.296 2.263 10 10 CECE CN[C@H]1CN(c2ccc3c(c2)CCCN3C)CC12CC2 2205845772 ISODDNGKHOLDRY-INIZCTEOSA-N 271.408 2.257 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)NC(=O)[C@H]3N)CCC1(F)F 2206240001 VUMYXYXFCMXEFW-PELKAZGASA-N 281.306 2.120 10 10 CECE CSc1ncc(CN[C@H](C)c2nccn2C)s1 2208568221 MPLUKLOLICGVHD-MRVPVSSYSA-N 268.411 2.449 10 10 CECE 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10 10 CECE CCOc1ccc(O)c(CN2CC3(CCCO3)C2)c1 862484343 KTGPEIYWCBEFPI-UHFFFAOYSA-N 263.337 2.156 10 10 CECE C[C@H](N[C@@H]1CCN[C@H]1C)c1cc(Cl)ccc1O 863545891 BACDUMUIQHAEEX-HOTUBEGUSA-N 254.761 2.447 10 10 CECE CCCN(CCC)c1ccc(CNC[C@@H](O)[C@@H](C)O)cc1 865742339 YMCGXKGCSLLDDS-RHSMWYFYSA-N 294.439 2.144 10 10 CECE COc1cccc([C@H](C)NCC[C@@H](O)C(F)F)c1O 866442014 BRVMZFBYTNFOSC-WCBMZHEXSA-N 275.295 2.068 10 10 CECE CCOc1ccc(N(CC2CC2)C[C@@H]2CNCCO2)cc1 866673077 QNOZDGRZMXJVLV-KRWDZBQOSA-N 290.407 2.290 10 10 CECE CCO[C@H](CC)C(=O)NCc1ccc2cccnc2c1O 862028224 USHMETXCNBINJH-CYBMUJFWSA-N 288.347 2.372 10 10 CECE CO[C@H]1C[C@@H](CNC(=O)N[C@H](C)c2ccccc2O)C1 868818164 VBOUQJIGIFCILI-UTUOFQBUSA-N 278.352 2.177 10 10 CECE COC[C@]1(C)CN(Cc2cc3c(cc2O)CCC3)CCO1 863340813 NLIRGHWXMKCHFM-KRWDZBQOSA-N 291.391 2.118 10 10 CECE Cc1nn(C)c(Cl)c1C(=O)N1Cc2cccc(O)c2C1 871198778 OPTFLWDCMOJLTE-UHFFFAOYSA-N 291.738 2.244 10 10 CECE C[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)c1ccncc1 779528161 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PLLJLGNBIVMRHH-UONOGXRCSA-N 260.381 2.406 10 10 CECE CCN[C@@H](C)c1ccc(N(C[C@H](C)O)C2CC2)cc1O 709452354 MLMUDZVAMPJXNO-RYUDHWBXSA-N 278.396 2.412 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC[C@H](C)[C@H]2CO)c1 688620530 XBYRUMVKJMWPNX-XHDPSFHLSA-N 277.364 2.188 10 10 CECE CCOc1ccc(CN(C)Cc2cnn(C)c2C)c(O)c1 790939921 YKLWLTOQIRHTNG-UHFFFAOYSA-N 289.379 2.465 10 10 CECE NCc1ccc(N2CC3CC2(CO)C3)cc1C(F)(F)F 710632671 DPEPSLFUSXPCNX-UHFFFAOYSA-N 286.297 2.125 10 10 CECE NCc1ccc(N2CCSC[C@@H]2CCO)c(Cl)c1 689739876 DURLVGKPVYVCFR-NSHDSACASA-N 286.828 2.103 10 10 CECE Oc1ccc(CNC[C@@H]2CCN2Cc2ccccc2)cc1O 716237086 JOKSLERWLWHHTN-INIZCTEOSA-N 298.386 2.462 10 10 CECE C[C@H]1CC[C@@H]1NC(=O)NCc1ccc(N(C)C)cc1 796656936 AJXLUEZCKAAEQQ-FZMZJTMJSA-N 261.369 2.350 10 10 CECE CN(C[C@@H]1CCCS1)c1cc2c(cc1F)[C@H](O)C(=O)N2 718368288 MPTYIUVJEFBSSU-SDBXPKJASA-N 296.367 2.143 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])C1(C(C)C)CCC1 686141394 WDXDMHIRIKNMCL-JTQLQIEISA-N 254.334 2.254 10 10 CECE COc1ccc([C@H](C)N[C@H]2COC[C@@H]2C)c(O)c1 699837740 PDRGRNZHLXAGNO-KWBADKCTSA-N 251.326 2.086 10 10 CECE CCc1cccc(CNCc2nccnc2C)c1O 699943470 NTSKRRRMUZIKOJ-UHFFFAOYSA-N 257.337 2.343 10 10 CECE CCN(CCOC)c1cc2c(cc1Cl)[C@@H](NC)C(=O)N2 92750884 LBKNBURIZOJWLN-CYBMUJFWSA-N 297.786 2.025 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1csnc1Br 1912191812 WUQOBBMEVPDZDB-UHFFFAOYSA-N 290.146 2.288 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CCO[C@@H]2C[C@@H]21 2115165405 VMNNBOGMXAOOBC-JKSUJKDBSA-N 260.381 2.471 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H]3CCO[C@H]3C2)c1O 2115450051 MEGGVFLRLPNFKR-ZANVPECISA-N 283.755 2.275 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2N)[C@@H]1CCCC[C@@H]1O 2128310623 JZWTXCBXPZDMOS-OAGGEKHMSA-N 260.381 2.372 10 10 CECE N[C@H]1CCc2cc(N3CCOC[C@H]3C(F)F)ccc21 2128328764 UFMCAJBHFBEEGW-STQMWFEESA-N 268.307 2.103 10 10 CECE CC(C)(C(=O)NCC1(CN=[N+]=[N-])CC1)[C@H]1CCCO1 2117723784 FZGWLIQYJNQLGG-SNVBAGLBSA-N 266.345 2.398 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CO[C@H]3C[C@@H]2C3)cc1O 2126709263 VHTUJHGPTHKHOM-KOXOONSLSA-N 262.353 2.026 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H]1[C@H]2COC[C@H]21 2118013159 ARRZFTQZZDXJQO-ZOUHWKOYSA-N 259.349 2.483 10 10 CECE N[C@H]1CCc2cc(N3CCC[C@@H]4COC[C@H]43)ccc21 2128319548 UPAOMHGTUXPEJI-UHOFOFEASA-N 258.365 2.248 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CCC[C@H]2F)cc1 2118935935 NKSQDQJIXYHWJY-CHWSQXEVSA-N 266.316 2.045 10 10 CECE CN(C)C[C@@H]1CCCN1c1ccc2c(c1)CC[C@@H]2N 2128318744 XFJPYJSSJGMLLF-HOCLYGCPSA-N 259.397 2.163 10 10 CECE CCOC[C@@H]1CCN(c2ccc3c(c2)CC[C@H]3N)C1 2128315548 SXGMHIFIJBHULM-MLGOLLRUSA-N 260.381 2.495 10 10 CECE CN(C)[C@@H]1CCCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128320830 GEFJBMDNTBVTDE-ZBFHGGJFSA-N 260.381 2.197 10 10 CECE CO[C@@H](CN(C)c1ccc2c(c1)CC[C@@H]2N)C1CC1 2128318948 OGSCAOCHRXSCEH-HOTGVXAUSA-N 260.381 2.494 10 10 CECE C[C@H]1CC[C@H](CO)CN1c1ccc2c(c1)CC[C@H]2O 2128323387 XAFYVNIQPPBUOU-MQIPJXDCSA-N 261.365 2.263 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2CNC[C@@H]2F)cc1 2120672147 LPGCVPKXZKXOTE-KKUMJFAQSA-N 266.360 2.124 10 10 CECE Nc1ccc(CCN2[C@H]3CC[C@@H]2C[C@@H](CO)C3)cc1 2128157399 GAESAODXZUBRQJ-MKZZRHPPSA-N 260.381 2.047 10 10 CECE COc1ccc(N2CCC23CC(CN)C3)c(OC)c1 2125789352 SLOHCGDGCNCHLB-UHFFFAOYSA-N 262.353 2.021 10 10 CECE Cc1ncc(C(=O)O)n1CCCc1ccc(N)cc1 2123094932 OOCUWGGSECXXPK-UHFFFAOYSA-N 259.309 2.105 10 10 CECE Cc1cc(N2CC[C@@H]3CCO[C@H]3C2)ccc1CCN 2128419169 YXYNATINKRDMHG-ZBFHGGJFSA-N 260.381 2.111 10 10 CECE C[C@H](F)CCNCc1ccc(N2CCN(C)CC2)c(F)c1 1343896179 QGGFELAQZCERIR-ZDUSSCGKSA-N 297.393 2.415 10 10 CECE COc1ccc(N2CC[C@H](N3CCCCC3)C2)c(N)c1 213399417 WTCMJIIKTQMUCZ-ZDUSSCGKSA-N 275.396 2.342 10 10 CECE C/C(=C/c1cccnc1)C(=O)N1CC(=O)Nc2ccccc21 1352182864 HPXSDMFOLNHCSF-XFXZXTDPSA-N 293.326 2.470 10 10 CECE COCC(CN[C@@H](C)c1ccc(C)cc1O)COC 1910265279 WYZXFXIDRBRSQK-LBPRGKRZSA-N 267.369 2.260 10 10 CECE CN(C(=O)/C=C\c1cn(C)cn1)c1ccc(Cl)nc1 1270844723 KBWQHKQQLYMCRT-UTCJRWHESA-N 276.727 2.145 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](CO)C3(CCC3)C2)c(F)c1 1914526156 PILCDRMTQOTHTM-WCQYABFASA-N 279.355 2.478 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@H](O)c2ccccc2)C1 1912185095 LTRWSMCAWMSJGD-WCQYABFASA-N 274.324 2.269 10 10 CECE Cc1nn(C)c(C)c1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1912164297 VKNXJIRSMGKESE-NSHDSACASA-N 276.344 2.199 10 10 CECE COC(=O)c1cccc(CN2CCC[C@H](N=[N+]=[N-])C2)n1 1912179675 XECDIDCNMCUKIU-NSHDSACASA-N 275.312 2.143 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)[C@H]2CCCSC2)C1 1912172411 DTKWRGBENDIJJQ-ZJUUUORDSA-N 254.359 2.288 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C[C@@H]2C[C@@H]3COCC[C@@H]3O2)C1 1912157234 XFBKJHXUJXOZAW-CRWXNKLISA-N 280.372 2.203 10 10 CECE CC(C)(C)c1nnsc1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912204280 VYABEQFVNBLGFW-ZETCQYMHSA-N 280.357 2.360 10 10 CECE COc1ccc(OC)c(C(=O)N(C)CCCN=[N+]=[N-])c1 1912202564 JDVFASGELNZQGR-UHFFFAOYSA-N 278.312 2.476 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCCN2CCCCC2)C1 1912203351 PULTUDGNECABDC-ZDUSSCGKSA-N 251.378 2.495 10 10 CECE CON1CCN(c2ccc(CNC(C)C)cc2F)CC1 1915780401 MMOBUFHPGFDJAU-UHFFFAOYSA-N 281.375 2.007 10 10 CECE Nc1ccc(NC(=O)CN2CC3(CCCC3)C2)cc1 1915804233 WMISEQRIHSVDPF-UHFFFAOYSA-N 259.353 2.083 10 10 CECE Nc1ccc(OCC(=O)N2CC[C@@H](CC(F)F)C2)cc1 1916630077 NEYPJOSFHWEAQL-JTQLQIEISA-N 284.306 2.151 10 10 CECE Nc1ccc(NC(=O)CCSc2cnccn2)cc1 110912329 AAQFVQUGRZSHPU-UHFFFAOYSA-N 274.349 2.180 10 10 CECE CC(=O)NCCN=NNc1cccc(Br)c1 1860490164 VAOQDODCWCYRCG-UHFFFAOYSA-N 285.145 2.364 10 10 CECE O=C(CCc1ccc(O)cc1)NCc1c(O)cccc1F 1471975901 LVNPUPUEIFPXHI-UHFFFAOYSA-N 289.306 2.486 10 10 CECE CNCc1ccc(N2C[C@@H](O)CC(C)(C)C2)c(C)c1 1923154619 ZPFMEMVYOWAGBE-AWEZNQCLSA-N 262.397 2.312 10 10 CECE Oc1c(CN[C@@]23CCC[C@@H](C2)OC3)ccc(F)c1F 1925069764 LWRXPVKWZOVSJV-HZMBPMFUSA-N 269.291 2.472 10 10 CECE O=C(/C=C/c1ccco1)NCc1ccc(O)cc1O 1557084645 IIVQMLLGAGCAQA-AATRIKPKSA-N 259.261 2.020 10 10 CECE O=C(/C=C\c1ccco1)NCc1ccc(O)cc1O 1557084646 IIVQMLLGAGCAQA-WAYWQWQTSA-N 259.261 2.020 10 10 CECE Cc1ccc(O)c(CN=c2cc(Br)n(C)[nH]2)c1 1949990254 VRJXLNANNSKWFL-UHFFFAOYSA-N 296.168 2.231 10 10 CECE COc1cc(Cl)cc(CN2CC[C@@H](C)[C@@H](N)C2)c1O 229103701 GIBBKKUMTMLVTP-SKDRFNHKSA-N 284.787 2.223 10 10 CECE Cc1nocc1NC(=O)/C=C/c1ccc(O)c(O)c1 1631756554 ZLPNVVOCOIGXMA-HWKANZROSA-N 260.249 2.046 10 10 CECE CCC1C[C@H]2C(=O)N(c3ccc(N)cc3)C(=O)[C@@H]2C1 229872986 YMQUXYNWLQCPEV-CHWSQXEVSA-N 258.321 2.194 10 10 CECE CC(C)N1CCO[C@H](c2noc(-c3sccc3O)n2)C1 123236280 FGUGPSRDBLUYBB-JTQLQIEISA-N 295.364 2.285 10 10 CECE CC1(C)C[C@@H]1CNC(=O)CCOc1ccc(N)cc1 232874195 DDAYVBDQKKLBOD-LLVKDONJSA-N 262.353 2.200 10 10 CECE CC(=O)NN1C=C(C)C2=S1N(c1ccccc1)N=C2C 5482634 UHIXVKIVMDAGRM-UHFFFAOYSA-N 288.376 2.424 10 10 CECE CCOC(=O)[C@@H](N[C@H](C)CC)c1ccccc1O 166135483 KEBCOABIOKQGDB-MFKMUULPSA-N 251.326 2.385 10 10 CECE OCC1(CNCc2cccc(O)c2O)CCCCC1 125497140 WRJOMLBTEZNEPS-UHFFFAOYSA-N 265.353 2.130 10 10 CECE CN(CCCC(=O)N1CCCC1)c1ccc(N)cc1 2141296446 YJPOHARYDJSAPF-UHFFFAOYSA-N 261.369 2.108 10 10 CECE COc1ccc(N(C)[C@@H](CN)CC(C)(C)OC)cc1 234865954 XHDPHGLJZPWULG-CYBMUJFWSA-N 266.385 2.274 10 10 CECE Cc1cccc(N)c1NC(=O)c1cccc(O)c1O 125957795 IJENFPLKFVLACB-UHFFFAOYSA-N 258.277 2.241 10 10 CECE Oc1cccc2c1[C@H](N[C@H]1COC[C@@H]1C1CC1)CC2 903441167 YJMAWVJKXLDFIG-MCIONIFRSA-N 259.349 2.394 10 10 CECE Oc1cc(Cl)ccc1CN1C[C@H]2COC[C@@H]2C1 1942494048 LEVLBXJYMQDXNK-QWRGUYRKSA-N 253.729 2.124 10 10 CECE CN(Cc1cc(Cl)n(C)n1)Cc1ccccc1O 859189037 KDRHYQPSYARXRL-UHFFFAOYSA-N 265.744 2.411 10 10 CECE CC[C@H](CN(C)C)NCc1cccc(Cl)c1O 1942690151 HONHQYQSYLTPDB-LLVKDONJSA-N 256.777 2.475 10 10 CECE Nc1ccc(-n2nnnc2-c2ccc(F)c(F)c2F)cc1 1857876840 UFFIJIFRESECFK-UHFFFAOYSA-N 291.236 2.329 10 10 CECE CC(C)CNC(=O)[C@@H](C)NCc1ccc(Cl)cc1O 1962920042 ZBUUILOPTXSDDY-SNVBAGLBSA-N 284.787 2.296 10 10 CECE C[C@@]1(CCNCc2cccc(Cl)c2O)COCCO1 1875564282 ODVLWBHIJAWZBC-CQSZACIVSA-N 285.771 2.331 10 10 CECE C[C@H]1CCN(Cc2cc(Cl)ccc2O)CCN1 1947764071 UCAYYRBURIEFIV-JTQLQIEISA-N 254.761 2.229 10 10 CECE Nc1ccc(OCCN2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)cc1 1877063771 NGFFVTRAVKKZQK-ITGUQSILSA-N 268.307 2.091 10 10 CECE Cc1sc(=N[C@@H](C)c2ccccc2O)[nH]c1C(=O)O 1877568464 GLDGGBDWWYQBLJ-ZETCQYMHSA-N 278.333 2.450 10 10 CECE CCOC(=O)[C@@H]1C[C@@H]1CN[C@@H](C)c1ccccc1O 1877570632 RQTHRHFARYZPMO-DMDPSCGWSA-N 263.337 2.242 10 10 CECE CC(C)C1(O)CN(c2c(F)cc([C@H](C)N)cc2F)C1 1880961146 TZDOEYQPKYNFLK-VIFPVBQESA-N 270.323 2.192 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc2c(s1)CCOC2 1963699247 OEVQNXOPLCQLCH-UHFFFAOYSA-N 266.326 2.251 10 10 CECE COc1cccc(CN2CCCC[C@@H](N(C)C)C2)c1O 1964584280 HMEMBKDLVJNTIA-CQSZACIVSA-N 278.396 2.317 10 10 CECE CCC[C@H](N)CC(=O)N(C)[C@@H](C)c1ccccc1O 135920271 FFKNSHVZLRFWBV-RYUDHWBXSA-N 264.369 2.429 10 10 CECE C[C@H](O)c1ccc(N2CCC(C(=O)N(C)C)CC2)cc1 2143656156 CORLOCHSVSHRQN-LBPRGKRZSA-N 276.380 2.045 10 10 CECE CCOC(=O)[C@H]1CNC[C@H]1c1cccc2c1ccn2C 1951624971 STPNBVSHDDFECO-KBPBESRZSA-N 272.348 2.044 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H]1CCS(=O)(=O)C1 250977681 JFNJBBNIQHBKLV-WOPDTQHZSA-N 295.404 2.026 10 10 CECE CCCN(CC(=O)N(C)C(C)C)Cc1ccccc1O 1969162720 MNXGHBNRLNEWKI-UHFFFAOYSA-N 278.396 2.471 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H](C)[C@H](C)S(C)(=O)=O)c1 1970400485 PQJPLVHAMZYJDD-SRVKXCTJSA-N 285.409 2.173 10 10 CECE Oc1ccc(-c2nc([C@H]3CCCOCC3)no2)cc1O 2145289936 XHKVPVIXMGJPTF-VIFPVBQESA-N 276.292 2.432 10 10 CECE O=C1Nc2cc(N3C[C@H]4CCC[C@H]3C4)c(F)cc2[C@H]1O 2145856277 WHWZGLMCCITEBL-UINNMSKDSA-N 276.311 2.190 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)CC(C)(C)CC(=O)O 2148897504 TUTLUGZQNMJYGF-UHFFFAOYSA-N 278.352 2.118 10 10 CECE Nc1ccc(CCCN2CC[C@H](CO)C(F)(F)C2)cc1 2146380788 JHKWJASDSSHNRC-CYBMUJFWSA-N 284.350 2.151 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H](N)c3ccco3)ccc21 2147626636 XTLHGZGXTVHFAU-HZPDHXFCSA-N 272.348 2.395 10 10 CECE C[S@](=O)C[C@@H](Nc1ccc(N)cc1)C(C)(C)C 1996699163 QTEUMPDXYYSQPE-PXAZEXFGSA-N 254.399 2.474 10 10 CECE Nc1ccc(NC(=O)N2C[C@H](O)CC3(CCC3)C2)cc1 2151349245 RJEXYFOLSNCLKJ-CYBMUJFWSA-N 275.352 2.038 10 10 CECE Nc1ccc(OCCNC(=O)[C@H]2CCC[C@@H](F)C2)cc1 2152324207 IQPLIXGKYTYPBS-NWDGAFQWSA-N 280.343 2.292 10 10 CECE Cc1cc(C)c(C(=O)NCCc2ccc(N)cc2)cn1 2153734769 IIFLVYTUDOORHQ-UHFFFAOYSA-N 269.348 2.253 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)c1cn(C(C)C)cn1 2154402230 KGAMLLUNIZYHPR-CABCVRRESA-N 275.352 2.164 10 10 CECE Oc1ccnc(NCc2ccc(Cl)cc2O)n1 2017528009 QSDVFJQDDFTOAW-UHFFFAOYSA-N 251.673 2.153 10 10 CECE CCCN(C)[C@@H](CN)c1ccc2c(c1)CCCN2C 50287094 OFOYZIIZONMNEH-INIZCTEOSA-N 261.413 2.411 10 10 CECE COc1ccc(N(C)[C@H]2CNC3(CCOCC3)C2)cc1 2155303073 UMBZMQSBYITQQL-CQSZACIVSA-N 276.380 2.043 10 10 CECE CCc1nnc([C@H](N)c2ccc(N(C)C)cc2)s1 2029158997 VPQBNNHRVBLAGD-GFCCVEGCSA-N 262.382 2.215 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1nc(C)cs1 2031163841 ZEKKWIDVZJDBKN-NWDGAFQWSA-N 264.350 2.151 10 10 CECE COc1ccc(N2CC[C@H](OC)[C@H](C)C2)c(N)c1 2031973807 IBJVHVLQGIHFQI-YGRLFVJLSA-N 250.342 2.139 10 10 CECE C[C@H]1CCO[C@@H]1CN(C)Cc1cc(F)ccc1O 2034983964 IFTIRLVTVPBAGA-IINYFYTJSA-N 253.317 2.388 10 10 CECE CN1[C@H]2CC[C@@H]1C[C@H](CNCc1ccc(O)cc1O)C2 2159190752 PWZJZBXPHLMPMM-UBSAEIQESA-N 276.380 2.060 10 10 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CN[C@H](C)c1ccc(N2CCN3CCC[C@H]3C2)cc1 251347250 FNJLRNSFVKGOPV-CJNGLKHVSA-N 259.397 2.251 10 10 CECE COc1cccc(O)c1CN1C[C@H](OC)C(C)(C)C1 1967791774 NMAWYAJTPZRJAL-AWEZNQCLSA-N 265.353 2.258 10 10 CECE FC1(F)C[C@@H]1NCc1ccc(N2CCOCC2)cc1 1969323203 MBUMEOMXYUQPAA-ZDUSSCGKSA-N 268.307 2.020 10 10 CECE Nc1ccc(CCNC(=O)[C@H]2CCCSC2)cc1 1969320856 PTDIZMFPHASDKR-LBPRGKRZSA-N 264.394 2.071 10 10 CECE Oc1cccc(Cl)c1CNC[C@@H]1[C@H]2CCOC[C@H]21 1972262668 MYHVUCVEIMUSCI-CKYFFXLPSA-N 267.756 2.418 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@@H]1CCS1(=O)=O 1972329060 RYLCMXCSGACQMP-GRYCIOLGSA-N 295.404 2.026 10 10 CECE NCc1ccc(N2CC[C@@H]2C2CCOCC2)c(F)c1F 2145744481 YVBYUBJSMWDOSA-GFCCVEGCSA-N 282.334 2.429 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3CCN(C)C[C@@H]3C2)cc1 2148896195 ZXBJRMOHQPRXNO-CWRNSKLLSA-N 273.424 2.484 10 10 CECE CC(C)C[C@H]1CCN1c1ccc2c(c1)N(C)C(=O)[C@H]2N 2148949423 UBUFDDGIFIBRST-DOMZBBRYSA-N 273.380 2.288 10 10 CECE C[C@@H]1C[C@@H](N)CCN1Cc1ccc2c(c1)CCCN2C 156072290 YSTCTWKAQOPCGW-CJNGLKHVSA-N 273.424 2.381 10 10 CECE CCOC(=O)C1(c2cc(O)c(O)c(C)c2C)CC1 260279386 JGZVOENNBBUKTR-UHFFFAOYSA-N 250.294 2.309 10 10 CECE CCOC(=O)CC1(c2cc(C)c(O)c(O)c2)CC1 260349786 MJHUXNXPDACVTJ-UHFFFAOYSA-N 250.294 2.391 10 10 CECE COC(=O)C1(F)CCN(c2ccc(OC)cc2)CC1 260569405 LKIXFONMHOEEBE-UHFFFAOYSA-N 267.300 2.177 10 10 CECE CCOC(=O)CC[C@@H](N)c1c(O)ccc(C)c1C 261011487 YJLQYHQICZJNAN-LLVKDONJSA-N 251.326 2.352 10 10 CECE C[C@H](c1ccccc1O)N(C)S(=O)(=O)N1CCCCC1 38089877 BPDDJJWQPPVLCS-GFCCVEGCSA-N 298.408 2.116 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1c(F)cncc1F 2148159208 DXVGNFKPOFDOTR-KBPBESRZSA-N 280.274 2.060 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](O)CC3(CCC3)C2)cc1O 2151343870 BJCUHQYKDJQPOA-AAEUAGOBSA-N 277.364 2.187 10 10 CECE CCCNCc1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)c(C)c1 2151396242 ISXOCNWNJBOQNI-UXLLHSPISA-N 274.408 2.312 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)COCC[C@@H]1CC 2152492775 YALDSJSATAKVME-MAZHCROVSA-N 279.380 2.220 10 10 CECE C[C@H](O)C12CCC(CC1)N2c1c(F)cc(CO)cc1F 2153394729 QANFLVDUGXUJLI-IEBVAXJPSA-N 283.318 2.339 10 10 CECE C[C@H]1[C@@H](CC(=O)O)CCN1Cc1ccc(N(C)C)cc1 2153479543 FIOOBYYCOUTXED-GXTWGEPZSA-N 276.380 2.438 10 10 CECE CC[C@H]1CCN(c2ccc3c(c2)OCCO3)CCCN1 49664219 ZJKLFSRLCSOMKO-ZDUSSCGKSA-N 276.380 2.426 10 10 CECE CCCNCc1ccc(OC)c(Cn2ccnc2)c1 50125484 XOOKLXGYBUNOAN-UHFFFAOYSA-N 259.353 2.440 10 10 CECE C[C@@H](CNC(=O)c1ccc(O)c(O)c1)CC(F)F 700016731 NXPQUQIKYVCTAE-SSDOTTSWSA-N 259.252 2.119 10 10 CECE Oc1cccc(Br)c1CN[C@H]1C[C@]12CCOC2 2021248120 NDDXEVBUEGJZCB-STQMWFEESA-N 298.180 2.423 10 10 CECE Nc1ccc(OCCCN2CCCCCO2)cc1 2029782653 LSOBTQLAJMNMGK-UHFFFAOYSA-N 250.342 2.455 10 10 CECE CCC[C@@H](O)CCN[C@@H](C)c1ccc(O)cc1O 2029922089 KGCSAQJKGLVBPG-WDEREUQCSA-N 253.342 2.300 10 10 CECE CN(C)[C@]1(C)CCN(Cc2cc(F)ccc2O)C1 2032598033 LXVMCDPTTWKISJ-CQSZACIVSA-N 252.333 2.057 10 10 CECE Cn1ncc(CNCc2cccc(F)c2O)c1Cl 2033338695 ZROAPJPHTYPJTD-UHFFFAOYSA-N 269.707 2.208 10 10 CECE C[C@H]1CCN(c2ccc(CN)c(Br)c2)C[C@H]1O 300295789 REAAZVVSZINMIP-TVQRCGJNSA-N 299.212 2.115 10 10 CECE CN(C)[C@H]1CC[C@H]1NCc1ccc(N2CCCC2)cc1 2157700408 LSUIOLLBXORYJR-SJORKVTESA-N 273.424 2.469 10 10 CECE CSC[C@@H]1CCCN1c1cc2c(cc1N)OCCO2 400221459 MBFBPTMJYMECBP-JTQLQIEISA-N 280.393 2.372 10 10 CECE CC(F)(F)[C@@H]1CCCN1c1ccc2c(c1)NC(=O)[C@@H]2N 2160123134 RGNSZPNQBJQKDE-NWDGAFQWSA-N 281.306 2.263 10 10 CECE COc1ccc(F)cc1[C@H](NCCCN=[N+]=[N-])C(=O)O 313018616 CSWRBVSUCGLNHV-NSHDSACASA-N 282.275 2.250 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCC[C@@H]1CCC(=O)O 313339453 MHDOBDWKWWWJHP-WDEREUQCSA-N 279.336 2.488 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCCN3)CCS1(=O)=O 2170259290 GCCAUIRITJDHNZ-UHFFFAOYSA-N 294.420 2.058 10 10 CECE COC(OC)[C@@H](C)NCc1ccc2c(c1)CCCN2C 79585158 OQFIVCBZIPOGJS-GFCCVEGCSA-N 278.396 2.166 10 10 CECE CC(C)c1nc(C(=O)NCCc2ccc(N)cc2)co1 2160616567 JVRVOBGIVBGCKH-UHFFFAOYSA-N 273.336 2.353 10 10 CECE CC1(C)CCN(Cc2cccc(F)c2O)CC[S@@]1=O 322101101 JFZJLATVLMETIR-IBGZPJMESA-N 285.384 2.264 10 10 CECE CCOC(CCNCc1ccc(OC)cc1O)OCC 2161090851 AZVLEILANGCVPZ-UHFFFAOYSA-N 283.368 2.280 10 10 CECE CN(c1ccc(CN)cc1F)[C@@H]1CO[C@H](C2CC2)C1 701168010 SLLQXIDZGPNJDP-WFASDCNBSA-N 264.344 2.288 10 10 CECE CN[C@H](C)c1ccc(N2CCOCC3(CC3)C2)cc1O 2171033645 GBEKVIHDXDECPV-GFCCVEGCSA-N 276.380 2.289 10 10 CECE CN[C@@H](C)c1ccc(N(CCOC)C2CC2)cc1O 93670955 CWWIIKYMFQJDOU-NSHDSACASA-N 264.369 2.288 10 10 CECE Cc1cc(C)n(C2CN(c3ccc(CN)cc3C)C2)n1 2171510654 XZVAHLOGRPLQFN-UHFFFAOYSA-N 270.380 2.328 10 10 CECE C[C@@H]1CN(c2cc3c(cc2Cl)[C@H](O)C(=O)N3)[C@@H]1C 706802476 QNJZDLUYULQPLW-QHMRUWFYSA-N 266.728 2.170 10 10 CECE O=C1CCCN1[C@@H]1CCN(c2ccc(CO)c(Cl)c2)C1 2171703086 XZFRPZDGGVKHRN-CYBMUJFWSA-N 294.782 2.033 10 10 CECE CC[C@H]1C[C@](CN)(N(C)c2ccc(OC)cc2)CO1 688504777 UKBXTNMMWCJBBT-DZGCQCFKSA-N 264.369 2.028 10 10 CECE CNCc1cc(F)c(N(C)Cc2nnc(C)o2)c(F)c1 2171826574 PWFFSSKMDPCMBW-UHFFFAOYSA-N 282.294 2.012 10 10 CECE CCCOc1ccc(N2C[C@H](N)C[C@@]23CCOC3)cc1 2162635068 IXNVDILMRIDBOP-CZUORRHYSA-N 276.380 2.172 10 10 CECE C[C@H]1C[S@@](=O)CCN1Cc1c(O)ccc2ccccc12 2171989059 XFJZFKBSDHDDHH-YUNKPMOVSA-N 289.400 2.498 10 10 CECE CN(C[C@H](O)C1CC1)c1ccc(CO)c(Cl)c1 690225949 SGIOTYNPEJICLD-ZDUSSCGKSA-N 255.745 2.039 10 10 CECE CC(C)[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)CO1 691413665 ZQTUWIADYPEMQZ-AAEUAGOBSA-N 279.336 2.024 10 10 CECE O=C(NCC1C[C@H]2[C@H](C1)C2(F)F)c1ccc(O)c(O)c1 693340508 NXLBWROILSBIDJ-UWVGGRQHSA-N 283.274 2.119 10 10 CECE CN[C@H](C)c1ccc(N2CC(C)(O)C2)cc1Cl 384035107 HWTUZTGTKWCYCV-SECBINFHSA-N 254.761 2.191 10 10 CECE CCCC1(O)CN(c2ccc(CN)c(Cl)c2)C1 384000149 RWIHHPHLWVIHFL-UHFFFAOYSA-N 254.761 2.150 10 10 CECE CCC1(O)CN(c2ccc(CNC3CC3)cc2F)C1 384082790 ZGZGYVYXRCQCQY-UHFFFAOYSA-N 264.344 2.039 10 10 CECE C[C@H](c1ccccc1O)N1C[C@H]2[C@H](N3CCCC3)[C@H]2C1 384519274 HNTWTIZVJNYGPF-UTXMOHQDSA-N 272.392 2.479 10 10 CECE C[C@H](NCc1cccc(Cl)c1O)c1cn(C)nn1 720522067 FXKTUDOVWCAALH-QMMMGPOBSA-N 266.732 2.025 10 10 CECE Cc1nccnc1CN(C)c1c(F)cc(CO)cc1F 699535269 FPENFHOUWFLVPA-UHFFFAOYSA-N 279.290 2.192 10 10 CECE Cc1cn(C)nc1CN1CCc2cc([C@H](C)N)ccc21 724011368 REPHYIDLJGOJIC-LBPRGKRZSA-N 270.380 2.311 10 10 CECE CC[C@@H]1C[C@H](C)CN1c1ccc2c(c1)N(C)C(=O)[C@@H]2N 399168487 KREJMODJNLQFSY-FIXISWKDSA-N 273.380 2.288 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H]2COC[C@H]2OC)cc1 2177271007 MRRWTGKJLVIPQT-DAXOMENPSA-N 278.396 2.207 10 10 CECE Cc1ccc([C@H](C)N[C@@H]2CCCC[C@H]2C(N)=O)c(O)c1 2174107771 RGEQPAJDXZFMCF-IACUBPJLSA-N 276.380 2.395 10 10 CECE CNCc1ccnn1Cc1cccc(Cl)c1O 2069871021 RVTNQEHOMFNVTM-UHFFFAOYSA-N 251.717 2.010 10 10 CECE COc1ccc(Cn2nc(C3CCC3)cc2CN)c(O)c1 2070082040 HKQIPXMSEAXBGX-UHFFFAOYSA-N 287.363 2.372 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@H]1CC[C@@H](OC)C1 2174922831 YCEJVAJCEYSYGK-UKRRQHHQSA-N 276.380 2.432 10 10 CECE CN1CCCc2cc([C@H](O)[C@](C)(N)CC(F)F)ccc21 2175095085 KZHVTRALKUKABV-LSDHHAIUSA-N 284.350 2.475 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OCO3)C[C@@H]1CNC1CC1 2169429333 XFTIQABSWRVLQX-NEPJUHHUSA-N 274.364 2.240 10 10 CECE CN1CCc2cc([C@H](O)C(=O)[C@H]3CCC[C@@H]3F)ccc21 2175534617 ZEYFKYOTFIDZOI-YDHLFZDLSA-N 277.339 2.420 10 10 CECE CN[C@@H](C)c1ccc(N2CC(n3cnnc3)C2)cc1Cl 2170187125 IBIGKYWPJYRGEQ-JTQLQIEISA-N 291.786 2.273 10 10 CECE OCc1cnn(Cc2c(O)cccc2F)c1C(F)(F)F 2079063021 ZZTGMXNKZUBJPK-UHFFFAOYSA-N 290.216 2.287 10 10 CECE CN(CCOc1ccc(N)cc1)Cc1cccc(O)c1 2192605074 OEFMVTRVHWVZJW-UHFFFAOYSA-N 272.348 2.485 10 10 CECE Oc1cccc(F)c1CN1CCN2CCCC[C@H]2C1 1137837911 YQZJBBWNRFRCTE-LBPRGKRZSA-N 264.344 2.201 10 10 CECE CCc1cc(O)n2nc(C3CCC3)c(C(=O)OC)c2n1 2080916705 CEZMZEHJLHMNSF-UHFFFAOYSA-N 275.308 2.051 10 10 CECE Cc1ccc(N(C)C(=O)COc2ccc(N)cc2)cn1 2196753943 YIHPFBHFFRQTCL-UHFFFAOYSA-N 271.320 2.014 10 10 CECE Oc1cc(-c2nc([C@@H]3CCCCO3)no2)cc(O)c1O 2188921642 CHOCJBITZDBDGJ-JTQLQIEISA-N 278.264 2.095 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@]12CCCNC2 2182059239 FIVHSGNPZHWYOI-WBMJQRKESA-N 276.380 2.377 10 10 CECE COC[C@@H]1C=CCCN1c1cc(OC)c(OC)cc1N 2182378004 XUSZXDFWPSBSDY-NSHDSACASA-N 278.352 2.067 10 10 CECE O=C(c1ccc(O)c(O)c1)N1C[C@@H]2CC(F)(F)C[C@H]2C1 2182838723 TZGXECOEPCYWAI-UWVGGRQHSA-N 283.274 2.215 10 10 CECE CCCCN(CC(N)=O)c1ccc2c(c1)CCC[C@H]2O 2184691587 PYQINOQJFSVNFT-OAHLLOKOSA-N 276.380 2.148 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@@H](F)[C@H](CO)C3)ccc21 2184688365 YGWREGOAXLDLHB-APHBMKBZSA-N 278.371 2.050 10 10 CECE O[C@H]1CCc2cc(N3CCCN4CCC[C@@H]4C3)ccc21 2184735536 HVUIBYCIUCAJQY-WBVHZDCISA-N 272.392 2.341 10 10 CECE CCCn1c(O)nnc1Sc1ncc([C@H](C)N)s1 2041816230 KMJKPBNCMHEUHJ-LURJTMIESA-N 285.398 2.021 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCOC[C@@H]2C(F)F)c(F)c1 2194704886 RHPTVYKTNBKBIC-RDDDGLTNSA-N 292.276 2.455 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@H](N)[C@H]3C2)c(F)c1 2044282448 XVZJUWHHLLDWDX-XHVZSJERSA-N 250.317 2.008 10 10 CECE CN[C@@H](C[C@H](O)c1ccc(N(C)C)cc1)C(F)F 2044715841 WWSSDULUOYTIDE-RYUDHWBXSA-N 258.312 2.029 10 10 CECE CN1CCc2cc([C@H](NN)[C@@H]3[C@H]4[C@H]5C[C@@H]3C[C@H]54)ccc21 2190933403 LWXWNFCKVOQGOH-YMWMKHGGSA-N 269.392 2.085 10 10 CECE CNCc1ccc(N2CC[C@@H]3C[C@]3(O)C2)c(Cl)c1 2051364383 YIORDNAAPBIQKO-RISCZKNCSA-N 266.772 2.021 10 10 CECE COC[C@@H](CF)N[C@@H](C)c1cc(OC)ccc1O 2053071209 KYADHLRCAQCFLU-VHSXEESVSA-N 257.305 2.036 10 10 CECE C[C@@H](O)c1ccc(N2CC=CC[C@@H]2CO)c(F)c1 2056315839 VFWRSXMQADZDCO-ZYHUDNBSSA-N 251.301 2.006 10 10 CECE Nc1cccc(Cl)c1N[C@H]1CCC[C@H]1N1CCNCC1 2191553616 RCLQGZQTDVVNSP-UONOGXRCSA-N 294.830 2.160 10 10 CECE Nc1ccc(CNC(=O)c2cc(N)c(F)cc2F)cc1 2191747860 NTPSOPRSIYEQIF-UHFFFAOYSA-N 277.274 2.059 10 10 CECE CO[C@@H]1CC[C@@H]1CCN(C)C(=O)Cc1ccc(N)cc1 2186880445 YMXSHHPQGVNYKN-UKRRQHHQSA-N 276.380 2.085 10 10 CECE COC(=O)NC[C@H]1CCN1c1ccc([C@@H](C)N)cc1Cl 2187290003 ASECRCJYYVOCLA-MWLCHTKSSA-N 297.786 2.294 10 10 CECE COCCN(C)C1CN(c2ccc([C@@H](C)O)cc2Cl)C1 2192537907 TXOWQUCERXSSJG-LLVKDONJSA-N 298.814 2.160 10 10 CECE CCO[C@@H]1CNCC[C@@H]1Nc1c(N)cccc1Cl 2071584471 KTAUNFNCOZEPFF-NWDGAFQWSA-N 269.776 2.101 10 10 CECE C[C@H](c1ccccc1O)N(C)CCCCC(N)=O 2072464197 YSHACNWSLPTXBV-LLVKDONJSA-N 250.342 2.041 10 10 CECE CO[C@@]1(C)CCN(c2ccc(CN)cc2)C[C@]1(C)OC 2199617312 GCLMBECSUOZGNR-HOTGVXAUSA-N 278.396 2.166 10 10 CECE O=C(NCc1ccccc1O)[C@H]1C[C@H]1C1CCOCC1 2199990150 PHCHSTLIVLAJIC-KBPBESRZSA-N 275.348 2.071 10 10 CECE COC[C@](C)(CN[C@@H](C)c1ccccc1O)OC 2077506916 KMYBXNOJIPHFTO-FZMZJTMJSA-N 253.342 2.094 10 10 CECE COC[C@](C)(OC)c1noc(-c2sccc2O)n1 2077510673 PEQLNWOLWFVJHU-NSHDSACASA-N 270.310 2.012 10 10 CECE C[C@H]1OC2(C)CC1(C(=O)N1CCC[C@@H](N=[N+]=[N-])C1)C2 2100449001 XZKOTNIMWXTGPR-ITSCGTHASA-N 264.329 2.245 10 10 CECE CO[C@@H]1C[C@]2(C(=O)N3CCC[C@H](N=[N+]=[N-])CC3)C[C@H]12 2101264861 DRRWPJLPUKKHNQ-SBFPOUOMSA-N 264.329 2.103 10 10 CECE C[C@@H](CN[C@H](C)c1ccc(N(C)C)cc1)N1CCC1 2102994791 DWKXAXLPXOBCGX-UONOGXRCSA-N 261.413 2.497 10 10 CECE Cc1ocnc1CN(C)c1ccc(CN)c(F)c1F 2104083742 CLMHZKACVLQBFM-UHFFFAOYSA-N 267.279 2.356 10 10 CECE COc1cccc(O)c1CNCCc1ccccn1 2104435243 ZSVNQZJPFRFQRZ-UHFFFAOYSA-N 258.321 2.128 10 10 CECE CN1CC[C@@H]2CCN(Cc3c(O)cccc3F)C[C@H]21 2104476318 DTDSMAJBZPQRQE-BXUZGUMPSA-N 264.344 2.057 10 10 CECE CN(Cc1cc(N)ccc1O)[C@@H]1CCOC(C)(C)C1 2105223263 NPUDJCREAYZKMA-CYBMUJFWSA-N 264.369 2.364 10 10 CECE CC[C@@H]1CN(c2ccc(OC)cc2OC)CC[C@H]1N 2106331619 NDPWNIXUMWOJGX-DGCLKSJQSA-N 264.369 2.267 10 10 CECE CC(C)[C@@H](N)CCN(C)c1ccc2c(c1)CCN2C 2106792410 CPUXGGAAGRJYCQ-HNNXBMFYSA-N 261.413 2.489 10 10 CECE CN1CCCc2cc([C@@](C)(O)[C@H]3CCCO3)ccc21 2106826859 XGWMWWJQOBRCLK-HZPDHXFCSA-N 261.365 2.456 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H]3CCCCN3)ccc21 2106802111 SCLWHZMYZSOALR-GOEBONIOSA-N 260.381 2.245 10 10 CECE CN1CCc2cc([C@H](NN)c3ccc(Cl)o3)ccc21 2106862845 ZODPOEWPUMMYQP-AWEZNQCLSA-N 277.755 2.478 10 10 CECE N[C@H](CN1CCCC1)c1ccc(N2CCCC2)cc1 2106828404 MNKNDTSSASGFJF-MRXNPFEDSA-N 259.397 2.382 10 10 CECE CN1CCC[C@@H]1[C@@H](N)c1ccc(N2CCCC2)cc1 2106829386 WIHJPSZQORSFEM-CVEARBPZSA-N 259.397 2.381 10 10 CECE C[C@@H]1SCCC[C@@]1(O)[C@H](N)c1ccc(N(C)C)cc1 2106855517 PAEMVURBEAYEAB-GLQYFDAESA-N 280.437 2.399 10 10 CECE CCc1cnn(C)c1C(=O)c1cccc2c1NCC2 2107700232 LJBBMWXHIAUHNP-UHFFFAOYSA-N 255.321 2.182 10 10 CECE CN(c1ccc(CN)cc1)C1(CO)CC2(CCC2)C1 2108318540 YTKBTVPBVCJGGT-UHFFFAOYSA-N 260.381 2.277 10 10 CECE NC(=O)c1cccc(N)c1N[C@H]1[C@H]2C=CC[C@H]1CC2 2108866478 WRSJZUYDOKFGPX-KWBADKCTSA-N 257.337 2.134 10 10 CECE CN1CC[C@H]2CN(Cc3ccc(Cl)cc3O)C[C@H]2C1 2090126628 IRXMNMPCAMLOGU-WCQYABFASA-N 280.799 2.429 10 10 CECE CCc1nccnc1NCCc1ccc(O)c(O)c1 2091759456 MAZMSASOENLUQQ-UHFFFAOYSA-N 259.309 2.105 10 10 CECE Oc1ccc(CCNc2ncc(F)cc2F)cc1O 2091750617 GKVQPZOVPKKXEV-UHFFFAOYSA-N 266.247 2.426 10 10 CECE CN1CCc2cc([C@@](C)(N)[C@@H]3CCCOC3)ccc21 2112053284 AKFYBTVGIIMTDC-GDBMZVCRSA-N 260.381 2.279 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](C)[C@H](O)C[C@@H]2C)cc1O 2093108062 KFHWVUSNPRUPRS-AYGWYOGXSA-N 265.353 2.041 10 10 CECE OCc1ccc(N2CC[C@H](O)C(F)(F)CC2)cc1Cl 2093623863 JMUYIMZNVSGDLZ-LBPRGKRZSA-N 291.725 2.429 10 10 CECE CC[C@@]1(O)CCN(c2ccc([C@H](C)NC)cc2F)C1 2094380221 OTNGTKWGUAISQY-XHDPSFHLSA-N 266.360 2.457 10 10 CECE Cc1cc(CN)ccc1N1CCOC[C@H](C2CC2)C1 2096559903 DWWIUWXQRYVBBS-OAHLLOKOSA-N 260.381 2.317 10 10 CECE CN(C(=O)COC1CC(C)(C)C1)c1ccc(N)cc1 2096974000 XXVURGFJNNIYRU-UHFFFAOYSA-N 262.353 2.437 10 10 CECE Oc1cccc(-c2nc(CC3CC(F)C3)no2)c1O 2096986835 IFHIMBCINYLUHQ-UHFFFAOYSA-N 264.256 2.438 10 10 CECE CC1(C)[C@H](CNCc2ccc(O)c(O)c2O)C1(F)F 2097357824 GIXYPPZCAUMHJB-VIFPVBQESA-N 273.279 2.184 10 10 CECE CCCn1cnnc1CN1CCC[C@H](N=[N+]=[N-])CC1 2099330714 ZRWPXQRPWDZTMJ-NSHDSACASA-N 263.349 2.353 10 10 CECE CS[C@H]1CN(c2ccc([C@@H](C)N)cc2)C[C@@H]1N(C)C 2114271000 DHBOQSCZFJQPSN-UGFHNGPFSA-N 279.453 2.188 10 10 CECE CNCc1ccc(N2CC[C@@H](O)CC2(C)C)cc1OC 2204554063 KYVMOHGPHOJJEJ-CQSZACIVSA-N 278.396 2.154 10 10 CECE O=C(O)C1[C@H]2CC[C@H]1CN(Cc1ccc(F)cc1O)C2 2204632551 HIGXCSORSCRZPM-QWRGUYRKSA-N 279.311 2.074 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@H]2C[C@H]3COC[C@H](C3)C2)CC1 2206854875 HVQDVNQCXZNTMK-ZSBIGDGJSA-N 278.356 2.256 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cncc(Cl)n1 2218741921 PBXMGYHVBSVXKM-RNFRBKRXSA-N 266.692 2.091 10 10 CECE C[C@@H]1C[C@H](O)[C@@H](C)N(c2ccc(CO)cc2Cl)C1 2220344056 KFVMDEKXLLLXCQ-RULNRJAQSA-N 269.772 2.428 10 10 CECE CC[C@@H]1CN[C@H](C)CN1c1ccc(OC)cc1F 2220311967 DYRZWGKTZOBHLO-GHMZBOCLSA-N 252.333 2.411 10 10 CECE CC[C@H](C)NCc1ccc(N2CC[C@@H](CO)C2)cc1 2231461471 RUXRDHPKWHWWNS-DZGCQCFKSA-N 262.397 2.393 10 10 CECE O[C@H]1CCCc2cc(N3CC[C@@H]4[C@H](O)C[C@H]4C3)ccc21 2232788909 GBLNXDXULFYJEN-OSMBCOQSSA-N 273.376 2.263 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1OC[C@H]2CCCC[C@@H]21 2233185765 MTWQGGMLCABUKU-MROQNXINSA-N 278.356 2.493 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)N)cc2C)C[C@@H]1F 2223971462 NHFSMUBCHOEGAA-VHRBIJSZSA-N 252.333 2.188 10 10 CECE CC(C)(CC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1)C(=O)O 2234167303 VJNGPEAFAQBZRL-SNVBAGLBSA-N 282.344 2.426 10 10 CECE C[C@@H](c1c(O)cccc1O)N1[C@H]2CCC[C@@H]1CN(C)C2 2234737625 HZEDNLCOIYPJME-RWMBFGLXSA-N 276.380 2.327 10 10 CECE CCCO[C@@H]1CCN(c2ccc(OC)cc2CNC)C1 2235958025 ILNVMGOGYMGCEX-OAHLLOKOSA-N 278.396 2.420 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@@]23CCOC3)c(CO)c1 2236004549 YIIYYVUQBGMREQ-CZUORRHYSA-N 277.364 2.050 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](CO)CC2CC2)c(F)c1 2226154342 UBILHVNCJACCCR-MFKMUULPSA-N 267.344 2.476 10 10 CECE N[C@@H]1C[C@H]2C[C@H]1CN(c1ccc(OC3CC3)cc1)C2 2226530880 FFHBGDWHNYUKSN-BFQNTYOBSA-N 258.365 2.401 10 10 CECE C[C@@H]1Cc2cc(N(CCO)CC(F)(F)F)ccc2O1 2226697883 WIRMKIQSGMHPJF-SECBINFHSA-N 275.270 2.371 10 10 CECE CN(CC1(CO)CC1)c1ccc2c(c1)OC(F)(F)O2 2226700005 ONPJIQDESRLDLE-UHFFFAOYSA-N 271.263 2.217 10 10 CECE COc1ccc(N2CC[C@H](C3(O)CC3)C2)c(OC)c1 2226806760 OUBBQDKYBMJYAN-NSHDSACASA-N 263.337 2.055 10 10 CECE COc1ccc(N2CC([C@@H]3CC3(F)F)C2)c(CO)c1 2227709999 AKFALVMVNUGKOG-LBPRGKRZSA-N 269.291 2.279 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CC[C@]3(OC)C2)cc1O 2239096163 NOXBWUOUDZCZPV-WQGACYEGSA-N 276.380 2.288 10 10 CECE O[C@@H]1CCN(c2ccc(CNC3CCC3)cc2)C[C@@H]1F 2240044639 PZHYAVLXPLYLAX-JKSUJKDBSA-N 278.371 2.238 10 10 CECE CCS(=O)(=O)CCN(C)c1ccc([C@@H](C)NC)cc1C 2240835595 JZCMEBFRBLCZTQ-CYBMUJFWSA-N 298.452 2.146 10 10 CECE CC(C)(C)OC(=O)NC[C@@]12C[C@@H]1CN(CCN=[N+]=[N-])C2 2242101959 DWVYBPSBVKFBQN-ZWNOBZJWSA-N 281.360 2.143 10 10 CECE Cc1cc(N(C)CCCC(=O)N(C)C)ccc1[C@@H](C)O 2285159132 COICKSIQRKYEPS-CYBMUJFWSA-N 278.396 2.353 10 10 CECE CSc1ncc(CN2CC[C@@H](CNC3CC3)C2)s1 2257127395 NICUIARPNSJWKR-JTQLQIEISA-N 283.466 2.439 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2COC3(COC3)C2)c(Cl)c1 2286270961 QJFIVFMLKGABNH-CMPLNLGQSA-N 297.782 2.387 10 10 CECE CCOC(=O)C=CCNCc1cnc(SC)s1 2248614381 RLLQBDIWYJRSDA-UHFFFAOYSA-N 272.395 2.074 10 10 CECE CSc1ncc(CNCCC[C@H]2CCCN2)s1 2248727747 HUQVYMYXFLQGHV-JTQLQIEISA-N 271.455 2.487 10 10 CECE COc1cc(OC)c(N2CC(C3CNC3)C2)cc1Cl 2270382086 ODLAKXAAFCWPBX-UHFFFAOYSA-N 282.771 2.013 10 10 CECE COc1ccc(N2CC[C@@H](N)[C@H](C)C2)c(OC)c1C 2278040024 MUESHYHGSFBLDL-ZYHUDNBSSA-N 264.369 2.186 10 10 CECE CSc1ncc(CNC(=O)[C@@H]2CCC(C)(C)CN2)s1 2269092788 KSNWSEQCBXOREO-JTQLQIEISA-N 299.465 2.259 10 10 CECE CC1(C)[C@@H]2C[C@@H]2CN1CC(=O)c1ccc(O)c(O)c1 2269278922 IRWSOGHIAFFHST-GHMZBOCLSA-N 261.321 2.011 10 10 CECE Cc1cc(N2C[C@H](CO)C3(CC3)C2)ccc1[C@H](C)N 2269665159 FRNPQPWVEUOPER-QWHCGFSZSA-N 260.381 2.223 10 10 CECE Oc1ccc(CNCC23CC(C(F)F)(CO2)C3)cc1O 2281012396 QLRHWXLGOKYXGQ-UHFFFAOYSA-N 285.290 2.002 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2nncs2)c([N+](=O)[O-])c1 2281347999 BTHSUIBGLVBFBU-QMMMGPOBSA-N 294.336 2.136 10 10 CECE CCCN[C@@H](c1ccccc1O)C1CC(S(C)(=O)=O)C1 2285372210 VIVYPJLSYGTFCQ-KOHJWAIASA-N 297.420 2.256 10 10 CECE CCc1ccnc(NS(=O)(=O)Cc2ccc(N)cc2)c1 2295800594 ZCRHEOSKFGIGDO-UHFFFAOYSA-N 291.376 2.168 10 10 CECE FCOc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CNC[C@H]32)cc1 2295961239 OTEZDVCZJAZUMU-FWYOQMDTSA-N 276.355 2.427 10 10 CECE O=C(O)CCC[C@H]1CCN(Cc2ccc(O)c(O)c2)C1 2296216062 GYIDQBQOXYUKCS-NSHDSACASA-N 279.336 2.175 10 10 CECE CC[C@@H](C)[C@H](NC(=O)c1cc(O)c(O)c(O)c1)C(F)F 2287319323 XTLBSVQIFZTVOR-LDWIPMOCSA-N 289.278 2.213 10 10 CECE Nc1ccc(OCC(=O)N[C@@]23CCCC[C@H]2CC3)cc1 2289016805 VEOUDFMPIXDJDE-BLLLJJGKSA-N 274.364 2.487 10 10 CECE CN(Cc1ncoc1CCN)c1ccc(Cl)cc1 2296731902 KOAHSACYAVXESH-UHFFFAOYSA-N 265.744 2.466 10 10 CECE O=C1N=C(N2CCCC2)SC1=Cc1ccccc1O 2297312897 ILHRMOKBPRPPSM-UHFFFAOYSA-N 274.345 2.458 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)Nc1cccnc1 2307978919 WEXOTYMWLNRDHU-UHFFFAOYSA-N 256.261 2.145 10 10 CECE CCc1nnsc1CNCCc1ccc(N)cc1 2314413170 UJFSDSOMMLEJAF-UHFFFAOYSA-N 262.382 2.015 10 10 CECE OC[C@@H]1C[C@H]2CC[C@@H]1N2c1ccc2c(c1)CC[C@H]2O 2331551595 NUMBMOLXFAAFSK-RUAUBTSSSA-N 259.349 2.016 10 10 CECE NCc1ccc(N2C[C@@H]3CCC[C@@](CO)(C3)C2)cc1 2332617740 IFPGYIFXFRHYHI-GDBMZVCRSA-N 260.381 2.134 10 10 CECE Cc1ccc(CNC[C@@]2(O)C[C@@H]3CCC[C@@H]32)c(O)c1 2333190974 OICPXWQQDUAHEM-NOLJZWGESA-N 261.365 2.341 10 10 CECE C[C@@H](c1ccccc1O)N(C)C[C@H]1[C@H]2CNCC[C@H]21 2333119779 GFGRALOLXJVIJB-PMOUVXMZSA-N 260.381 2.241 10 10 CECE N[C@H]1C[C@@H]2C[C@H]1CN(c1ccc(OC3CC3)cc1)C2 2333673366 FFHBGDWHNYUKSN-MKBNYLNASA-N 258.365 2.401 10 10 CECE Cc1cc(N2C[C@H]3CC[C@H]2C[C@@H]3O)ccc1[C@@H](C)O 2337168823 BCSYZELGINKPHY-HLSYRSCKSA-N 261.365 2.398 10 10 CECE COCc1ncc(N[C@H](C)c2ccccc2O)n1C 2338187564 FRSNSDVYEKFQIG-SNVBAGLBSA-N 261.325 2.445 10 10 CECE Cc1cc(CO)ccc1N1C[C@H]2CC(O)C[C@@H](C2)C1 2338906560 PNWXOZAXTPETLX-ZIAGYGMSSA-N 261.365 2.085 10 10 CECE OCc1ccc(N2CC=CC[C@@H]2CO)cc1C1CC1 2339143162 HPJKESDFWRVZDR-OAHLLOKOSA-N 259.349 2.184 10 10 CECE CN(c1ccc(OC2CCC2)cc1)[C@@H]1CNC[C@H]1F 2343613080 CAPREPBVWAOQOI-HUUCEWRRSA-N 264.344 2.364 10 10 CECE CO[C@@H]1COCCN(c2ccc([C@H](C)N)cc2Cl)C1 2351647773 GHUFOQFAOVCTOT-JQWIXIFHSA-N 284.787 2.211 10 10 CECE Cc1cnc(N(C)c2cccnc2)cc1C[C@@H](C)N 2352271504 JSVRPXZIJMQPKY-GFCCVEGCSA-N 256.353 2.443 10 10 CECE Nc1ccc(CCCNC[C@@H]2O[C@H]3CC[C@H]2C3)cc1 2352712754 PVVPPTNWUFKNKR-BPUTZDHNSA-N 260.381 2.359 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CCN1[C@@H](C)c1c(O)cccc1O 2353890843 OGZSPWSWLSDRPL-DCAQKATOSA-N 279.336 2.344 10 10 CECE COc1cccc(CN[C@@H]2C[C@@H]3CC[C@@]2(CO)C3)c1O 2354527935 YAXQDJHADHEFNB-PEYYIBSZSA-N 277.364 2.042 10 10 CECE CO[C@@]1(C)C[C@@H]2C[C@H]1C[C@H]2NCc1cccc(O)c1O 2356193515 XGKQNFQJYQUDSC-JFILPPLUSA-N 277.364 2.391 10 10 CECE O=C1C[C@@H]2CC[C@@H](C1)N2c1ccc2c(c1)OCCO2 107903377 MLAOPFHSUQRFBI-QWRGUYRKSA-N 259.305 2.158 10 10 CECE CNC(=O)c1ccc(N[C@H](C)c2ccc(N(C)C)cc2)nn1 302421814 OIDZXEZKPGESBT-LLVKDONJSA-N 299.378 2.075 10 10 CECE C[C@@H](NCCc1nccs1)c1ccc(O)cc1O 63133466 OZMURMWMSBMMFF-SECBINFHSA-N 264.350 2.448 10 10 CECE CCOCC(C)(C)CNCc1ccc(O)c(O)c1 311108355 UMOMALDWGYXTPQ-UHFFFAOYSA-N 253.342 2.250 10 10 CECE COCCNCc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1C 62734286 CHLBRIILBAGKBI-GJZGRUSLSA-N 292.423 2.345 10 10 CECE O=C(O)/C=C/c1ccc(N2CCn3ccnc3C2)c(F)c1 62255121 QHTCQXSROHJPNX-DUXPYHPUSA-N 287.294 2.140 10 10 CECE N[C@H](CC(=O)O)c1cc(Cl)c(Br)cc1O 308936114 CQSQRBNVIAJOIB-SSDOTTSWSA-N 294.532 2.283 10 10 CECE CCOc1ccc(N2CCCN[C@H](C)C2)cc1F 126717964 AFSHUTVJPVNDJO-LLVKDONJSA-N 252.333 2.413 10 10 CECE CCO[C@@H]1C[C@@H](NCc2ccccc2O)C12CCOCC2 186307527 PHRWKNUVALYRIP-HZPDHXFCSA-N 291.391 2.456 10 10 CECE C[C@@H](C(=O)N1CCCC1)N(c1ccc(CN)cc1)C1CC1 34655544 SYPDMGSWSRJJHX-ZDUSSCGKSA-N 287.407 2.125 10 10 CECE COc1ccc(C2(N)CC2)c(O)c1Br 217943618 UTQRKJHTBUCBRP-UHFFFAOYSA-N 258.115 2.111 10 10 CECE CC(C)(C)OC(=O)Nc1cccc([C@H](N)C2(O)CC2)c1O 1952885507 ZXIAXLLLADEMOI-LBPRGKRZSA-N 294.351 2.264 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)CCCC(=O)O 86802482 QQFUQSWFDMLOLZ-SECBINFHSA-N 255.289 2.389 10 10 CECE COc1ccc(O)c(CN(C)C[C@@H]2CCCO2)c1 132958069 HURCLGZFKOYFIE-ZDUSSCGKSA-N 251.326 2.012 10 10 CECE CS[C@@H]1CCCC[C@H]1Nc1c(N)cccc1C(N)=O 235069157 NSEGXSLVPYWMSX-VXGBXAGGSA-N 279.409 2.454 10 10 CECE C[C@H](N)c1cc([N+](=O)[O-])c(Br)cc1O 238421876 XBWPZMPMAVADTH-BYPYZUCNSA-N 261.075 2.083 10 10 CECE Cc1cc(O)c([C@H]2CCN2)cc1I 238490663 ZLHQVLSKHPPHIK-SECBINFHSA-N 289.116 2.340 10 10 CECE N[C@H](c1cccc(Br)c1O)C(F)F 238653929 SCMFYCYETCGQSU-ZCFIWIBFSA-N 252.058 2.420 10 10 CECE COc1ccc(O)c(CN[C@@]23C[C@H]2COC3(C)C)c1 529640772 DJDVMHAUUDEKND-NHYWBVRUSA-N 263.337 2.058 10 10 CECE Cc1cccc(O)c1CN1CC[C@H]2NCCC[C@H]2C1 1237415616 QEOUCTNYORFBOV-DZGCQCFKSA-N 260.381 2.275 10 10 CECE C[C@H](N[C@H]1CCNC12CCC2)c1cc(F)ccc1O 530216493 PSJLDLAYCHXTTN-HZMBPMFUSA-N 264.344 2.467 10 10 CECE COc1ccc(O)c(CN(C)[C@H]2C[C@@H](OC)C2)c1 289335147 HEGUTZXCQWKAGN-BJHJDKERSA-N 251.326 2.010 10 10 CECE C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)c1ccccc1O 284404822 PYWXULUBIKXCAW-SLEUVZQESA-N 281.396 2.201 10 10 CECE CCNCc1ccc(N2CC[C@H](CO)[C@@H]2C)c(F)c1 385851729 XUWYFOZOCOQBFS-WCQYABFASA-N 266.360 2.142 10 10 CECE CC(C)(C)C[C@H](O)CC(=O)NCc1ccccc1O 292372048 ZDYKNZNRHVDLMG-GFCCVEGCSA-N 265.353 2.196 10 10 CECE CN1CCc2cc([C@]3(O)CCN(C(C)(C)C)C3)ccc21 2163072902 ZVTMXBQVOJLDQA-KRWDZBQOSA-N 274.408 2.371 10 10 CECE CN1CCCc2cc([C@]3(N)C[C@@]4(C)CCO[C@@H]43)ccc21 2163104021 AHTGNGVGPNZZOF-GVDBMIGSSA-N 272.392 2.422 10 10 CECE CN1CCSC[C@H]1[C@H](O)c1ccc(N2CCCC2)cc1 2163107532 OUPIHEIZBCOUOA-JKSUJKDBSA-N 292.448 2.367 10 10 CECE Cn1cc([C@](C)(O)c2ccc(N3CCCC3)cc2)cn1 2163109504 ZSXXEBIDEUFSEO-MRXNPFEDSA-N 271.364 2.276 10 10 CECE C[C@@H]1CNC[C@H]([C@H](O)c2ccc3c(c2)CCCN3C)C1 2163111781 VSSREHFKWXQZPX-XGWLTEMNSA-N 274.408 2.348 10 10 CECE Cc1ccncc1[C@@H](O)[C@H](N)c1ccc(N(C)C)cc1 2163135721 MPNUKTWYUPBSPO-HZPDHXFCSA-N 271.364 2.189 10 10 CECE CCc1c(C(=O)OCC(=O)C(C)=O)cnn1C(CC)CC 808541145 PMDVESXXVXBUOS-UHFFFAOYSA-N 294.351 2.122 10 10 CECE N[C@@H](c1ccccc1O)[C@H](O)c1ccncc1C(F)F 2166987809 NXHSMEFYFZGSMQ-QWHCGFSZSA-N 280.274 2.458 10 10 CECE C[C@H]1c2nncn2CCN1Cc1cc(Cl)c(F)cc1O 294654636 LCOKGYPTAUNSOV-QMMMGPOBSA-N 296.733 2.353 10 10 CECE Cc1cc(CO)ccc1N(C)[C@@H]1CCN2CCC[C@H]1C2 2164426461 UCRGAJRVLBODJU-DOTOQJQBSA-N 274.408 2.408 10 10 CECE Cc1cc(CN2CC(F)(F)C[C@H]2CO)ccc1N(C)C 815098734 NBLKMVUDFPFCKK-ZDUSSCGKSA-N 284.350 2.263 10 10 CECE CN(C)c1ccc([C@H](CCc2ccns2)NN)cc1 719838813 SZZZGNAENPGMEF-AWEZNQCLSA-N 276.409 2.346 10 10 CECE 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[N-]=[N+]=N[C@@H]1CCCN(C(=O)C[C@@H](CC(=O)O)C2CC2)C1 2234170679 GERHKJKDZPVJKS-WDEREUQCSA-N 280.328 2.179 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@H]2C[C@@H](O)C2)cc1O 2224221050 ZOCKBEAHVGRKPP-WCFLWFBJSA-N 264.369 2.022 10 10 CECE CCO[C@@H]1C[C@@H]2CN(c3ccc([C@@H](C)N)c(O)c3)C[C@@H]21 2234320937 RJUQZRHRJPFJKT-TWINXVHLSA-N 276.380 2.273 10 10 CECE CC[C@H](O)c1ccc(N2CC[C@@H]3[C@@H]2C[C@]3(C)O)cc1 2225455377 ZLSZMJJJIZUECS-UGUYLWEFSA-N 261.365 2.480 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)Cc1ccc(O)cc1 2225797020 CIKZJPNKGICBAW-RYUDHWBXSA-N 260.297 2.282 10 10 CECE COc1ccc(N2CCC[C@@H]3COC[C@@H]32)c(C(=O)O)c1 2235958871 UUFTVGRSXJNANY-YGRLFVJLSA-N 277.320 2.009 10 10 CECE CCNCc1cc(OC)ccc1N(C)C[C@@H]1CCCO1 2235973318 RHBVTFVYZFKJGF-HNNXBMFYSA-N 278.396 2.420 10 10 CECE CNCc1cc(OC)ccc1N1C[C@H](C)OCC[C@@H]1C 2235977983 XMWQBWZWTGUVBZ-STQMWFEESA-N 278.396 2.418 10 10 CECE COc1ccc(N2CCCOCC2)c(C=CC(=O)O)c1 2235953169 YAKJASOOYRDVFN-UHFFFAOYSA-N 277.320 2.020 10 10 CECE CNCc1cc(OC)ccc1N(C)C[C@@]1(C)CCCO1 2235958685 MIAPUYQIBXYZES-MRXNPFEDSA-N 278.396 2.420 10 10 CECE COc1ccc(N2C[C@H]3C[C@H]2CO3)c(CNC(C)C)c1 2235969850 JOBJXRVVZDZHFL-DZGCQCFKSA-N 276.380 2.171 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](CO)CC2CC2)cc1O 2226152675 PKCVMBVKFBDVKB-MFKMUULPSA-N 265.353 2.043 10 10 CECE OC[C@@H]1[C@H]2CC[C@@H](C2)N1c1ccc2c(c1)CCCO2 2226661952 KFCXLXKYPLQCKQ-CORIIIEPSA-N 259.349 2.361 10 10 CECE COc1ccc(N2C[C@H]3[C@@H](O)CCC[C@H]3C2)cc1F 2226791844 HYUQVRBZVPLYEJ-SUHUHFCYSA-N 265.328 2.432 10 10 CECE COc1ccc(N2CCSC[C@@H]2CCO)c(F)c1F 2226937777 YEKMSJVCRWISFW-VIFPVBQESA-N 289.347 2.278 10 10 CECE C[C@@H](N)c1ccc(N2CC(OC(F)(F)CF)C2)cc1O 2237636899 KDKMXEUHEGLTNX-MRVPVSSYSA-N 290.285 2.179 10 10 CECE COCCNC[C@@H]1CC[C@H]1Oc1ccc(N(C)C)cc1 2237705418 VPTLLTURHGKTHX-XJKSGUPXSA-N 278.396 2.146 10 10 CECE COc1ccc(CNC[C@@H](F)[C@H]2CCOC2)cc1C 2229981289 AAQILJZYHVPUBE-UONOGXRCSA-N 267.344 2.468 10 10 CECE CC[C@@H](C)NCc1cc(OC)ccc1N(C)C1COC1 2240026189 KWBXGIQNXOPRNU-GFCCVEGCSA-N 278.396 2.418 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCC[C@@H]1CS(C)(=O)=O 2240839791 KASCFWMBSIBLSV-GXTWGEPZSA-N 296.436 2.028 10 10 CECE Oc1c(Br)cccc1CNC12COCC(C1)C2 2250894634 OBVWDTAGDPYXEX-UHFFFAOYSA-N 298.180 2.423 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1ccc(CN)cc1Br 2251033372 JQYVNJWPEHDCGH-AAEUAGOBSA-N 299.212 2.257 10 10 CECE COC[C@@]1(C)C[C@@H]1NCc1cc(F)cc(F)c1O 2257013223 JZIKEQHUGPRJJY-WCQYABFASA-N 257.280 2.185 10 10 CECE CSc1ncc(CNC[C@H]2C[C@H]3C[C@H]2C[C@@H]3N)s1 2257136914 TXFAANFAMLFYBW-XNDJQWLSSA-N 283.466 2.328 10 10 CECE Cc1cc(N(C[C@H](C)O)C(C)(C)C)ccc1CN 2259789837 GGUYJTQWOGNXFM-LBPRGKRZSA-N 250.386 2.439 10 10 CECE COc1cc(OC)c(N2CC3(CC(O)C3)C2)cc1Cl 2270423244 SPCKMHZWWJONSF-UHFFFAOYSA-N 283.755 2.318 10 10 CECE COc1cc(OC)c(N2CCC[C@](C)(O)C2)cc1OC 2289333760 JHVCYEBLHACKIL-HNNXBMFYSA-N 281.352 2.064 10 10 CECE COc1ccc(N(C[C@@H](C)O)C(C)(C)C)c(CN)c1 2272458128 UBRFZFVUECHLRF-LLVKDONJSA-N 266.385 2.140 10 10 CECE C[C@@H](CCN(C)C)N(C)c1c(F)cc(CN)cc1F 2273103176 NDELQPKQTYBJKL-JTQLQIEISA-N 271.355 2.200 10 10 CECE CC[C@@H]1CN(c2ccc(OC)c3c2CCC3)C[C@@H]1O 2269179753 YIRFCXABQLKYFN-ABAIWWIYSA-N 261.365 2.391 10 10 CECE Cc1cc(N2CC[C@]3(C2)C[C@@H](O)C3)ccc1[C@H](C)N 2269661172 CXKLEBNPBMAIMO-DUVNUKRYSA-N 260.381 2.366 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](C)[C@@H](O)C2)cc1C 2269658573 SEICFKAHOGJNKS-GHJWDPDVSA-N 262.397 2.483 10 10 CECE C[C@H](CN[C@@H](C)c1ccc(O)cc1O)Cc1cn[nH]c1 2290439699 OBVMZQHESXBFPL-QWRGUYRKSA-N 275.352 2.350 10 10 CECE CCN(c1ccc([C@@H](C)O)c(C)c1)[C@@H](C)CS(C)(=O)=O 2285151136 YDPMRTZRFGHLTL-QWHCGFSZSA-N 299.436 2.308 10 10 CECE CC(=O)NC1CCN(c2ccc([C@@H](C)O)c(C)c2)CC1 2285148381 BROOWZNCKLXSBX-GFCCVEGCSA-N 276.380 2.153 10 10 CECE CC[C@@H]1CN(c2ccc(OC)c(C)c2OC)C[C@@H]1CO 2295359675 ITDMNQJKOQAOJB-CHWSQXEVSA-N 279.380 2.467 10 10 CECE COc1ccc(N2C[C@H]3[C@H](N)CC[C@H]3C2)c(OC)c1C 2295432449 HXUROIWZMFJICW-YNEHKIRRSA-N 276.380 2.186 10 10 CECE C[C@H](CF)N(C)c1ccc(C=CC(=O)O)cc1[N+](=O)[O-] 2285706347 IZCCEEJWRLQJKT-SECBINFHSA-N 282.271 2.487 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1c(OC)cc(OC)cc1OC 2288892828 PNOSCXHIBVXHNY-NEPJUHHUSA-N 281.352 2.062 10 10 CECE C[C@H](N)c1ccc(N(C)CC2(O)CC2)c(Cl)c1 2301882439 SNYCTXDOLIKPDK-VIFPVBQESA-N 254.761 2.321 10 10 CECE CC[C@@H](C)[C@@H](N)C(=O)N(C)[C@@H](C)c1ccccc1O 37826529 MDATYRPMXNKHTE-UHIISALHSA-N 264.369 2.285 10 10 CECE C[C@H](NC(=O)c1cnn2c1CCC2)c1ccccc1O 827964567 QOOITRULGFCBBF-JTQLQIEISA-N 271.320 2.026 10 10 CECE CSc1cc(N2CCO[C@@H](C)C2)ccc1CN 2308065735 QKZZMGQFXVTOHA-JTQLQIEISA-N 252.383 2.092 10 10 CECE CNCc1cc(F)c(N2C[C@H]3C=C[C@@H]2C3)c(F)c1 2308763216 VYIFCNUWRGYKEB-GXSJLCMTSA-N 250.292 2.449 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC[C@H]3[C@@H]2C[C@H]3O)c1C 2340848281 LEQYYWDRULKNID-SHPPOPEUSA-N 261.365 2.316 10 10 CECE COCCCCCN(C)C(=O)Cc1ccc(N)cc1 2342786123 XLXGHVVXBRRMPM-UHFFFAOYSA-N 264.369 2.086 10 10 CECE Cc1cnc(N(C)c2cccnc2)cc1C[C@H](C)N 2352271505 JSVRPXZIJMQPKY-LBPRGKRZSA-N 256.353 2.443 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2C[C@@H]3C[C@H]2C[C@H]3F)cc1 2354311362 NEIFIOHCVKQEJX-VIRABCJISA-N 276.355 2.454 10 10 CECE COc1ccc(CN(C)C[C@@H]2C[C@H]3CC[C@@H]2O3)c(O)c1 2355029134 CJDVGGSHCCAVEU-BJJXKVORSA-N 277.364 2.400 10 10 CECE Cc1cc(/C=C/C(=O)O)ccc1N(C)CCN(C)C 111141004 KRIUONSXSIWGIS-SOFGYWHQSA-N 262.353 2.091 10 10 CECE Oc1cccc(Cl)c1Cn1ncnc1Br 2070040481 KICBEMQKTXDEHI-UHFFFAOYSA-N 288.532 2.448 10 10 CECE O=C1COc2cc([N+](=O)[O-])c(N3CCCCCC3)cc2N1 301614391 UNWGMUUBEMZMML-UHFFFAOYSA-N 291.307 2.306 10 10 CECE CC(C)=[S@@](NS(=O)(=O)C(F)(F)F)C(C)C 71765739 WQYBGLSQFOWAKD-CQSZACIVSA-N 265.322 2.230 10 10 CECE C[C@H](NC(=O)c1cccc(O)c1O)c1ccc(CN)cc1 125940203 JWRIWYCYNOLHRD-JTQLQIEISA-N 286.331 2.048 10 10 CECE CCC[C@@H](C)N(C)CC(=O)c1ccc(O)c(O)c1 37339235 TXJRWEJHILDGDI-SNVBAGLBSA-N 251.326 2.401 10 10 CECE C[C@@H]1CN(c2ccc(OC(F)F)cc2)CC[C@@H]1N 49710338 QNADJMJOSHTYDE-SKDRFNHKSA-N 256.296 2.462 10 10 CECE CC(C)(C)OC(=O)N1C[C@H](N)C[C@H]1c1c(O)cccc1O 1952451215 QVQMTPXDONINCA-ZJUUUORDSA-N 294.351 2.107 10 10 CECE CC(=O)N[C@@H]1CCN(c2ccc(CNC(C)(C)C)cc2)C1 228305305 FCHKBSRHLWHFOV-OAHLLOKOSA-N 289.423 2.290 10 10 CECE CCCN[C@H](C)c1ccc(N2CCO[C@@H](CO)C2)c(F)c1 221134597 YPLOVAUMCGNEDK-TZMCWYRMSA-N 296.386 2.084 10 10 CECE Oc1c(Br)cc(Cl)cc1[C@H]1COCCN1 95692619 UYMMLPIJEOMIMN-SECBINFHSA-N 292.560 2.469 10 10 CECE Cc1cnc(CN(C)Cc2ccc(N(C)C)cc2)nc1 1237807133 KLVOKCSQNNIYTO-UHFFFAOYSA-N 270.380 2.483 10 10 CECE CC(C)(C)[C@H]1CN(c2ccc3c(c2)OCCO3)CCN1 86124466 CBOCKRPPORELDN-OAHLLOKOSA-N 276.380 2.282 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](C)[C@H](CO)C2)c(F)c1 700399445 KIZISTULTVYNHN-GVXVVHGQSA-N 267.344 2.334 10 10 CECE COC(=O)c1cnc(SCC(=O)C2CC2)s1 295329902 OZQSBAGKSGTMTK-UHFFFAOYSA-N 257.336 2.001 10 10 CECE COc1ccc(O)c(CN[C@H]2CCN(C3CCC3)C2)c1 2169572086 XYTYSQIPMIBURT-ZDUSSCGKSA-N 276.380 2.117 10 10 CECE CC[C@]12C[C@H]1CN([C@H](C)C(=O)Nc1ccc(N)cc1)C2 2167518747 GJGFWIZYYYCFKE-BFQNTYOBSA-N 273.380 2.328 10 10 CECE CCc1nnc(C)cc1[C@H](O)c1ccc(N(C)C)cc1 2163073170 GMOUIOQMLAPSIZ-MRXNPFEDSA-N 271.364 2.495 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3NC[C@H]4CC[C@@H]43)ccc21 2163094472 LTQCAHFHJMNSCF-WTTBNOFXSA-N 272.392 2.100 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@]1(O)CCS[C@H]1C 2163130011 CZRDCDNIVGAMAE-XZJROXQQSA-N 292.448 2.196 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)c1cncs1 2163132019 XGLZMFRJACBVOW-HUUCEWRRSA-N 289.404 2.130 10 10 CECE Cc1nccnc1CN(C)c1ccc([C@@H](C)N)c(O)c1 700017699 AIQRYXYPMNCESQ-SNVBAGLBSA-N 272.352 2.147 10 10 CECE CN1CCN(c2ccc(CO)c(C(F)(F)F)c2)[C@@H]2C[C@@H]21 2168394844 QBPJQFMXRRLSAC-QWHCGFSZSA-N 286.297 2.090 10 10 CECE C[C@H]1C[C@H]1N(CCO)c1ccc(CN)cc1C(F)(F)F 2167109677 PJNMJRTXVKURSP-TVQRCGJNSA-N 288.313 2.371 10 10 CECE CCCC[C@H](c1ccc(O)cc1O)N1CCNCC1 575286753 DTJABXINCMHXIY-CQSZACIVSA-N 264.369 2.234 10 10 CECE Cc1nc(C)c(CNCc2ccc3c(c2)CCO3)[nH]1 724679643 XPYVJJNFMHNIPY-UHFFFAOYSA-N 257.337 2.251 10 10 CECE 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Cc1cc(CN2CC[C@@H](O)C(F)(F)C2)ccc1N(C)C 852412481 BBOIBPTVRXYPKF-CQSZACIVSA-N 284.350 2.263 10 10 CECE CC(C)[C@H](N)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 854230366 NXXASKDPZNSSHR-GXFFZTMASA-N 281.356 2.324 10 10 CECE C[C@H](NCC12CC(CN1)C2)c1ccc(N(C)C)cc1 854226650 JOOFCZGMFLXSNX-FUJMWEONSA-N 259.397 2.155 10 10 CECE Cc1ccc([C@H](C)NCCOCCCN)c(O)c1C 863544887 DMYKBHZGRSTHDC-ZDUSSCGKSA-N 266.385 2.025 10 10 CECE COC(=O)[C@H](N[C@@H](C)c1ccc(F)cc1O)C(C)C 62745799 ANIMFRRYWXZFOI-TVQRCGJNSA-N 269.316 2.380 10 10 CECE Oc1ccc2c(c1O)CCN[C@H]2CC1CCOCC1 75793965 OSVBALQLTGPLOR-ZDUSSCGKSA-N 263.337 2.101 10 10 CECE COc1ccc(O)c(CN2C[C@@H]3CCCN3C[C@H]2C)c1 245959206 UMOCGLWANWKQTD-OCCSQVGLSA-N 276.380 2.069 10 10 CECE CC[C@H]1CN(CCCO)c2ccc(OC)cc2N1 76929784 QECIVJMVOGRISJ-NSHDSACASA-N 250.342 2.088 10 10 CECE CC1(C)CCC([C@@H](NCCCN=[N+]=[N-])C(N)=O)CC1 388627189 HCXMHYPDEIUXQS-LLVKDONJSA-N 267.377 2.347 10 10 CECE CO[C@]1(C)CCN(Cc2cc(C(C)=O)ccc2O)C1 388777661 PYHQOXMKZMXJAK-OAHLLOKOSA-N 263.337 2.206 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CC1(C)CN(c2ccc3c(c2)CCC[C@H]3O)CC[S@]1=O 2184681429 DJQFCMGQBNEYCH-FOIQADDNSA-N 293.432 2.404 10 10 CECE CCCN[C@@H]1CCc2cc(N3CCN(C)CC3)ccc21 2184742440 XNKLKXPFUFGVMQ-QGZVFWFLSA-N 273.424 2.425 10 10 CECE CN(C)CC[C@@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2184739144 CICWNKAWOVQQSB-DYVFJYSZSA-N 273.424 2.411 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@@H](O)[C@H]3C(C)C)ccc21 2184724060 UWJLYIIPECFEDA-BRWVUGGUSA-N 274.408 2.489 10 10 CECE OC[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3O)C12CCC2 2190363339 NIVRPQXVFCFEAS-CJNGLKHVSA-N 273.376 2.408 10 10 CECE C[C@H](NCCCC[S@](C)=O)c1cc(F)ccc1O 2047833471 OABGAOLGWBBZIN-YPMLDQLKSA-N 273.373 2.341 10 10 CECE Cn1cnc(Cl)c1CNCc1cc(F)ccc1O 2049169465 FFVGAYSJUVBSRS-UHFFFAOYSA-N 269.707 2.208 10 10 CECE C[C@@H](N(C)c1ccc(OCCN(C)C)cc1)C(C)(C)O 2197242379 VIIIVHKOSDUMGL-CYBMUJFWSA-N 280.412 2.223 10 10 CECE CC[C@H](N)CN(CC)c1ccc(OC)cc1OC 2053089099 HVBRILWSRFZPNB-NSHDSACASA-N 252.358 2.267 10 10 CECE CSCCS(=O)(=O)N(C)[C@H](C)c1ccccc1O 2053721766 YFYVHWDTMHZJGI-SNVBAGLBSA-N 289.422 2.078 10 10 CECE C[C@@H](C1CC=CC1)N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 2190851862 DYYCVJAKOWBIQG-ZUZCIYMTSA-N 272.348 2.463 10 10 CECE COCc1cnccc1C(=O)N1CCC(N=[N+]=[N-])CC1 2185889356 AOPXLLZERPFRJZ-UHFFFAOYSA-N 275.312 2.143 10 10 CECE C[C@@H]1C[C@H]1N(CCO)c1cc(Cl)c(CN)cc1F 2057254032 FUMZPUXELNYCCZ-PRHODGIISA-N 272.751 2.145 10 10 CECE COC[C@]1(F)CCN(c2ccc(CO)c(C)c2)C1 2059271913 KEGJHRGLCDHIOC-AWEZNQCLSA-N 253.317 2.052 10 10 CECE NCC1C[C@@H]2CC[C@H](C1)N2Cc1cc(F)ccc1O 2102961329 BBQKJKIFXZYEFP-FTNCPSPGSA-N 264.344 2.233 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]2c2ncon2)cc1 2104166600 FPMTYJGEOZZVSA-ZWNOBZJWSA-N 258.325 2.301 10 10 CECE C[C@@H]1CC[C@H](CNCc2ccc(F)cc2O)OC1 2084176989 PLTOUPQHPSMSGS-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H]2CN(C)C)c(F)c1 2104574480 KRBREJREMJSXAZ-WCQYABFASA-N 265.376 2.246 10 10 CECE CCCOc1ccc(N(C)[C@@]2(CN)CCOC2)cc1 2106354656 VARMHPHGCAVKGX-OAHLLOKOSA-N 264.369 2.029 10 10 CECE c1cc2c(cc1N1CCC[C@H]3NCC[C@@H]31)COCC2 2106394386 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CC1(C)[C@@H](N)C[C@@]1(O)c1ccc(N2CCCC2)cc1 2106826310 RUQVBWPMRMHXQO-GOEBONIOSA-N 260.381 2.232 10 10 CECE C[C@H](CCN)CC[C@H](O)c1ccc2c(c1)CCN2C 2106802778 XETACFCEPZQIHS-LRDDRELGSA-N 262.397 2.477 10 10 CECE CN1CCCc2cc([C@@](C)(N)[C@@H]3CCCO3)ccc21 2106828937 RVLBCRXQMQZVHA-JKSUJKDBSA-N 260.381 2.422 10 10 CECE CN[C@@H](CC1CCNCC1)c1ccc(N(C)C)cc1 2107793543 NJZSGAUNQXMAPB-INIZCTEOSA-N 261.413 2.403 10 10 CECE CC[C@H](Nc1c(N)cccc1C(=O)OC)[C@H](O)CC 2108723147 VKSGTZVROYMNCJ-NWDGAFQWSA-N 266.341 2.017 10 10 CECE C[C@@H](O)c1ccc(N2C[C@]3(C)C[C@]3(CO)C2)c(F)c1 2109187797 SERSGUMDDXUJME-WKPIXPDZSA-N 265.328 2.088 10 10 CECE CNCc1ccc(N2C[C@@]3(C)C[C@]3(COC)C2)cc1 2109178643 UQXNGLPBUDBLKQ-HZPDHXFCSA-N 260.381 2.269 10 10 CECE C[C@H](O)c1ccc(N2CCCNC(=O)CC2)c(Cl)c1 2089101737 PKTIUXSTTUCWGU-JTQLQIEISA-N 282.771 2.110 10 10 CECE CC[C@](C)([C@@H](NN)c1ccccc1O)N1CCCC1 2090037151 KGAFABIGVZZWQJ-LSDHHAIUSA-N 263.385 2.161 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](C)[C@@H]2C(N)=O)cc1Cl 2090258413 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10 CECE CCN(CC)c1ccc([C@H](O)c2nc(C)nn2C)cc1 2203512501 BHCRKKDDMIYMPZ-AWEZNQCLSA-N 274.368 2.051 10 10 CECE CNCc1ccc(N(C)CC2(OC)CCC2)cc1OC 2204553894 MWXWFZDTMJCVKF-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H]3[C@@H]2CO)cc1Cl 2214329361 HKUPPSHZKAGOCE-PEXQALLHSA-N 253.729 2.166 10 10 CECE Oc1cc(F)ccc1CNCc1cnn(C(F)(F)F)c1 2204746430 GOVZQKBNCRVAMQ-UHFFFAOYSA-N 289.232 2.494 10 10 CECE C[C@@H]1C[C@@]1(F)CN(C)[C@H](CN)c1ccc(N(C)C)cc1 2206342778 WXADPBBVWWCQGL-DAXOMENPSA-N 279.403 2.432 10 10 CECE Cc1cc(N(C)[C@@H](CCO)C(F)F)ccc1[C@@H](C)N 2269666751 RQSXVXLNWZCVJP-MFKMUULPSA-N 272.339 2.467 10 10 CECE Cc1cc(N2C[C@H]3CC[C@@]3(CO)C2)ccc1[C@@H](C)N 2269663510 XKADLYRDKOHIET-IOASZLSFSA-N 260.381 2.223 10 10 CECE Cc1cc(N2CCC[C@@](F)(CO)C2)ccc1[C@H](C)O 2269674499 YBTWHBJXBKMLDX-WFASDCNBSA-N 267.344 2.349 10 10 CECE COc1ccc(N2CCC[C@@H](O)[C@@H]2C)c(OC)c1 2219642338 DFEDZBIJABQVAJ-GXFFZTMASA-N 251.326 2.053 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)c1ccc(=O)n(C)c1 2233246872 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2.197 10 10 CECE CCN(C)C1CN(c2ccc([C@@H](C)O)c(C)c2C)C1 2340847933 WOHYIHLUNLJULZ-CYBMUJFWSA-N 262.397 2.497 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)c(C)c2C)C[C@H]1F 2340861549 LEHHAFUBIHWCLZ-LNSITVRQSA-N 266.360 2.496 10 10 CECE CC(C)c1ncccc1[C@H](NCCN=[N+]=[N-])C(=O)O 2342158151 MKZPFZOHNZBZFK-NSHDSACASA-N 263.301 2.231 10 10 CECE CCc1cnn(C[C@@H](N)c2ccc(N(C)C)cc2)c1 2345832503 MGBWJEHYEZCMOE-OAHLLOKOSA-N 258.369 2.212 10 10 CECE CSc1cc(N2C[C@@H](O)CC23CCC3)ccc1CN 2353849380 SCCFXIVSIUSGLZ-ZDUSSCGKSA-N 278.421 2.361 10 10 CECE NC[C@@H]1C[C@H]2CC[C@@H]1N2c1ccc2c(c1)OC(F)(F)O2 2355416826 ABFXBGFVOYBTFY-NGZCFLSTSA-N 282.290 2.324 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@@H]4C[C@@H](O)[C@H]3C4)ccc21 2356170621 ROCAXDPLHPJLPO-KSHAWTQOSA-N 272.392 2.243 10 10 CECE COCc1c(O)cc2c(c1O)C(=O)c1ccccc1C2=O 4098685 OBAYLECORSQIQW-UHFFFAOYSA-N 284.267 2.020 10 10 CECE biogenic,in-vitro CC[C@H](N[C@H](CC)C(=O)OC)c1ccccc1O 310875133 SHGAZOBKRKVRPV-NWDGAFQWSA-N 251.326 2.385 10 10 CECE CN(C)C(=O)c1cccc2c1C(=O)c1ccccc1C2=O 175279423 JTJUXFSEAJNIHZ-UHFFFAOYSA-N 279.295 2.164 10 10 CECE COc1ccc([C@H](NCCCO)c2ccccc2)c(O)c1 20188151 XBDDIGMXXRWCTK-QGZVFWFLSA-N 287.359 2.462 10 10 CECE C[C@H]1CN(c2ccc(CN)c(Cl)c2)C[C@@H](C)O1 61845498 UEUKSIRJBZIQGH-AOOOYVTPSA-N 254.761 2.412 10 10 CECE COC(=O)/C=C/c1cc(O)c(O)c(Br)c1 308738194 PWRFMJGLWMYSOY-NSCUHMNNSA-N 273.082 2.047 10 10 CECE COCCOCCCCNCc1ccc2c(c1)CCN2C 120692651 NHGHMHNWZADKKI-UHFFFAOYSA-N 292.423 2.212 10 10 CECE CN(Cc1cn[nH]c1)C(=O)/C=C\c1ccc(N(C)C)cc1 211129755 ZDEHKJHASAGZRF-TWGQIWQCSA-N 284.363 2.148 10 10 CECE Oc1cc2[nH]cc(I)c2cc1O 35260065 KMQYFQCDFRRATR-UHFFFAOYSA-N 275.045 2.184 10 10 CECE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2O)CCNC1 1952304336 KDTHNGBMDWWFHS-HNNXBMFYSA-N 278.352 2.106 10 10 CECE C[C@H]1CN(c2ccc(CN)c(Cl)c2)C[C@@H]1N(C)C 123391336 ALUJFLMTHRPCLP-HZMBPMFUSA-N 267.804 2.185 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2COc3ccccc3O2)cc1 217313674 ZUNVUBKVQCZLTO-CYBMUJFWSA-N 299.330 2.230 10 10 CECE CCCNCc1ccc(N(CC)CC(=O)NCC)c(F)c1 42370533 XXVKBMGGPVKCSG-UHFFFAOYSA-N 295.402 2.288 10 10 CECE O=C(NCc1ccccc1O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1 228421943 SCZCMNRBZNQAHD-SNPRPXQTSA-N 288.391 2.319 10 10 CECE Cc1ccsc1CNC(=O)c1ccc(O)c(O)c1 227022885 YJZUWRIRTNEWQX-UHFFFAOYSA-N 263.318 2.398 10 10 CECE CN1CCc2cc([C@H]3[C@@H](N)CCCN3C3CC3)ccc21 226475771 TWOFGBJJWUFSMU-RDJZCZTQSA-N 271.408 2.306 10 10 CECE Cc1cc(C(=O)Nc2ccc(O)cc2C(=O)O)ccc1N 48847272 ZYUPGWDQKRQQLX-UHFFFAOYSA-N 286.287 2.233 10 10 CECE CS(=O)(=O)c1cccc(Sc2nccs2)c1N 137955898 ASRKKUFSHBXTRT-UHFFFAOYSA-N 286.403 2.280 10 10 CECE CC(C)(C)NCCNCc1ccc2c(c1)CCCO2 228728340 OZNQNEHMJGSPHF-UHFFFAOYSA-N 262.397 2.489 10 10 CECE CO[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 228157307 YVFNTQWOUANJDP-LLVKDONJSA-N 285.185 2.133 10 10 CECE C[C@H]1CN(C)CC[C@H]1N(C)Cc1cccc(F)c1O 290645632 YUDBNYAXGDNTLW-SMDDNHRTSA-N 266.360 2.303 10 10 CECE CC[C@@H](N[C@@H](C)c1cc(C)ccc1O)C(=O)OC 381000688 MFATYPMCQYOUKN-CMPLNLGQSA-N 251.326 2.303 10 10 CECE CC(C)(C)[S@@](=O)CCC(=O)Nc1ccc(N)cc1 40966321 FZHWJVNCLUETJB-GOSISDBHSA-N 268.382 2.145 10 10 CECE Oc1ccc([C@@H](O)C(F)(F)Br)cc1O 225674292 QPJIZYCBBVRLBQ-SSDOTTSWSA-N 269.041 2.119 10 10 CECE C[C@@H](O)C1CCN(Cc2ccc(N(C)C)cc2)CC1 92969095 DBVHFUDQDRCOKG-CYBMUJFWSA-N 262.397 2.345 10 10 CECE C[C@H](O)[C@H](C)SCCC(=O)Nc1ccc(N)cc1 235580418 BLTDKKYODIZAKS-UWVGGRQHSA-N 268.382 2.100 10 10 CECE N[C@H](CF)c1cc(Br)cc([N+](=O)[O-])c1O 238683733 HCZXNQIOLGJFRA-ZCFIWIBFSA-N 279.065 2.032 10 10 CECE C[C@H](N[C@@H]1CCC[C@@H]1CO)c1ccc(F)cc1O 230663801 WVDRBCHGWSODSZ-OPQQBVKSSA-N 253.317 2.343 10 10 CECE [N-]=[N+]=NC[C@@H]1CN=C(N)N1c1ccccc1Br 93386427 YMZXDOKUDCXBRN-ZETCQYMHSA-N 295.144 2.263 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@H](C)[C@H]1CO 299949455 CRCDIESULMMMDY-YVEFUNNKSA-N 274.408 2.454 10 10 CECE COc1cccc(CNC[C@H]2CC[C@H](C(=O)O)CC2)c1O 253112911 DTFNPXBEJNRBEK-HAQNSBGRSA-N 293.363 2.381 10 10 CECE O=C1Nc2cc(O)c(O)cc2N[C@H]1c1ccccc1 606595713 URMZDHQRUSOPNE-ZDUSSCGKSA-N 256.261 2.203 10 10 CECE CCNCc1cc(F)c(N2CC[C@H](C)[C@H](O)C2)c(F)c1 300012040 OZXYXUCMHHNGAM-IINYFYTJSA-N 284.350 2.281 10 10 CECE COC(=O)[C@H](C)c1c(F)cc(O)c(O)c1Br 260481889 INBGOBSEPMECRP-SCSAIBSYSA-N 293.088 2.276 10 10 CECE COc1cc(O)c(CN(C)[C@H]2C[C@@H](OC)C2)cc1OC 285235899 ZAZNQWPJEVBOJM-TXEJJXNPSA-N 281.352 2.019 10 10 CECE C[C@@H]1CCOCC[C@@H]1NCc1cc2c(cc1O)OCO2 2165412653 QZMYSKUOERZVDM-PWSUYJOCSA-N 279.336 2.026 10 10 CECE CO[C@@H]1C[C@@H](OC)CN([C@@H]2CCc3cccc(O)c32)C1 2165457061 PEDFMYHHFCTJMQ-MGPQQGTHSA-N 277.364 2.115 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@H]2[C@H]3CCCCC[C@H]32)cc1 2167258471 UFSCAOSYYCNUBZ-QDMKHBRRSA-N 294.420 2.267 10 10 CECE C[C@H](N)c1ccc(N2CC3(CC(N(C)C)C3)C2)c(F)c1 2164443478 TWAYLWDTNSFLDL-NSHDSACASA-N 277.387 2.376 10 10 CECE CCOCc1nc([C@H](C)NCc2cc(C)ccc2O)no1 290836888 IAGIOFPFPJKPTG-NSHDSACASA-N 291.351 2.471 10 10 CECE CN(CC1(CF)CCC1)c1ccc2c(c1)NC(=O)[C@H]2O 2166503798 INBCRLJWGDGMHF-ZDUSSCGKSA-N 278.327 2.248 10 10 CECE CCN1CCc2cc([C@@]3(O)[C@H]4CCO[C@@H]4[C@H]3C)ccc21 2163075233 BARDTSGASKHJBH-IPALMDDQSA-N 273.376 2.311 10 10 CECE CN1CCCc2cc([C@]3(N)CCN(C4CC4)C3)ccc21 2163098845 DVJYQTOUINCIHT-KRWDZBQOSA-N 271.408 2.091 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCCN3C)C[C@@]1(C)CN 2163102266 JDWRNGCQMVXKHF-SUMWQHHRSA-N 273.424 2.490 10 10 CECE OCc1ccc(N2C[C@@H]3C[C@H]2CO3)cc1C(F)(F)F 718278849 VZDOXURIVVHGHX-QWRGUYRKSA-N 273.254 2.175 10 10 CECE CN(C)c1ccc(CNC[C@H]2CNCCC2(F)F)cc1 903955486 STIANXNHTKXPCP-CYBMUJFWSA-N 283.366 2.087 10 10 CECE CNC[C@@H]1C[C@H](F)CN1Cc1c(O)cc(C)cc1Cl 843122779 USPSEODHOHBUPX-QWRGUYRKSA-N 286.778 2.486 10 10 CECE CC1(C(=O)NCc2ccc(O)cc2O)C[C@@H]2C[C@H]2C1 910945407 VCZSAWJFTOCFRO-QWRGUYRKSA-N 261.321 2.150 10 10 CECE O=C(c1cc(O)cs1)N1CCc2cc(Cl)nnc2C1 844147036 MMAGULWQUPAHSR-UHFFFAOYSA-N 295.751 2.096 10 10 CECE CO[C@](C)(CO)CN[C@H](C)c1cc(Cl)ccc1O 848558229 KHNBMAIDDSPWTJ-RNCFNFMXSA-N 273.760 2.094 10 10 CECE CC1(C)CN(CC(=O)NCCCSc2nccs2)C1 847488241 UZDOSUBEZROLRH-UHFFFAOYSA-N 299.465 2.083 10 10 CECE C[C@H](CO)[C@@H](C)NCc1cc(F)c(N(C)C)cc1F 858142449 BBSOOADGMGQEMV-NXEZZACHSA-N 272.339 2.137 10 10 CECE Cc1ccc(O)c(CNC(=O)N[C@H]2CCOC2(C)C)c1 858509133 SZMQOOUUTXFGGT-ZDUSSCGKSA-N 278.352 2.067 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H]3COC(C)(C)C3)C2)cc1 850488464 RXPQWMBENLBWJA-KBPBESRZSA-N 290.407 2.431 10 10 CECE C[C@@H]1CCC[C@H](CNC(=O)c2cc(O)cs2)O1 855796632 JDWJTOARKDNWMC-PSASIEDQSA-N 255.339 2.141 10 10 CECE Cc1ncc(CNC(=O)c2ccc(C)c(O)c2O)s1 751534532 IRMVBYSTVOOYRG-UHFFFAOYSA-N 278.333 2.101 10 10 CECE CC(=O)C1CCN(C(=O)Nc2ccc(N)cc2)CC1 873329342 YEHYSAZMHXBLOJ-UHFFFAOYSA-N 261.325 2.102 10 10 CECE CC[C@@H]1CN(CCCC(=O)OC)c2ccc(CN)cc2O1 74337969 HQONRZZJYQECBR-CYBMUJFWSA-N 292.379 2.076 10 10 CECE C[C@@H]1[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1(F)F 1123945411 CGLNOEAPBWBBQY-HQJQHLMTSA-N 253.248 2.136 10 10 CECE COc1ccc(N(C)C[C@@H](O)CC(F)(F)F)cc1OC 787187229 OGZLJMYZLGOEQM-JTQLQIEISA-N 293.285 2.453 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1NCc1cccc(Cl)c1O 164683833 RQYWRUYMOOATMG-MFKMUULPSA-N 268.788 2.475 10 10 CECE Cc1nc(-c2ccc(N(C)C)cc2)sc1C(=N)N 82421135 UOYITKFVGKTMJX-UHFFFAOYSA-N 260.366 2.469 10 10 CECE Cc1nnc([C@H](N)c2c(O)ccc3ccccc23)o1 83409161 FAWFYDZVHPPLNM-CYBMUJFWSA-N 255.277 2.285 10 10 CECE CC[C@]1(c2cc(F)cc(F)c2O)CO[C@@H](C)CN1 83419679 KYZAUEVQWVAMHK-ISVAXAHUSA-N 257.280 2.284 10 10 CECE Cc1cc([C@@H]2NCCc3c2ccc(O)c3O)ccc1O 83656269 IPKQGDWULDIDQH-HNNXBMFYSA-N 271.316 2.347 10 10 CECE CN(CCO[C@H]1CCCCO1)c1ccc(N)cc1 702070273 ZNGWZURCTQXCFE-AWEZNQCLSA-N 250.342 2.248 10 10 CECE C[C@H]1CC[C@H](N)CN1Cc1cc(Cl)ccc1O 690840568 XTAPFZUXOCLHKB-CABZTGNLSA-N 254.761 2.357 10 10 CECE CN(C)c1ccc(CNC(=O)N[C@@H]2C[C@H]2C2CC2)cc1F 797440894 GBSWWVALIQNKBN-GXTWGEPZSA-N 291.370 2.489 10 10 CECE C[C@H](c1ccc(F)cc1O)N(CCN)CC(F)(F)F 713335789 LDHMZIDOPIEWKV-MRVPVSSYSA-N 280.265 2.415 10 10 CECE COc1ccc(N2CCC(C(C)(C)O)CC2)c(N)c1 716397202 IPPFHZKEAUGLJC-UHFFFAOYSA-N 264.369 2.265 10 10 CECE CC(C)OCCCN1CCN(c2ccc(N)cc2)CC1 690499188 UWVNBMSSPBBNQS-UHFFFAOYSA-N 277.412 2.206 10 10 CECE CCN(c1ccc(CO)cc1Cl)[C@@H]1CCN(C)C1 693448086 XKRWBQXWJCLTSW-GFCCVEGCSA-N 268.788 2.363 10 10 CECE COC(=O)[C@H](NC(C)C)[C@@H](C)Sc1nccs1 698612411 NXICNAVNRHYQCF-RKDXNWHRSA-N 274.411 2.163 10 10 CECE Nc1ccc(NC(=O)c2ccc3cccnc3n2)cc1 699228441 IQEWZELTGOMVFH-UHFFFAOYSA-N 264.288 2.464 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@H](C(=O)O)[C@H]2C)c1 92944329 FIQGAIJTGWZMCQ-SCVCMEIPSA-N 279.336 2.257 10 10 CECE C/C(=C/c1ccccn1)C(=O)NCc1cc(O)ccc1O 1303225257 DLYYGWYUOYOGET-FLIBITNWSA-N 284.315 2.213 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H]2CNCC(C)(C)C2)cc1 2115484935 JFTSIFLMKLURTN-UKRRQHHQSA-N 262.397 2.422 10 10 CECE CCN(CCC(=O)N1CCCC1)c1ccc(N)cc1 2117133948 DIVTZPZYHLMBFE-UHFFFAOYSA-N 261.369 2.108 10 10 CECE COC1(OC)CC[C@@H]1CN[C@H](C)c1ccccc1O 2116760888 ISJYDPWOEIAEAX-VXGBXAGGSA-N 265.353 2.442 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](O)C3(CCCC3)C2)cc1 2117749313 NUORPKOGSNQFAM-IUODEOHRSA-N 260.381 2.448 10 10 CECE OCc1ccc(N2C[C@@H](O)C3(CCCC3)C2)c(F)c1 2117734046 BVBTUBYUDBOBAL-CQSZACIVSA-N 265.328 2.059 10 10 CECE O[C@@H]1CCc2cc(N3CCOCC34CCC4)ccc21 2128321513 LJBLEOBVKGCIOR-OAHLLOKOSA-N 259.349 2.426 10 10 CECE CCN1CCc2cc([C@@]3(O)COC4CC3C4)ccc21 2126689398 JLZKXWKMTSFLJC-XUJLQICISA-N 259.349 2.065 10 10 CECE Nc1ccc(CCCN2CCCC[C@@H]2C(=O)O)cc1 2123049024 PVLVNSFRLVLBHA-CQSZACIVSA-N 262.353 2.141 10 10 CECE Cc1ccnc(CNCc2ccc(F)c(F)c2O)n1 2130071544 DHGZPGIADCYDRE-UHFFFAOYSA-N 265.263 2.059 10 10 CECE CC[C@H](N[C@@H](C)Cn1cnnc1)c1ccccc1O 2130155988 YBOGACGNKRRVJD-AAEUAGOBSA-N 260.341 2.113 10 10 CECE CN1CCc2cc(CN[C@H]3CC[C@](C)(O)C3)ccc21 2130303755 RPRFEXZFAMHZTN-HOCLYGCPSA-N 260.381 2.072 10 10 CECE CN[C@@H](CC1(C)OCCO1)c1ccc(N(C)C)cc1 1905307850 LNBBUJGSUQJPBE-AWEZNQCLSA-N 264.369 2.166 10 10 CECE CN(C[C@H]1CCO1)c1ccc(CO)c(Br)c1 1902004355 WAYIAOMMNALUAU-LLVKDONJSA-N 286.169 2.167 10 10 CECE Oc1cccc(F)c1CN[C@@H]1C[C@H]2[C@@H]1[C@H]1CC[C@H]2O1 2132227521 MKYCJRGWONYVMH-GNWSSZPXSA-N 263.312 2.187 10 10 CECE CCC1(NC(=O)c2cc(O)c(O)c(O)c2)CCCC1 2132351335 WMUVFBDFSRGCQV-UHFFFAOYSA-N 265.309 2.256 10 10 CECE Nc1ccc(CNC[C@@H]2C[C@H]2C2CCOCC2)cc1 2135353562 GSKNAEDMRVCIGH-HOCLYGCPSA-N 260.381 2.421 10 10 CECE CO[C@@H]1C[C@@H]2C[C@](O)(c3ccc(N(C)C)cc3)[C@@H]2C1 2133949570 QAPWXNNVKMIFBH-MPESAESLSA-N 261.365 2.385 10 10 CECE CC1(C)C=CCN1c1cc2c(cc1Cl)[C@H](O)C(=O)N2 1914235471 DJVIUYFTDBUAQA-LBPRGKRZSA-N 278.739 2.480 10 10 CECE CC[C@@]1(C(=O)O)CCCN1[C@@H](C)c1cc(O)ccc1O 215655883 UFAAZFHWSFFIOG-BONVTDFDSA-N 279.336 2.488 10 10 CECE COC1CN(c2ccc(C=CC(=O)O)c(Cl)c2)C1 1911935324 WKCYBSDUAGLCPQ-UHFFFAOYSA-N 267.712 2.273 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H]2C[C@H]2C1 1912152797 BNAYMMQFQAZLFN-SCVCMEIPSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=NCCCCN1C[C@@H](CO)[C@H](C(F)(F)F)C1 1912147462 JBCLTVIAKMLWFT-DTWKUNHWSA-N 266.267 2.180 10 10 CECE CCOC(=O)[C@@](C)(NCCN=[N+]=[N-])[C@H]1CCCSC1 1912193962 RKAVCIMQKRVVNT-JQWIXIFHSA-N 286.401 2.351 10 10 CECE CCCN(CCC)C(=O)CN1CCC[C@@H](N=[N+]=[N-])C1 1912179149 QIUUGOPFBNZODV-GFCCVEGCSA-N 267.377 2.410 10 10 CECE CCOC(=O)[C@H](CC)N1CCC[C@@H](CN=[N+]=[N-])C1 1912199060 NZAFYASZFAFDQT-QWRGUYRKSA-N 254.334 2.350 10 10 CECE C[C@H](CN1CCCC[C@@H](CN=[N+]=[N-])C1)CS(C)(=O)=O 1912147322 IFCCYRURXSIEIO-NEPJUHHUSA-N 288.417 2.080 10 10 CECE CC1(C)COC[C@@H](CN2CCC(CN=[N+]=[N-])CC2)O1 1912158242 VPIZTUUVQKOBMC-GFCCVEGCSA-N 268.361 2.203 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NCc2ccccc2O)cc1 1445968798 FOMDSHKMXCTNHT-UHFFFAOYSA-N 298.302 2.485 10 10 CECE CCOCCN(CC)CCCOc1ccc(N)cc1 111116793 KAQBDCOEAXDEOO-UHFFFAOYSA-N 266.385 2.396 10 10 CECE Nc1ccc(CCN2CC[C@@]3(CCC[C@@H]3O)C2)cc1 1918935293 PFZRRBMPJXKWDC-HOTGVXAUSA-N 260.381 2.048 10 10 CECE O=C(Nc1ccc(O)c(F)c1F)c1c(F)ccc(O)c1O 1611315280 DBQQWOLZBCOYFL-UHFFFAOYSA-N 299.204 2.473 10 10 CECE COc1ccc(N2C[C@@H](C)[C@@](C)(CN)C2)c(F)c1F 2136984028 HIUHHDGDGZFLIZ-OTYXRUKQSA-N 270.323 2.395 10 10 CECE Oc1ccc(CN[C@@]23CCC[C@@H]2CSC3)c(O)c1O 2137301604 BNUBKQCTDPXJLO-QMTHXVAHSA-N 281.377 2.179 10 10 CECE CN(C)c1ccc2c(c1)C[C@H](CC(=O)O)CCN2C 211955187 SZYMNKWZFDYKQT-LLVKDONJSA-N 262.353 2.226 10 10 CECE COc1ccc2c(c1Cl)C[C@@H](C(=O)O)CCN2C 212150990 OSNOLEPBTFRZFF-QMMMGPOBSA-N 269.728 2.432 10 10 CECE COc1ccc(N2C[C@@H](C)CNC[C@H]2C)c(OC)c1 217116683 ITZPDBWIKUIDSX-NWDGAFQWSA-N 264.369 2.138 10 10 CECE Oc1ccccc1CN[C@@H]1CCC[C@@H]1[C@@H]1CCCN1 228408101 AUQWQPZTTNVZHY-QLFBSQMISA-N 260.381 2.403 10 10 CECE C[C@@H](NCC(=O)N1CCCCC1)c1ccc(F)cc1O 228804183 XAIUZXKDPXFSDN-LLVKDONJSA-N 280.343 2.194 10 10 CECE CCOCCC1(C(=O)NCc2cc(O)ccc2O)CCC1 1558175398 PATHTQXNHWYFJG-UHFFFAOYSA-N 293.363 2.311 10 10 CECE CC(F)(F)C1(CNCc2ccc(O)c(O)c2O)CC1 1926805850 HGJGXEICDPOKFZ-UHFFFAOYSA-N 273.279 2.328 10 10 CECE CC[C@H](CSC)N(C)C[C@H](O)COc1ccc(N)cc1 123768213 NCYXWPUIVSAQGY-KGLIPLIRSA-N 298.452 2.082 10 10 CECE Cc1cccc(CNC(=O)C[C@H]2CO[C@@H](C)C2)c1O 2139759102 WEQFNZKBMQFZNF-RYUDHWBXSA-N 263.337 2.132 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1C[C@H]2O[C@H]1[C@H]1C[C@H]12 2139882195 SHQPBUHMOYYASZ-PISGWYDKSA-N 263.312 2.044 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](N)CC[C@H]3C2)cc1F 2141240400 BPPKJMRZUDXQIG-QJPTWQEYSA-N 264.344 2.398 10 10 CECE c1cc2c(cc1CN[C@H]1COC[C@H]1C1CC1)CCO2 914433876 XRZKOEBHNWSAJE-GJZGRUSLSA-N 259.349 2.136 10 10 CECE OCC[C@H]1CCCCN1c1ccc2c(c1)CC[C@H]2O 2141714612 HBNFMRDDZLINHE-CZUORRHYSA-N 261.365 2.408 10 10 CECE C[C@@H](NC[C@H]1CCCCN1C)c1c(O)cccc1O 235208015 YCOFFPFLGQMTQF-VXGBXAGGSA-N 264.369 2.233 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CSC3)C2)c(F)c1 1942546078 FFHREXVWRFPMRU-SECBINFHSA-N 253.342 2.432 10 10 CECE CC(=O)N(C)C1CCN(Cc2cc(F)c(F)cc2O)CC1 1142526997 FPZLOYOTYJWTMB-UHFFFAOYSA-N 298.333 2.113 10 10 CECE Cc1cc2c(n1-c1cccc(C(N)=O)c1)CCC[C@@H]2O 235851893 TXAOKCWSJCFLKN-HNNXBMFYSA-N 270.332 2.254 10 10 CECE CCC[C@@](C)(CO)NCc1ccc(F)c(F)c1O 877035270 GCXYGZOSSXACFD-ZDUSSCGKSA-N 259.296 2.311 10 10 CECE Cc1scnc1CNCc1cccc(O)c1O 1947329271 VJSRVHSIUHJNHL-UHFFFAOYSA-N 250.323 2.153 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](C)[C@](C)(O)C2)c(F)c1 1876950341 QSUFTWVCSHDXOJ-JRPNMDOOSA-N 266.360 2.443 10 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269.339 2.125 10 10 CECE C[C@H]1C[C@@]1(NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1885562395 FYOOXKJGMPRUCK-ZANVPECISA-N 297.359 2.058 10 10 CECE NCc1ccc(N2CC[C@@]3(CCO3)C2)cc1Br 1947809136 ZELOYZBMXYWTBG-CYBMUJFWSA-N 297.196 2.277 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2O)[C@@H]1COCC1(F)F 1888234873 VFHYTPGJDJCTOZ-QWHCGFSZSA-N 269.291 2.137 10 10 CECE C[C@H](NCC1(n2cccn2)CC1)c1cc(O)ccc1O 2144650550 IVDQHLJQOPDORQ-NSHDSACASA-N 273.336 2.134 10 10 CECE CN(Cc1ccccc1O)C(=O)c1ccnn1C1CC1 1964873349 GVQKFCCMKUSABC-UHFFFAOYSA-N 271.320 2.196 10 10 CECE Nc1ccc(CCC(=O)OC[C@@H]2CC(F)(F)CO2)cc1 2144787226 CXMNPANWPASGRW-LBPRGKRZSA-N 285.290 2.169 10 10 CECE CCOC(=O)c1c[nH]nc1CCCc1ccc(N)cc1 1951465983 VFCFAGULFQKKDN-UHFFFAOYSA-N 273.336 2.344 10 10 CECE CC(C)(C(=O)O)[C@H](N)c1ccc(N2CCCC2)cc1 1951897789 OGORZZPITLCZRG-CYBMUJFWSA-N 262.353 2.397 10 10 CECE CC1(C)SCC[C@H]1CNC(=O)c1cccc(O)c1O 1965403987 ZIJYEGZSXJMOGG-VIFPVBQESA-N 281.377 2.359 10 10 CECE Nc1ccc(CCNC(=O)[C@@H]2CC[C@@H]3[C@H]2C3(F)F)cc1 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CC[C@@H](CN(C)C)NCc1ccc(OC)c(C)c1 2029865803 DJONYZNBFUDNMI-AWEZNQCLSA-N 250.386 2.433 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C(CO)[C@H]3C2)cc1Cl 2030271989 DHLGBOVVNGSCDN-UWJYBYFXSA-N 267.756 2.068 10 10 CECE COCCNCc1ccnc(Sc2nccs2)c1 2037349155 USWNJCPBGRWRCH-UHFFFAOYSA-N 281.406 2.425 10 10 CECE COCC[C@@H](C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2037999113 CDIIJZUJSPHKJB-GHMZBOCLSA-N 254.334 2.350 10 10 CECE C[C@]1(C(F)(F)F)C[C@@H]1CNC(=O)c1ccc(O)c(O)c1 2161825263 YQPMEZQLYHNKPK-PELKAZGASA-N 289.253 2.416 10 10 CECE CSC[C@H]1CCCN1[C@@H](C)C(=O)Nc1ccc(N)cc1 400230673 ONMJOCGHAPUOLD-SMDDNHRTSA-N 293.436 2.423 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H](C)S(=O)(=O)[C@H](C)C2)cc1 400858793 VYNUAOHAZBTVSK-ZOWXZIJZSA-N 296.436 2.108 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H]3CCN(C)[C@H]3C2)c(F)c1 2158534518 AJKRVXGSKDWYIR-OZVIIMIRSA-N 278.371 2.409 10 10 CECE CC[C@H](O)c1ccc(N2CCc3nnccc3C2)cc1 2161187984 CDMCTLVBDKJCMM-INIZCTEOSA-N 269.348 2.483 10 10 CECE CCOc1cccc(CNC[C@H]2CCN2C2CC2)c1O 700806198 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CC(=O)c1cc(Cl)cc(CN(C)[C@@H]2CCN(C)C2)c1O 394237014 QHEHOKGWDQGMOE-CYBMUJFWSA-N 296.798 2.384 10 10 CECE COc1ccc(CN(C)[C@H]2COC(C)(C)C2)c(O)c1 396545741 UEWORIFKRDMLSN-GFCCVEGCSA-N 265.353 2.400 10 10 CECE COc1ccc(N(C)C[C@@H](C(=N)NO)C2CC2)cc1 397232683 HCOYGMWZNDOMEF-CYBMUJFWSA-N 263.341 2.114 10 10 CECE CCn1cnc(Cl)c1CNCCc1ccc(O)c(O)c1 2175303255 BOJXNNOOQDCNGE-UHFFFAOYSA-N 295.770 2.300 10 10 CECE CC(C)c1nccn1CCC(=O)Nc1ccc(O)c(O)c1 2062141688 QJWICXJIQPLPFE-UHFFFAOYSA-N 289.335 2.447 10 10 CECE COc1ccc([C@H](C)NC[C@H]2[C@H]3OCCC[C@H]23)c(O)c1 2176452774 KQZZXSKQZWIDRO-YDEYXMKJSA-N 277.364 2.476 10 10 CECE CCc1cc(C(=O)N(C)C)n(Cc2cc(C)ccc2O)n1 2070082932 UYTNEHSCACPMMV-UHFFFAOYSA-N 287.363 2.210 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(Cc2nc(CC(F)(F)F)no2)C1 2169741985 HQPNNMIVCZHGBA-SSDOTTSWSA-N 290.249 2.307 10 10 CECE COc1ccc(Cn2cc(Cl)c(O)n2)c(O)c1 2070608140 XFWCQOJIQNRCJC-UHFFFAOYSA-N 254.673 2.005 10 10 CECE CN(c1ccc(CN)cc1F)C1CC(n2ccnc2)C1 2182199560 RDUNIXULOXFOAM-UHFFFAOYSA-N 274.343 2.321 10 10 CECE CN(CCCN1CCCC1=O)c1ccc(CO)cc1Cl 2171706573 KLHRYZIZDAOPKJ-UHFFFAOYSA-N 296.798 2.281 10 10 CECE Cn1nccc1[C@@H]1CCN(c2ccc(CN)c(F)c2)C1 2171772019 DPZNGJQJOFAMLB-GFCCVEGCSA-N 274.343 2.012 10 10 CECE CC1(C)[C@@H]2[C@@H](CCN2CCCc2ccc(N)cc2)[C@H]1O 2178159743 JXKHMJZKAXOYQX-OWCLPIDISA-N 274.408 2.293 10 10 CECE Oc1c(F)cccc1CN1CC[C@@H]2CCO[C@H]2C1 1138124050 WZZDRTJJPARYMM-MFKMUULPSA-N 251.301 2.142 10 10 CECE C[C@]12CC[C@@]1(C)CN(CC(=O)Nc1ccc(N)cc1)C2 2181189415 XFJRGYGFSAGALB-IYBDPMFKSA-N 273.380 2.329 10 10 CECE CO[C@@H]1CCC[C@H](NCc2ccc(O)c(O)c2)C1 1172916646 CDGLFLWRFQKIJJ-NWDGAFQWSA-N 251.326 2.145 10 10 CECE CC[C@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)CCO1 2182912610 SSUZIHVFSQHPKH-MNOVXSKESA-N 279.336 2.127 10 10 CECE C[C@H](NC(=O)NCC(F)(F)F)c1ccccc1O 1187103235 GYKCHMCULPHJBC-ZETCQYMHSA-N 262.231 2.315 10 10 CECE C[C@H]1CN(CCN2CCc3cc(CN)ccc32)C[C@@H]1C 2189918019 HQTKHEKNUYNFBV-KBPBESRZSA-N 273.424 2.096 10 10 CECE C[C@H](O)c1cc(F)c(N2CC3(CCCN3C)C2)c(F)c1 2194516816 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JVHJZVGCOAJVFE-MRXNPFEDSA-N 271.364 2.193 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@]2(C(F)(F)F)CCNC2)cc1 2163073641 KYTLLIKRHSMVSP-CHWSQXEVSA-N 288.313 2.328 10 10 CECE CN(C)c1ccc([C@]2(N)COc3cc(O)ccc32)cc1 2163126336 IFKGZXRODFDRBT-MRXNPFEDSA-N 270.332 2.053 10 10 CECE COCC[C@@](C)(O)[C@H](N)c1ccc(N2CCCC2)cc1 2163245810 YGKYZBBPMOQGTG-HZPDHXFCSA-N 278.396 2.074 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H](O)c1cncs1 2163242930 NIVUHNWOTBEQRB-CABCVRRESA-N 289.404 2.477 10 10 CECE Cc1nn(C)c(C)c1/C=C/C(=O)Nc1ccc(N)cc1 704283292 HDVDWTXNXUDISK-CMDGGOBGSA-N 270.336 2.271 10 10 CECE COc1ccc(N2C[C@@H](N)[C@@H](C(F)(F)F)C2)cc1OC 2162672427 KHFOSNYVKLWFLC-VHSXEESVSA-N 290.285 2.030 10 10 CECE Cc1cc(/C=C/C(=O)O)ccc1N1C[C@@H]2C[C@H]1CO2 718313579 GNYIOLYKMQWEKC-CDBNLRSOSA-N 259.305 2.070 10 10 CECE C[C@@H](CCNCc1cc(Cl)c(F)cc1O)[S@](C)=O 816563504 AHGFXELOWQTGDZ-ASCAZGACSA-N 293.791 2.431 10 10 CECE Oc1cc(F)c(Cl)cc1CN1CCO[C@@H]2C[C@@H]21 816616861 IBUICCYQBIZFMZ-CMPLNLGQSA-N 257.692 2.158 10 10 CECE [N-]=[N+]=NCCCN1CC(NC(=O)OCc2ccccc2)C1 1953340738 JKBYAAYAQDBCQZ-UHFFFAOYSA-N 289.339 2.297 10 10 CECE CC[C@H](CC(F)F)C(=O)NCCc1ccc(O)c(O)c1 837481978 SYZNOMQBSRKATG-SNVBAGLBSA-N 287.306 2.438 10 10 CECE COc1ccc(N(C)CCn2cc(C)cn2)cc1OC 730086550 QVOHIXLYZXYMCU-UHFFFAOYSA-N 275.352 2.345 10 10 CECE COCCOC[C@@H](C)NC/C=C\c1ccc(N(C)C)cc1 835044356 ZAORBXXMJHTUFR-IYKSTZQJSA-N 292.423 2.407 10 10 CECE COCC[C@@H](C)N[C@H]1CCN(c2ccc(OC)cc2)C1 849321572 IBSRQBPZOYQTFW-KGLIPLIRSA-N 278.396 2.289 10 10 CECE CN(C)c1ccc(/C=C\CN[C@H](CO)CCF)cc1 846095533 AZCJWYMMSXNCJD-NQHOJNORSA-N 266.360 2.076 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@@H]4COC[C@H]43)ccc21 1899113289 RFPMPGJSKNXZJQ-DAXOMENPSA-N 258.365 2.248 10 10 CECE CCN(C(=O)/C(C)=C\c1cccnc1)c1cnn(C)c1 848344860 PNHOYXQNFKROMS-WQLSENKSSA-N 270.336 2.272 10 10 CECE CCN(CC)Cc1nc(Cc2ccc(N)cc2)no1 843162267 URGYVNOALYDHKI-UHFFFAOYSA-N 260.341 2.084 10 10 CECE CCO[C@H](CN[C@H](CC)c1ccccc1O)CN(C)C 926958248 FIBNYHLDSLSSCY-UKRRQHHQSA-N 280.412 2.400 10 10 CECE Cc1cc(C(=O)NCc2cc(Cl)ccc2O)nc(C)n1 857548524 MJOQLJPOBZFYKD-UHFFFAOYSA-N 291.738 2.382 10 10 CECE CCN(C[C@@H]1CCC2(COC2)O1)c1ccc(OC)cc1 929904690 NSZCKQXRZOSQHH-HNNXBMFYSA-N 277.364 2.470 10 10 CECE COc1ccc(CN[C@H]2CC[C@H](C)S(=O)(=O)C2)cc1C 850367777 DHBRCFAUTKZXDR-JSGCOSHPSA-N 297.420 2.059 10 10 CECE O[C@@H]1C[C@H](NCc2ccc3c(c2)CCO3)C12CCC2 850388057 GMHFMPYIPGQJFW-LSDHHAIUSA-N 259.349 2.015 10 10 CECE CCCOc1ccc(N2CC[C@H]2CNCCOC)cc1 696314974 MPPPBOLLRWFQFM-HNNXBMFYSA-N 278.396 2.290 10 10 CECE COc1ccc(N(C)CCN(C)c2nccnc2F)cc1 858605242 QVQHEBIQBOUIMV-UHFFFAOYSA-N 290.342 2.197 10 10 CECE Cc1cc(O)c(CN2C[C@@H]3COC[C@@]3(C)C2)cc1C 853568296 ZMHYKVINDNDPJR-GDBMZVCRSA-N 261.365 2.477 10 10 CECE C[C@H]1C[C@H](NCC2(N)CCOCC2)c2c(O)ccc(F)c21 863541041 IUAGGNIYEVVUHR-JQWIXIFHSA-N 294.370 2.177 10 10 CECE CSc1ccc(/C=C\C(=O)OCC(=O)C(C)=O)s1 860290533 SWAFUICREBJUKP-HYXAFXHYSA-N 284.358 2.185 10 10 CECE COc1cccc(CN2CCN(C)c3ncccc3C2)c1O 872264925 GXBJAQPUGKLLEJ-UHFFFAOYSA-N 299.374 2.248 10 10 CECE CC(C)[C@H]1CCN(C(=O)Cc2ccc(O)c(O)c2)C1 1137298940 HMWQWXPYMPLVHX-LBPRGKRZSA-N 263.337 2.145 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)OCO3)[C@H](CC)CN1 83456584 FLWKUWPMOVHPRV-VXGBXAGGSA-N 262.353 2.382 10 10 CECE COc1cccc2c1[C@@H](c1cc(O)ccc1O)NCC2 83598097 BLRYVSGFMLWKGN-MRXNPFEDSA-N 271.316 2.342 10 10 CECE Oc1ccc([C@@H]2NCCc3cccc(F)c32)c(O)c1 83621752 XPKVIQQKQJHPLM-HNNXBMFYSA-N 259.280 2.472 10 10 CECE Oc1ccc(O)c([C@H]2NCCc3ccc(O)c(F)c32)c1 83623432 JVBYWZJPTQRMQD-OAHLLOKOSA-N 275.279 2.178 10 10 CECE COc1ccc(N2CC[C@H](C(=O)O)C2)cc1Cl 84596225 DSGQRGZMRVTVCM-QMMMGPOBSA-N 255.701 2.260 10 10 CECE O=C(O)C[C@@H]1CCCN(c2ccc3c(c2)OCO3)C1 84628425 XRDCILSNOXPDSS-JTQLQIEISA-N 263.293 2.106 10 10 CECE CCOC(=O)[C@H]1CCCN(c2ccc3c(c2)CCN3)C1 84896059 KQUXVNLJVZFKRI-ZDUSSCGKSA-N 274.364 2.434 10 10 CECE C[C@@H](CCO)N(C)C(=O)c1cc2cc(O)c(O)cc2s1 898295070 TVKICOOGLHRGHH-QMMMGPOBSA-N 295.360 2.155 10 10 CECE CN(CC1C[C@@H]2C[C@H]2C1)c1ccc2c(c1)NC(=O)[C@H]2N 704405278 SOOFKXYWHBHYOO-HFAKWTLXSA-N 271.364 2.121 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCCC[C@H]1CCCCO1 1138096522 MFDDSCSGDVGJHH-CYBMUJFWSA-N 293.363 2.106 10 10 CECE C[C@@H](O)CCNCc1c(O)cccc1Br 706828529 GQMNVDBWHWKGBA-MRVPVSSYSA-N 274.158 2.015 10 10 CECE OCc1ccc(N2CC[C@]3(CCOC3)C2)cc1Cl 687913692 QDUWVUWBMXNKKY-AWEZNQCLSA-N 267.756 2.449 10 10 CECE CN(C(=O)CSC1CCOCC1)c1ccc(N)cc1 62053923 NDMBFSIHUZFDQK-UHFFFAOYSA-N 280.393 2.144 10 10 CECE C[C@H]1CN(Cc2ccc(Br)cc2O)[C@@H](C)CN1 691489276 UMBXUWDOKXITOE-UWVGGRQHSA-N 299.212 2.337 10 10 CECE Oc1cccc(Cl)c1CN1C[C@H]2CC[C@H]1[C@H]1CNC[C@@H]21 709965164 RYLOJNCAJBHWSZ-YXMPFFBPSA-N 292.810 2.475 10 10 CECE NCCCN(Cc1cc(F)ccc1O)CC(F)(F)F 714338487 OXAHIQNIGLSMKM-UHFFFAOYSA-N 280.265 2.244 10 10 CECE CC(C)NCc1ccc(N2C[C@H]3COC[C@H]3C2)cc1 718220517 LAEWGZUQTBPKAZ-GASCZTMLSA-N 260.381 2.267 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@]2(C)OC)c(O)c1 694465885 BHJUYIZYTUADDN-HERUPUMHSA-N 251.326 2.229 10 10 CECE COC[C@@H](CN1CCCc2cc([C@H](C)N)ccc21)OC 694630534 HCOHLLVITWIWGV-SWLSCSKDSA-N 278.396 2.120 10 10 CECE Cc1nnc(CN(C)c2ccc(CN)cc2C)s1 697805783 MLJZDJOGHQOMSB-UHFFFAOYSA-N 262.382 2.250 10 10 CECE CCN(C[C@@H]1C[C@H]1C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 698224052 MWOSJIDGRUKJDR-JRPNMDOOSA-N 274.364 2.179 10 10 CECE CCOc1ccccc1[C@@](C)(NCCN=[N+]=[N-])C(=O)O 90256450 XHHYQHPZWILIKO-CYBMUJFWSA-N 278.312 2.285 10 10 CECE CCOc1ncnc(NCc2cc(N)ccc2O)c1C 90789753 FWRCXKJPLOTWCL-UHFFFAOYSA-N 274.324 2.084 10 10 CECE C[C@@H]1CCO[C@H]1Cc1noc(Cc2ccc(N)cc2)n1 1918147992 OMPVUWOESXODJA-MFKMUULPSA-N 273.336 2.210 10 10 CECE NCc1ccc(N(CC(F)(F)F)C2COC2)c(F)c1 1886841021 KHOQOBAOLLGCCF-UHFFFAOYSA-N 278.249 2.052 10 10 CECE CNCc1ccc(N2CC[C@@H](CO)C[C@@H]2C)c(F)c1 2115823630 DEFNFEZBDQODGW-WCQYABFASA-N 266.360 2.142 10 10 CECE OC[C@H]1CCCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128279238 NJNFNWLWVHWDPY-LRDDRELGSA-N 261.365 2.265 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@]1(C)COCCO1 2117639205 LKQADDSRQPWLCM-CQSZACIVSA-N 285.771 2.283 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@H]4OCC[C@@H]4C3)ccc21 2128308350 CVHWGOVDYIFFIE-DAXOMENPSA-N 258.365 2.248 10 10 CECE CCO[C@@H]1CC[C@H](C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2118210394 MAKOWYGIWGWZCK-WDEREUQCSA-N 266.345 2.398 10 10 CECE COC[C@H]1CN(Cc2ccc(OC)cc2O)C[C@H]1C 2118638537 BKWJVBSQJGIKHK-DGCLKSJQSA-N 265.353 2.115 10 10 CECE NCc1cc(F)c(N2C[C@H]3C[C@H](O)C[C@H]3C2)cc1Cl 2128751884 GPQXHDDHQCDIIX-URLYPYJESA-N 284.762 2.145 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H]2C[P@@](C)(=O)C[C@H]2O)c1 2121368148 LHKKXBXNHWETGH-BDPOLOCLSA-N 283.308 2.087 10 10 CECE CN(CC(C)(C)CO)c1ccc2c(c1)CCC[C@H]2N 2128276245 YLNQYOHSSGMHIT-OAHLLOKOSA-N 262.397 2.477 10 10 CECE CC(C)(O)C1CN(c2ccc3c(c2)CCC[C@H]3O)C1 2128271698 PGVQKFPHEVRRFR-OAHLLOKOSA-N 261.365 2.263 10 10 CECE COc1ccc(O)c(CNCC[C@H]2CC[C@H]2OC)c1 2130388162 YEBYBULSAYTNRO-IAQYHMDHSA-N 265.353 2.306 10 10 CECE CNCc1ccc(N2CCC[C@H](C3(O)CC3)C2)cc1 2130503154 QXDBJNMWOJSMKA-AWEZNQCLSA-N 260.381 2.147 10 10 CECE Nc1ccc(CCCN2CC[C@H](O)[C@@H]3CC[C@@H]32)cc1 2133737019 NHZGJSSEINGSJO-PMPSAXMXSA-N 260.381 2.047 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(=O)O)c1ccc(Cl)s1 1912195045 XDGMLPARIAJYFU-SSDOTTSWSA-N 260.706 2.427 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCOC2CCOCC2)C1 1912186173 AMAGQBJCCOAICH-GFCCVEGCSA-N 268.361 2.204 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCS[C@H]2CCOC2)C1 1912193310 NGDFYMUBDPZKJD-QWRGUYRKSA-N 256.375 2.141 10 10 CECE COC1(C(F)(F)C(=O)NCCCN=[N+]=[N-])CCC1 1912173240 KDYYMYDKHVZANP-UHFFFAOYSA-N 262.260 2.007 10 10 CECE Cc1ccnc(C(=O)NCCN=[N+]=[N-])c1Br 1912171608 MYFXZNGKYIPCGE-UHFFFAOYSA-N 284.117 2.193 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CCC[C@@H]2CSC[C@@H]21 1912186640 BETQUWURAHCLPD-MDZLAQPJSA-N 298.412 2.351 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])C[C@@H]2CCC[C@@H]21 1912158962 BJFXKHCSZGVELB-NHCYSSNCSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 1912153399 GOYHCCANJMIMRZ-VIFPVBQESA-N 261.241 2.120 10 10 CECE CC1(C)CC(=O)N[C@@H]1CN1CCCC[C@@H](CN=[N+]=[N-])C1 1912209512 AOAPBOKKLLGVQY-NWDGAFQWSA-N 279.388 2.314 10 10 CECE NCc1ccc(N2CC[C@@]23CCOC3)cc1Br 1915801631 LCSIPIYDPCEMTP-ZDUSSCGKSA-N 297.196 2.277 10 10 CECE CCCOc1cc(N2CCCNCC2)ccc1[N+](=O)[O-] 111044587 FKGZFCPEPXKZIB-UHFFFAOYSA-N 279.340 2.183 10 10 CECE C[C@H]1CCC[C@@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1290826966 ILTKNMSTPXOYTJ-CMPLNLGQSA-N 263.337 2.335 10 10 CECE Cc1ccccc1CNC(=O)c1ccc(O)c(O)c1 226952909 JMWLJBSRLXLXNK-UHFFFAOYSA-N 257.289 2.336 10 10 CECE CCc1ccccc1/N=N/N1CCC(C(N)=O)CC1 1860488802 LGSLKBNGUKQTMT-WUKNDPDISA-N 260.341 2.445 10 10 CECE Cc1ccc(/N=N/N2CCC(C(N)=O)CC2)c(C)c1 1860494416 FMDXYNNEFNJXRY-WUKNDPDISA-N 260.341 2.499 10 10 CECE CN(Cc1ccc(N)cc1)[C@H]1CCO[C@@]2(CCOC2)C1 227179080 KHSCNZPNWPIONM-HOTGVXAUSA-N 276.380 2.039 10 10 CECE CC[C@@H](C)N[C@H](C(=O)O)c1ccc(N(C)C)cc1 211859118 JIIJVHUDBNAVPU-MFKMUULPSA-N 250.342 2.266 10 10 CECE CCN(CCC1CC1)C(=O)Cc1ccc(O)c(O)c1 1556112709 PIRDPYGRMBKARF-UHFFFAOYSA-N 263.337 2.289 10 10 CECE CN(c1ccc(CO)c(Br)c1)C1CSC1 1928037705 LRMSMSGBPQADHT-UHFFFAOYSA-N 288.210 2.493 10 10 CECE COc1ccc(N2CCC[C@@](C)(O)CC2)c([N+](=O)[O-])c1 230373300 BGOANFDRQMMFPH-CQSZACIVSA-N 280.324 2.345 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCO[C@@H]2C2CC2)cc1 230316836 JMEYBAHKUWZABP-HZPDHXFCSA-N 260.381 2.410 10 10 CECE C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)c1nnc[nH]1 230424570 WEBSXYOZUOYXDH-MNOVXSKESA-N 259.357 2.283 10 10 CECE CCN(CCCN(C)C)Cc1cc(C(C)=O)ccc1O 230724311 UAZHLFUZBLNYSY-UHFFFAOYSA-N 278.396 2.368 10 10 CECE Nc1cccc(Br)c1N[C@H](CO)C1CC1 1930724251 ORNWIRTZGNBRNJ-SNVBAGLBSA-N 271.158 2.214 10 10 CECE CCOc1cccc(CN[C@@H]2CCN(C)C[C@@H]2C)c1O 134408640 DXIYRPOXPZTCCL-GXTWGEPZSA-N 278.396 2.221 10 10 CECE COc1cc(N(C)C[C@@H]2CO[C@H](C)C2)ccc1CN 2139704915 SEAGROLLPIKSEX-VXGBXAGGSA-N 264.369 2.015 10 10 CECE COc1cc(N2C[C@@H]3C[C@H]3C2)ccc1CNC1CC1 2139702719 NWJPBZQLFJHGMR-STQMWFEESA-N 258.365 2.403 10 10 CECE Oc1cc(F)ccc1CNCc1cnn(C2CC2)c1 2139886245 ZNRBBIVWMDIWIG-UHFFFAOYSA-N 261.300 2.353 10 10 CECE COC[C@@]1(C)CCCN1Cc1c(O)cccc1OC 2139827529 TUNGMLOUTMLQMW-OAHLLOKOSA-N 265.353 2.402 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1C[C@H]2O[C@H]1[C@@H]1C[C@H]21 2139882197 SHQPBUHMOYYASZ-PRHQYYMVSA-N 263.312 2.044 10 10 CECE COc1cscc1[C@H](NN)c1ccccc1O 1950318873 ARXUXMJOMBVBNR-GFCCVEGCSA-N 250.323 2.015 10 10 CECE COC[C@H]1CCCN(c2cc(OC)c(OC)cc2N)C1 234853963 DCKNHDGWSJIPSP-NSHDSACASA-N 280.368 2.149 10 10 CECE CC[C@@H]1C[C@@H](NCc2c(O)cccc2OC)CCO1 817415370 RZPSGRJTMFGDDQ-NWDGAFQWSA-N 265.353 2.448 10 10 CECE COCCN(CC(C)C)c1ccc([N+](=O)[O-])c(CO)c1 234645074 JVRMSNJWIXASMS-UHFFFAOYSA-N 282.340 2.196 10 10 CECE COc1cccc(O)c1CN[C@@H]1CC[C@H](OC)C1 1116748882 ZGOVNYLFVSEREP-MNOVXSKESA-N 251.326 2.058 10 10 CECE COC[C@H]1CC[C@@]1(N)c1ccc2c(c1)CCCN2C 2142415986 FURSEEPWYSUGGK-GDBMZVCRSA-N 260.381 2.279 10 10 CECE CCN(CC)CCN(C)Cc1ccc(C)cc1O 1140948605 QPUGYXYVGGLYLJ-UHFFFAOYSA-N 250.386 2.474 10 10 CECE CN1CCc2cc([C@@H](C[C@@H]3CC34CC4)NN)ccc21 2142755476 PURPVIAOOFEKDM-ZIAGYGMSSA-N 257.381 2.374 10 10 CECE NCc1ccc(N2CC[C@]3(CCO3)C2)cc1Cl 1947807291 QBCRXRYGDFIKSI-ZDUSSCGKSA-N 252.745 2.168 10 10 CECE O=C(O)[C@H]1CC[C@@](F)(CNCc2ccccc2O)CC1 1875573100 OSVLBALPERCLIG-FUKZOUPISA-N 281.327 2.465 10 10 CECE CCN(CC)C[C@H](O)CN(C)[C@H](C)c1ccccc1O 2143385580 YQSPEUNBYDUZIJ-ZIAGYGMSSA-N 280.412 2.088 10 10 CECE CCCOc1cc(N2CCC(NC)CC2)ccc1N 1876334228 XXINFBOYSCYSFZ-UHFFFAOYSA-N 263.385 2.246 10 10 CECE C[C@H](c1ccccc1O)n1cncc1[C@H]1CCNC1 1877589963 ZBYLUADTHGTDGD-NEPJUHHUSA-N 257.337 2.275 10 10 CECE COc1cccc(O)c1CNCCc1ccns1 883242193 YSKORAYSIKOHEW-UHFFFAOYSA-N 264.350 2.190 10 10 CECE CN1CCCc2cc([C@H](N)C34CC(CO3)C4)ccc21 1878418174 JKCNOTDFUGADRN-AJQRCPHMSA-N 258.365 2.248 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@H]1CNC(C)(C)C1 1878955674 PBAUOTPQZSWOMJ-HIFRSBDPSA-N 261.413 2.401 10 10 CECE Oc1cc(Cl)ccc1CN[C@@H]1C[C@@H]2OCC[C@@H]21 1946511711 PZPRRSMXGFJIJP-WZRBSPASSA-N 253.729 2.313 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCCNCC1(C)C 1879327904 MLDATQRJNYHNJO-NSHDSACASA-N 264.369 2.233 10 10 CECE CO[C@]1(CNCc2ccc(O)cc2O)CCCSC1 1879920428 VZFHPWXVLNMVPV-AWEZNQCLSA-N 283.393 2.100 10 10 CECE COc1ccc([C@H](C)N2C[C@H](C)N(C)[C@H](C)C2)c(O)c1 129591932 FACADXHHBCABGY-XQQFMLRXSA-N 278.396 2.486 10 10 CECE OCc1ccc(N2C[C@H]3CO[C@@H](C3)C2)cc1Cl 1946911061 WIRKQYFEUQMHEU-CABZTGNLSA-N 253.729 2.057 10 10 CECE CC[C@@H](CN)Nc1c(N)cccc1Br 1888904583 CJFBGFDFLSQMDU-ZETCQYMHSA-N 258.163 2.181 10 10 CECE Cc1ccc(O)c(CNC[C@]2(O)C[C@@H]3CCC[C@H]32)c1 1890985983 NZGWXFQBXKIAGT-JGGQBBKZSA-N 261.365 2.341 10 10 CECE CC1(C)[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C1(F)F 1964863516 FHKNHSOORCMBRK-LLVKDONJSA-N 285.290 2.048 10 10 CECE C[C@H](N)c1ccc(N2CC(C)(CO)C2)cc1Cl 1951054299 XZRMNMSEGFQJSG-VIFPVBQESA-N 254.761 2.178 10 10 CECE CC(=O)C(=O)c1ccc(F)cc1I 1951322364 CZKSGCQXAHGKAD-UHFFFAOYSA-N 292.047 2.202 10 10 CECE CC1(C)C[C@H](N)CN(Cc2cc(F)ccc2O)C1 1967987184 QMOPNUHGBNJXSR-LBPRGKRZSA-N 252.333 2.091 10 10 CECE Oc1cc2c(cc1CN1CCCC[C@H]1CF)OCO2 1970441133 LCYQVPHWZBFBMJ-NSHDSACASA-N 267.300 2.445 10 10 CECE COC(=O)N[C@H]1CCN([C@H](C)c2ccc(C)cc2O)C1 252795669 BVVCRQICHVQNJK-NEPJUHHUSA-N 278.352 2.192 10 10 CECE CCN(Cc1c(O)cccc1OC)[C@H](C)CN(C)C 1971283979 IOFHDBIVFKDWDN-GFCCVEGCSA-N 266.385 2.173 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC1(C(N)=O)CC1 1972477643 BJAUXILZXFNNJD-MNOVXSKESA-N 274.364 2.104 10 10 CECE Oc1cccc(F)c1CN[C@H]1CC[C@]12CCCO2 1974345142 FFKIKFSFNFUMLO-UONOGXRCSA-N 251.301 2.333 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1cscc1C(=O)O 2148892633 IXVYOGGNVCTBND-UHFFFAOYSA-N 290.344 2.301 10 10 CECE COCCN(CCOc1ccc(N)cc1)[C@H](C)C1CC1 42614016 NPDJNYXHPVEKAL-CYBMUJFWSA-N 278.396 2.395 10 10 CECE COc1cc(Cl)cc(CN2CC[C@H](C3CNC3)C2)c1O 2149894584 LPVAYOGWKUJINL-JTQLQIEISA-N 296.798 2.096 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](CO)C2(C)C)cc1O 2151538305 ZMSBHFURFDOEPA-VXGBXAGGSA-N 278.396 2.270 10 10 CECE CCN[C@H](C)c1ccc(N2CC(OCCO)C2)c(Cl)c1 2152289023 SQHFYOUXFLHGQP-LLVKDONJSA-N 298.814 2.208 10 10 CECE OCCC1CN(c2c(F)cc(CNC3CC3)cc2F)C1 2152305270 WLLHKUXVQSECKI-UHFFFAOYSA-N 282.334 2.035 10 10 CECE CC[C@@]1(C)CC[C@H](CNC(=O)c2ccc(O)c(O)c2)O1 2153961931 OHCSHNQXWSJYNZ-ABAIWWIYSA-N 279.336 2.175 10 10 CECE CN(C)c1ccc([C@](C)(N)CC[C@@H]2COCCO2)cc1 2154773260 ZXADTTPRTZEWDJ-HZPDHXFCSA-N 278.396 2.122 10 10 CECE CCNCc1ccc(N2C[C@@H](O)[C@@H]2C)c(Cl)c1 2011379421 LKPDFAONGLXUTB-TVQRCGJNSA-N 254.761 2.019 10 10 CECE Cc1cncc(S(=O)(=O)N2CCC[C@H](N=[N+]=[N-])CC2)c1 2155558002 YXJYFTNFIFSVGX-NSHDSACASA-N 295.368 2.244 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)CCN2CCSC2=O)CC1 2155564020 NZWKKAARUVXDRM-SNVBAGLBSA-N 297.384 2.237 10 10 CECE CN(c1c(F)cc(CO)cc1F)[C@H]1C[C@@H]2COC[C@@H]2C1 2156142227 LXPPYSSCZHORAH-GDNZZTSVSA-N 283.318 2.318 10 10 CECE Cc1cc(N2CCO[C@@H](C)C2)ccc1CNC1CC1 50581190 HHJGQISQYJVASK-ZDUSSCGKSA-N 260.381 2.472 10 10 CECE C[C@H]1OC2(C)CC1(NC(=O)CCc1ccc(N)cc1)C2 2156683333 RTVCDCOQEKSNJK-VHWKEVPUSA-N 274.364 2.028 10 10 CECE CC[C@H](C)N1CCN(c2ccc(CNC)cc2)CC1 55068653 ZDDNJOBOXMVOQJ-AWEZNQCLSA-N 261.413 2.327 10 10 CECE CN(Cc1ccc(F)cc1O)C[C@H]1CCCOC1 295062920 AESSHQDEIOHKLY-LLVKDONJSA-N 253.317 2.390 10 10 CECE COc1ccc(N2CCC(C3(C)OCCO3)CC2)c(N)c1 2029099092 ABQNWAWDMAEWKD-UHFFFAOYSA-N 292.379 2.257 10 10 CECE CN(Cc1ccc(Cl)cc1O)[C@H](CN)C(F)(F)F 2029641700 PYJFVWLYPWHSSP-SNVBAGLBSA-N 282.693 2.367 10 10 CECE COc1ccc(N(C)C[C@H](N)c2cnsc2)cc1 2031561027 RQGGOQYGBGFJDT-ZDUSSCGKSA-N 263.366 2.288 10 10 CECE NCc1ccc(N2CC([C@@H]3CC3(F)F)C2)c(F)c1 2036163942 SNBVMRCTFLOQMP-JTQLQIEISA-N 256.271 2.376 10 10 CECE C[C@@H](O)C[C@@H](C)N(C)Cc1ccc(N(C)C)cc1 2037371375 ZFCNQLMGWRJBIV-CHWSQXEVSA-N 250.386 2.344 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)C[C@H]2CCCO2)CC1 2038002607 NKEMFNQWXYJSLQ-GHMZBOCLSA-N 252.318 2.247 10 10 CECE CN[C@H](C)c1ccc(N(C)C2CCC(O)CC2)cc1O 2160130660 SGMBZYYAYKQTOR-LKSINWNRSA-N 278.396 2.412 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2C[C@H]3C[C@H]2C[C@@H]3F)cc1 2157650214 NEIFIOHCVKQEJX-DHMWGJHJSA-N 276.355 2.454 10 10 CECE COc1cccc(CN[C@@H]2COC[C@H]2CC2CC2)c1O 2158041168 CBQVBBANCSBEPS-ZIAGYGMSSA-N 277.364 2.306 10 10 CECE Cc1cc(N2CCC[C@H](N)C2)ccc1O[C@H]1CCOC1 70072896 WCXAIFUHVSOQQB-ZFWWWQNUSA-N 276.380 2.090 10 10 CECE CN(C)C[C@H]1CCCN(C(=O)Nc2ccc(N)cc2)C1 404912558 JMOSQXMSXFXEFH-GFCCVEGCSA-N 276.384 2.074 10 10 CECE O=C([C@H]1CNc2ccccc2N1)N1CCCC(F)(F)C1 405147458 OFAXNLULJPQXNR-GFCCVEGCSA-N 281.306 2.150 10 10 CECE O=C1CCCCN1CCNCc1cccc(Cl)c1O 405405860 ZQSNWWQXRMPODD-UHFFFAOYSA-N 282.771 2.148 10 10 CECE CC(C)OC1CN(c2ccc([C@H](C)O)cc2[N+](=O)[O-])C1 2158709073 WHONCGPNMCVCGR-JTQLQIEISA-N 280.324 2.262 10 10 CECE COc1cccc(O)c1CNCC1CCC(CO)CC1 2160715061 VFYXIRHZYLKBNZ-UHFFFAOYSA-N 279.380 2.289 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2CCCCNC2=O)cc1Cl 2171079170 KJVFAMNFLGZDMF-YGRLFVJLSA-N 296.798 2.498 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)NCCCN=[N+]=[N-] 701302802 GOOAZVRWFOOLLB-OUAUKWLOSA-N 253.350 2.064 10 10 CECE CCCO[C@H]1CCN(c2ccc([C@H](C)O)c(O)c2)C1 701719699 MQPSOOYKSJYGSS-AAEUAGOBSA-N 265.353 2.451 10 10 CECE Nc1cc2c(cc1N1CCC[C@H]1C1CC1)OCCO2 706887748 VPRCTCYNQZVCTP-LBPRGKRZSA-N 260.337 2.419 10 10 CECE CC1(S(=O)(=O)N(Cc2ccc(N)cc2)C2CC2)CC1 710229622 PHBDJBNXXNCWHX-UHFFFAOYSA-N 280.393 2.116 10 10 CECE CCc1cnc([C@H](O)c2ccc3c(c2)CCCN3C)[nH]1 2163103992 ZXCINCBHJLMYOK-OAHLLOKOSA-N 271.364 2.436 10 10 CECE C[C@H]1C[C@@H](N)CCN1Cc1ccc(Br)cc1O 691488604 RJDKEHASLVMDRU-CABZTGNLSA-N 299.212 2.466 10 10 CECE CCn1ncc(CN(C)c2ccc(CNC)cc2Cl)n1 2172424449 QGZDYRVJEFSZMO-UHFFFAOYSA-N 293.802 2.307 10 10 CECE COc1cc(Cl)cc(CN2CCC[C@@H](N)[C@H]2C)c1O 381539255 CQPOZCFFQMMAQW-BXKDBHETSA-N 284.787 2.366 10 10 CECE CC(C)NCc1ccc(N2CCS[C@@H](CO)C2)c(F)c1 720003108 NSMHNWAJNIHIIZ-CYBMUJFWSA-N 298.427 2.238 10 10 CECE CC(C)N1CC[C@H](N[C@H](C)c2ccc(O)cc2O)C1 389175765 OYLMVKZZCMSSNP-NEPJUHHUSA-N 264.369 2.231 10 10 CECE CC[C@@]1(NCc2ccc3c(c2)CCN3C)CCOC1 393444596 RFMAIZIHIPIXQB-MRXNPFEDSA-N 260.381 2.338 10 10 CECE C[C@@H]1C[C@@H](C(=O)O)CN([C@H](C)c2c(O)cccc2O)C1 399031933 YESWFVKFQIGFHC-GMTAPVOTSA-N 279.336 2.201 10 10 CECE CNCc1ccc(N2CCO[C@@](C)(C3CC3)C2)cc1 822245425 FEBCDNHQWDREKK-MRXNPFEDSA-N 260.381 2.411 10 10 CECE CCC1(C(=O)NCc2c(O)cc(O)cc2O)CCCC1 2062169358 SYKKNZFTQWKMCM-UHFFFAOYSA-N 279.336 2.390 10 10 CECE CCc1cc(CN(C)C)n(Cc2cc(F)ccc2O)n1 2070117929 IXWXFSYVYSWNPS-UHFFFAOYSA-N 277.343 2.400 10 10 CECE CNCc1cc(C2CC2)nn1Cc1c(O)cccc1F 2070201656 OOOSBMQHZWFDRK-UHFFFAOYSA-N 275.327 2.373 10 10 CECE COC(=O)c1cn(Cc2cc(Cl)ccc2O)nc1C 2070244891 PLOHWABKWXDALX-UHFFFAOYSA-N 280.711 2.385 10 10 CECE CO[C@@H](C)CCN(C)[C@H](CN)c1ccc(N(C)C)cc1 2179924631 DDIIRFIYYADKSQ-XJKSGUPXSA-N 279.428 2.109 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2C[C@@H]1OCC[C@H]1F 2179080087 FGBUJLWCFXQRNA-XFJVYGCCSA-N 278.371 2.457 10 10 CECE Nc1cnn(Cc2cccc(F)c2O)c1C(F)F 2079033075 OOWWCLFBOKJPCB-UHFFFAOYSA-N 257.215 2.296 10 10 CECE C[C@H](c1ccccc1O)N(C)CC(=O)N1CCCCC1 2192603253 CYUPOOPIPVCHRA-CYBMUJFWSA-N 276.380 2.398 10 10 CECE C[C@@H](Nc1ncc(C(=O)O)cc1N)c1ccccc1O 2192625790 GHLOMZLSMCCNRI-MRVPVSSYSA-N 273.292 2.241 10 10 CECE Cc1cc(N2CC[C@@H](c3nncs3)C2)ccc1CCN 2196523052 VGYZJEPSHHSPFY-CYBMUJFWSA-N 288.420 2.342 10 10 CECE CC1CCN(C2CN(c3ccc(CO)cc3F)C2)CC1 2188379050 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CECE CN[C@H]1CCc2cc(N3C[C@H]4C[C@H]3CN(C)C4)ccc21 2184711845 WZFUTZWUMHITCG-NUTKFTJISA-N 271.408 2.034 10 10 CECE CN[C@@H]1CCc2cc(N3CCN(C)C(C)(C)C3)ccc21 2184710457 FXSLBSVATPQRNA-MRXNPFEDSA-N 273.424 2.424 10 10 CECE C[C@H](O)c1cnc(Sc2nnc3ccccn23)s1 2041812766 AHEJXGDXMPUSFL-ZETCQYMHSA-N 278.362 2.390 10 10 CECE Oc1cccc(F)c1CN[C@H]1CCO[C@@H]1C1CC1 2042629775 YZQFNFZIPXQSQR-GXTWGEPZSA-N 251.301 2.188 10 10 CECE C[C@H](N)[C@H]1CCCN(Cc2c(O)cccc2F)C1 2042633159 QFYODSCRMIXNJQ-QWRGUYRKSA-N 252.333 2.091 10 10 CECE C[C@@H]1CC[C@H](CC(=O)N2CCC[C@@H]2CN=[N+]=[N-])O1 2042884724 UBXBXAYKZUMEJK-GMTAPVOTSA-N 252.318 2.245 10 10 CECE Oc1cccc(Cl)c1CN[C@@]12COC[C@@H]1C2(F)F 2043601587 DXCDVYRNRPBNAR-QWRGUYRKSA-N 275.682 2.169 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3C[C@H](C[C@@H]3O)C2)c(F)c1 2194513692 OMESKAKQSRFDDA-VKZHRDFRSA-N 283.318 2.225 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1c(F)cc([C@H](C)O)cc1F 2194522774 LZDDGHWSSUEZJY-ZMLRMANQSA-N 282.334 2.301 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)c(F)c1 2194516803 JXLCVWKNSCAHOG-AFCLKFOHSA-N 283.318 2.489 10 10 CECE Cc1scnc1[C@@H](NN)c1ccc(N(C)C)cc1 2044734202 TXLGXYCIGCXXOS-ZDUSSCGKSA-N 262.382 2.070 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](C)[C@@H](CO)C2)c(F)c1 2194692570 VHORIBSGMDWEPJ-JBLDHEPKSA-N 284.350 2.439 10 10 CECE O=C(O)CC[C@@H]1CCN1Cc1cc(Cl)ccc1O 2047052929 QXFFFPDCHQYJJX-LLVKDONJSA-N 269.728 2.485 10 10 CECE CN(C)C[C@H]1C[C@@H](NCc2c(O)cccc2Cl)C1 2047173625 YRPAOWUJYQNRGJ-PHIMTYICSA-N 268.788 2.475 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@](C)(O)[C@](C)(O)C2)c(Cl)c1 2194620601 KZGOFSXONOOBGN-WKPIXPDZSA-N 298.814 2.072 10 10 CECE COc1ccc(O)c(CN2CC[C@@H]3CCOC[C@H]3C2)c1 2185446928 SLOSKZVQLFVALS-TZMCWYRMSA-N 277.364 2.259 10 10 CECE COCCC1(C(=O)NCC2(CN=[N+]=[N-])CC2)CC1 2054026661 POPYGBRZFZSXLK-UHFFFAOYSA-N 252.318 2.010 10 10 CECE CC[C@@H](O)c1ccc(N(C)C[C@]2(OC)CCOC2)cc1 2186194853 JZDUGFQQJJITDT-HZPDHXFCSA-N 279.380 2.372 10 10 CECE NCc1cc(F)c(N2CC[C@]3(CCO3)C2)cc1Cl 2057249106 LWJKAOSYCHRKJF-ZDUSSCGKSA-N 270.735 2.307 10 10 CECE CCCc1noc(CN2CCC[C@@H]2CN=[N+]=[N-])n1 2059054231 USMXHZMSDNXLLO-SECBINFHSA-N 250.306 2.297 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2059057722 DSYJJQFTFVDKDI-LMLFDSFASA-N 252.318 2.101 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@H](C2)N3)c(F)c1 2061949576 PCSPCNHJYMNLCC-PHIMTYICSA-N 250.317 2.165 10 10 CECE CN(C)C1CC(CNCc2cccc(Cl)c2O)C1 2065266859 ZCXWFTJNCGDQCT-UHFFFAOYSA-N 268.788 2.475 10 10 CECE CC[C@](C)(CN(C)Cc1cc(N)ccc1O)OC 2066248847 ZVNPSGFRIIJEHB-CQSZACIVSA-N 252.358 2.221 10 10 CECE CO[C@H]1CC[C@H](N(C)c2cc3c(cc2N)OCCO3)C1 2187277073 XRGXRHFALZOMPY-QWRGUYRKSA-N 278.352 2.044 10 10 CECE CC[C@H](CN(C)C(=O)Nc1ccc(N)cc1)OC 2068159252 ANWRETHIPACLRV-GFCCVEGCSA-N 251.330 2.158 10 10 CECE CC(=O)N1C[C@H]2C[C@H]1CN2c1ccc([C@@H](C)N)c(Cl)c1 2192286948 UHARRLUYGRMJQE-JIMOISOXSA-N 293.798 2.169 10 10 CECE Nc1ccc(NC[C@@]2(CO)C[C@H]2C(F)(F)F)cc1 2072456666 SRGBUEIISPJCHS-GHMZBOCLSA-N 260.259 2.242 10 10 CECE CCN=c1cc[nH]cc1CN(C)Cc1ccccc1O 2192597275 DJAWZMGJWJTHEC-UHFFFAOYSA-N 271.364 2.273 10 10 CECE C[C@H](CO)CN(C)c1c(F)cc([C@@H](C)O)cc1F 2074083234 RLDXDDCVVROUGS-DTWKUNHWSA-N 259.296 2.083 10 10 CECE CC1(C)[C@@H](O)CCCN1c1ccc(CN)cc1F 2076223128 MZZYXMHPNOLUIO-ZDUSSCGKSA-N 252.333 2.024 10 10 CECE CC(C)[C@H]1C[C@H]1CN(C)C(=O)c1cc(O)c(O)c(O)c1 2200107782 AISMGAMQTODBDV-WDEREUQCSA-N 279.336 2.168 10 10 CECE [N-]=[N+]=N[C@H]1CCN(Cc2ccnn2C(F)(F)F)C1 2079113656 IDZABWXPUPTTLD-ZETCQYMHSA-N 260.223 2.244 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CCN2CCC(F)(F)C2)CC1 2103801678 FOYGYVYPQPQIEF-NSHDSACASA-N 273.331 2.492 10 10 CECE CCOCCCN(C)c1ccc(CO)c(OC)c1 2084014066 NJRPPGJJYJFDCR-UHFFFAOYSA-N 253.342 2.050 10 10 CECE COc1cc(N2CCC(CF)CC2)ccc1CN 2084007172 ZVAVORFNZYDXMU-UHFFFAOYSA-N 252.333 2.340 10 10 CECE Cc1cccc(O)c1CN1C[C@@H]2CCC[C@H](N)[C@H]2C1 2104483690 IYAWNTKEAFIWOV-QEJZJMRPSA-N 260.381 2.260 10 10 CECE CCOC(=O)[C@@H](NCC(C)C)c1c(O)cccc1F 2104474211 ORHPBASESIKBDQ-ZDUSSCGKSA-N 269.316 2.381 10 10 CECE Cc1cccc(O)c1CNc1ccc(C(N)=O)cc1 2104508893 JBIURMWPEYEALH-UHFFFAOYSA-N 256.305 2.412 10 10 CECE CC[C@@H]1C[C@@H](C(=O)O)N(Cc2c(C)cccc2O)C1 2104508791 HKOCAXLALJLCMJ-YPMHNXCESA-N 263.337 2.386 10 10 CECE N[C@@H](c1ccccc1O)[C@H](O)C1CC(C(F)(F)F)C1 2105186189 OIWCEGCBOOYPJB-JPHXHPFSSA-N 275.270 2.341 10 10 CECE NC[C@H]1CCCCN(c2ccc3c(c2)COCC3)C1 2106331076 INNNFAKFPNJNQT-CYBMUJFWSA-N 260.381 2.325 10 10 CECE COc1ccc(CN[C@H]2COC[C@@H]2SC)cc1C 2086377423 GCDUJKCRBFGQJG-JSGCOSHPSA-N 267.394 2.224 10 10 CECE CN[C@H](COCC1CC1)c1ccc2c(c1)CCN2C 2106797695 CZYFAPYLQQZDLO-OAHLLOKOSA-N 260.381 2.366 10 10 CECE CC(C)[C@@]1([C@@H](O)c2ccc(N(C)C)cc2)CCNC1 2106790614 KAPDQKMQHIHBBW-JKSUJKDBSA-N 262.397 2.422 10 10 CECE CCN1CCc2cc([C@@]3(N)COCC[C@H]3C)ccc21 2106788381 PEAJQAQAEHLIBY-MLGOLLRUSA-N 260.381 2.279 10 10 CECE CC[C@H](C)C[C@@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2106855348 NBVKFOJRVZWTMJ-IUIKQTSFSA-N 262.397 2.476 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@@H](O)C(C)C 2106860703 UMZXKFYRXUJVIB-HOTGVXAUSA-N 262.397 2.346 10 10 CECE NN[C@@H](c1ccc(N2CCCC2)cc1)c1ccoc1 2106826722 VYFBJXCYDGLXNK-HNNXBMFYSA-N 257.337 2.433 10 10 CECE CN1CCCc2cc([C@@H](NN)[C@H]3CCCS3)ccc21 2106826031 PMYNUZSKWYEXNH-HUUCEWRRSA-N 277.437 2.469 10 10 CECE C[C@@H](N)c1ccc(N2CC3(CC(N(C)C)C3)C2)cc1 2108169347 ISACYIBWNISLPD-GFCCVEGCSA-N 259.397 2.237 10 10 CECE CCN(CCCC(=O)O)Cc1ccc(OC)cc1O 2088017995 QBYGSBNCQZESDU-UHFFFAOYSA-N 267.325 2.088 10 10 CECE C[C@H](c1ccccc1O)N1CC[C@H](C(=O)O)[C@H](F)C1 2108289195 TVJHABNWDSFCQS-ADEWGFFLSA-N 267.300 2.198 10 10 CECE CC(C)[C@@H]1CCN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2088655159 UGMLPDQHRZDGLW-WCQYABFASA-N 264.300 2.046 10 10 CECE C[C@H]1CCCN(CCCc2ccc(N)cc2)S1(=O)=O 2088645971 FTTVRAIVPKOOPP-LBPRGKRZSA-N 282.409 2.016 10 10 CECE C[C@H](Nn1cnnc1)c1ccc2ccccc2c1O 2089410680 UQISIVOFRGSZBL-JTQLQIEISA-N 254.293 2.442 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@@H]1CC[C@H]2C[C@@H]2C1 2109681768 UTTJBSVPWRYFRX-HBNTYKKESA-N 261.321 2.358 10 10 CECE COc1ccc([C@H](NN)c2ccccc2O)c(F)c1 2090037837 QWONJRKGLJKQQI-AWEZNQCLSA-N 262.284 2.093 10 10 CECE C[C@@H]1C[C@@H]1[C@@H](C)NC(=O)CCOc1ccc(N)cc1 2090354902 CENXQZQWVNYWTI-GYSYKLTISA-N 262.353 2.198 10 10 CECE Nc1ccc(CCCN2CCCCC[C@@H]2CO)cc1 2090613107 PGPPDUWGTXTVBK-MRXNPFEDSA-N 262.397 2.438 10 10 CECE CC(C)NCc1cc(F)c(N2CC[C@H]2CO)c(F)c1 2092548515 OMMMCKLGGFPSKH-NSHDSACASA-N 270.323 2.034 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C3(CC3)C2)c(C)c1 2093341881 SSHSWTHGKZNSEC-OAHLLOKOSA-N 260.381 2.066 10 10 CECE CC1(C)CCC[C@@]1(CO)NCc1ccc(O)cc1O 2094152360 XMDNTOPIUYQHAY-HNNXBMFYSA-N 265.353 2.129 10 10 CECE CCOC1([C@@H](CN)N(C)c2ccc(OC)cc2)CC1 2095141513 DQKSHFWKOTUXET-CQSZACIVSA-N 264.369 2.028 10 10 CECE COc1cccc(CN(C)C[C@H]2OCC[C@H]2C)c1O 2096126039 KEPDBORTQVKQJS-BXUZGUMPSA-N 265.353 2.258 10 10 CECE CC[C@@]1(C)CN(c2c(F)cc(CO)cc2F)CCO1 2096397010 XDHBKFKMWNTICQ-AWEZNQCLSA-N 271.307 2.462 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)COCC3)C[C@@H]1C 2096488899 XEPOSZODJAUJEM-BLLLJJGKSA-N 260.381 2.194 10 10 CECE OC[C@H]1CC[C@H]1NCc1cc(Br)ccc1O 2210354762 BTGKHXFBCXVMRQ-LDYMZIIASA-N 286.169 2.015 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[S@@](=O)C(C)(C)C1 2114496369 RLHVRWYKUPYSPF-GIGQVBGESA-N 285.384 2.435 10 10 CECE Nc1ccc(CC(=O)N2CCC[C@@H](C3CC3)C2)cc1 2114997399 QIWDOKUPIXIQGF-CQSZACIVSA-N 258.365 2.460 10 10 CECE COc1cc(N(C)C[C@H]2COC(C)(C)C2)ccc1CO 2204556600 FUZJKVSGXJLHIP-LBPRGKRZSA-N 279.380 2.439 10 10 CECE CCNCc1ccc(N(C)CCCN(C)C)cc1OC 2204546372 AOOUGEKCPGXHMG-UHFFFAOYSA-N 279.428 2.193 10 10 CECE COc1cc(N2CCO[C@H](C3CC3)CC2)ccc1CN 2204553722 IDGYQTOCSDYKES-HNNXBMFYSA-N 276.380 2.159 10 10 CECE COc1cc(N(C)CC[C@H]2OCC[C@@H]2C)ccc1CO 2204549668 KDTAWHGRIPFISY-SWLSCSKDSA-N 279.380 2.439 10 10 CECE CCC12COC(CNCc3c(O)cccc3OC)(C1)C2 2205390216 FRJZGPKENLNANH-UHFFFAOYSA-N 277.364 2.450 10 10 CECE COc1cccc(O)c1CNC1C[C@H]2COC[C@H](C1)C2 2206782966 MUIOPYOJEZQKCP-RYUDHWBXSA-N 277.364 2.306 10 10 CECE Cc1cc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)ccc1[C@H](C)N 2269661289 DYJDLFLEWQPRTF-XPCVCDNBSA-N 260.381 2.222 10 10 CECE Cc1cc(N2C[C@H](C)[C@@H](N(C)C)C2)ccc1[C@@H](C)N 2269668536 VLJSIPQDZVCXHH-ZENOOKHLSA-N 261.413 2.401 10 10 CECE OCCCC1CN(c2ccc(CO)cc2Cl)C1 2216689264 KVEPXDFCJCZOFK-UHFFFAOYSA-N 255.745 2.041 10 10 CECE COc1ccc(N2CC(P(C)(C)=O)C2)c(CCN)c1 2270657146 UOJOKGSGQODPSP-UHFFFAOYSA-N 282.324 2.008 10 10 CECE COc1ccc(N2CCC[C@@H](C)[C@@H]2CO)c(F)c1 2219611262 ZJLQGXMNYMJZDI-YGRLFVJLSA-N 253.317 2.432 10 10 CECE CCO[C@@]1(CN2CCC[C@H](N=[N+]=[N-])CC2)CCOC1 2271591614 SCTKOHKTTQXRBZ-QWHCGFSZSA-N 268.361 2.347 10 10 CECE Cc1cc(N2CC[C@@H](OC(F)F)C2)ccc1CCN 2230684893 QWGJAXZMJSJLDB-CYBMUJFWSA-N 270.323 2.314 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@@H]2[C@H](CO)C[C@H]2C1 2232091974 NBEUDTJWCHDNHK-UNQGMJICSA-N 261.365 2.113 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@]1(C)CO 2235062035 LVLGUAOSJRKPLW-NOZJJQNGSA-N 285.290 2.463 10 10 CECE C[C@@H]1CN[C@H](C)[C@@](O)(c2ccc(N3CCCC3)cc2)C1 2235905217 MXCANQGULMRAMU-JJRVBVJISA-N 274.408 2.492 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@](C)(COC)C1 2235974216 WJMKTACFMKSABE-MRXNPFEDSA-N 278.396 2.277 10 10 CECE CC1(C2CCC2)CN(C(=O)COc2ccc(N)cc2)C1 2236269476 VUJQGFRLRROTIK-UHFFFAOYSA-N 274.364 2.296 10 10 CECE CCOc1ccc(N2CC[C@@H](O)[C@@H]2C)cc1OCC 2226536865 CYWKRMNJAJADIE-WCQYABFASA-N 265.353 2.444 10 10 CECE C[C@H](O)C[C@@H]1CCCN1c1ccc2c(c1)OCCO2 2226764163 DMNLUPISDPDIAV-RYUDHWBXSA-N 263.337 2.198 10 10 CECE CC1(C)CN(c2ccc3c(c2)COCC3)C[C@H]1CO 2226710029 CZDIPVIQYRQDAZ-AWEZNQCLSA-N 261.365 2.214 10 10 CECE CN(C[C@@H]1CCC[C@H]1O)c1ccc2c(c1)COCC2 2226707003 GTPRBWIRKNUZOI-XJKSGUPXSA-N 261.365 2.357 10 10 CECE COc1ccc(N2CCCC[C@H]2[C@@H](C)O)c(OC)c1 2226808796 MILHSYUGFIAPNI-YPMHNXCESA-N 265.353 2.444 10 10 CECE COc1ccc(N(C)[C@@H](CO)CC2CC2)c(C=O)c1 2227694248 AHXOTFPNUONZRY-CYBMUJFWSA-N 263.337 2.105 10 10 CECE COc1ccc(N(C)C[C@H]2CC[C@@H]2OC)c(CO)c1 2227823389 YQUHYUPLYGEQCG-ABAIWWIYSA-N 265.353 2.049 10 10 CECE Nc1ccc(O)c(CN2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@H]3C2)c1 2228691528 QFTISSNSQGTCDL-BAESOJJISA-N 256.349 2.228 10 10 CECE [N-]=[N+]=NCCS(=O)(=O)CC1CC(C(F)(F)F)C1 2250111356 KOAXKCWICQCRLR-UHFFFAOYSA-N 271.264 2.300 10 10 CECE CSc1ncc(CNCC(C)(C)[C@@H](C)N)s1 2243844886 RJYIHLOXFPLTRQ-MRVPVSSYSA-N 259.444 2.328 10 10 CECE Cc1nsc(CNCc2ccc(Cl)cc2O)n1 2246784668 WXUXQODAEREINL-UHFFFAOYSA-N 269.757 2.495 10 10 CECE Nc1ccc(CCCS(=O)(=O)C2C[C@H]3C[C@@H]3C2)cc1 2270211110 GYLOJWZHJPETLO-CHWSQXEVSA-N 279.405 2.415 10 10 CECE COc1ccc([C@@H](C)N[C@@H]2C[C@H]3CO[C@H]2C3)c(O)c1 2270764946 WRJWQCUBKVVGTB-VWFAINMRSA-N 263.337 2.229 10 10 CECE COCC1(C)CC(NCc2cccc(O)c2O)C1 2260998951 MPBQVLOAMPRLBC-UHFFFAOYSA-N 251.326 2.003 10 10 CECE C[C@@H](O)CN(c1ccc([C@@H](C)O)c(O)c1)C(C)(C)C 2272495629 DWIJNENVGRXWQR-GHMZBOCLSA-N 267.369 2.431 10 10 CECE CC1(C)[C@H]2CO[C@@]1(C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-])C2 2273636849 NUJFQDYZYQKZHA-VWMGYNLJSA-N 264.329 2.149 10 10 CECE OC[C@@H]1[C@H]2CC[C@H](C2)N1c1ccc(OCF)cc1 2263952440 HYXHRGRLRXMVLQ-ZKYQVNSYSA-N 251.301 2.342 10 10 CECE COC(=O)[C@H](CCCCN)Nc1c(N)cccc1Cl 2273881038 YDDQECPNLOVUJZ-NSHDSACASA-N 285.775 2.005 10 10 CECE COc1ccc(N2CC(F)(F)C[C@H]2CN)c(C)c1 2264309197 RYDJSVQGIJMRLH-JTQLQIEISA-N 256.296 2.176 10 10 CECE COc1ccc(N2CC[C@@H](CCO)C2)c(OC)c1C 2277977690 RNVUZVLUNHHPFU-LBPRGKRZSA-N 265.353 2.221 10 10 CECE COC[C@]1(C)[C@@H]2C[C@H]2CN1c1ccc(CO)c(C)c1 2269121889 SKIVUMVINQVXRU-NUEKZKHPSA-N 261.365 2.349 10 10 CECE CC(=O)c1ccc(C=C2SC(=S)N(C)C2=O)o1 2293175949 CFZCJTJXYRDIKZ-UHFFFAOYSA-N 267.331 2.313 10 10 CECE COC[C@@]1(C)C[C@@H]1CN(C)c1ccc(OC)cc1CO 2284681770 GFAOAAVWUCGVQW-CZUORRHYSA-N 279.380 2.296 10 10 CECE COC[C@]1(C)COCCN1c1ccc([C@H](C)N)c(C)c1 2285132586 PGFRMFQTFBDRAW-XJKSGUPXSA-N 278.396 2.256 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nncn2C)cc1C 2285142993 CEAOOPBMBJGAPU-LBPRGKRZSA-N 273.384 2.040 10 10 CECE Cc1cc(N(C)[C@@H]2CCCCNC2=O)ccc1[C@H](C)N 2285122875 YOWSCMZQUWMSJH-SWLSCSKDSA-N 275.396 2.120 10 10 CECE CCN1CCc2cc([C@]3(O)CCCCNCC3)ccc21 2287918949 NRVMQTZVDZZWLD-KRWDZBQOSA-N 274.408 2.420 10 10 CECE COC[C@@H]1C[C@H](CN)N([C@@H](C)c2cc(C)ccc2O)C1 2289587566 JRCBMTUCTCKPGG-BFHYXJOUSA-N 278.396 2.057 10 10 CECE COc1ccc(NCc2ccc(O)c(O)c2)c(C)n1 1169995054 QEXPCVNATACBIC-UHFFFAOYSA-N 260.293 2.422 10 10 CECE Cc1ccc(CN2CCN[C@H](C)C2)c(O)c1Br 2307429188 MAFWRHXPHPFUMB-SNVBAGLBSA-N 299.212 2.257 10 10 CECE O=C(O)C1(Sc2nccs2)CC(n2ccnc2)C1 2326903707 MMSAWJAZUWMVQP-UHFFFAOYSA-N 281.362 2.290 10 10 CECE CC1(C)[C@@H]2NCC[C@@H]2[C@]1(Sc1nccs1)C(=O)O 2326904864 WLIFMODFZOSTGJ-SXMVTHIZSA-N 284.406 2.077 10 10 CECE CCCC1(O)CN(c2ccc(CN)c(SC)c2)C1 2328546256 HSXINQJEIBKAMQ-UHFFFAOYSA-N 266.410 2.218 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1cccc(F)c1O 2329224502 VYTTVNHBCGGFOL-CDGCEXEKSA-N 265.328 2.434 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@H]1CC[C@@H]2C[C@H]12 2329677128 DOBJQTZZSQUTTC-USWWRNFRSA-N 261.321 2.011 10 10 CECE Oc1c(CNC[C@H]2[C@@H]3CCOC[C@@H]32)ccc(F)c1F 2331247861 QKJXJSNPVHJBGE-DCAQKATOSA-N 269.291 2.043 10 10 CECE NCc1ccc(N2C[C@@H]3CCO[C@@H]3C2)cc1C1CC1 2339159463 FBUXOHDAPMHWEN-XJKSGUPXSA-N 258.365 2.248 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(CO)C2)c(C)c1C 2340861143 GHCOCOFAXBHYAT-ZDUSSCGKSA-N 262.397 2.402 10 10 CECE CN(C)[C@H]1C[C@@H]2C[C@H]1CN2c1ccc(CN)cc1Cl 2340994024 DGMKXBMHHALFNG-HUBLWGQQSA-N 279.815 2.328 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCN(C)[C@H]3C[C@H]32)c1C 2341066226 ZLUGSNXDTJONAU-UHOFOFEASA-N 260.381 2.249 10 10 CECE CSc1cc(N(C)C[C@]2(F)CCOC2)ccc1CN 2353851932 PIODWGFTRFQTMS-CQSZACIVSA-N 284.400 2.432 10 10 CECE CSc1cc(N2C[C@@]3(C)C[C@@]3(CO)C2)ccc1CN 2353852988 ZOJGEPITTZBPMG-CABCVRRESA-N 278.421 2.076 10 10 CECE C[C@@H](NC[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21)c1cc(O)ccc1O 2353918739 UVKZPOMNMUHHTR-KYLTWLSDSA-N 275.348 2.172 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@H]3C[C@@H]2CO)c(F)c1F 2354708018 FHTDJMFOZZFTPH-WCQGTBRESA-N 282.334 2.163 10 10 CECE C[C@H](N[C@H]1C[C@@H]2C[C@H]1C[C@]2(C)O)c1ccc(O)cc1O 2355731310 WSQHZMQLYUALJN-CXFMUKIQSA-N 277.364 2.298 10 10 CECE COc1cccc(CNC(=O)C2[C@@H]3CCCC[C@@H]23)c1O 175216262 RBKAXBVYXHYILJ-VXGBXAGGSA-N 275.348 2.453 10 10 CECE CCc1cc(CN)c(O)c(Br)c1OC 218053443 TUKIXDFLHKUPIA-UHFFFAOYSA-N 260.131 2.184 10 10 CECE CCN(C(=O)c1cccc(O)c1O)[C@@H]1CCCC[C@H]1CN 126697398 PBWFSUUUOQGTRW-WCQYABFASA-N 292.379 2.077 10 10 CECE Nc1ccc(CC(=O)NC2(C(=O)O)CCCCCC2)cc1 40481790 JKDLSJNLGFDIMH-UHFFFAOYSA-N 290.363 2.105 10 10 CECE COCCN(c1ccc(/C=C/C(=O)O)cc1)C1CC1 49038466 UDCVJIWNGZMFRQ-RUDMXATFSA-N 261.321 2.400 10 10 CECE CSC[C@@H](C)NC(=O)CCc1ccc(N)cc1 229342809 RMFRILXPGSVIOY-SNVBAGLBSA-N 252.383 2.069 10 10 CECE CCN1CCN(Cc2cccc(F)c2O)[C@H](C)C1 289863817 VNDCJBLCRTXFGI-LLVKDONJSA-N 252.333 2.057 10 10 CECE CCN(CC(=O)NC(C)C)[C@H](C)c1ccc(OC)cc1O 133189906 KRXLTHIUFURZGP-GFCCVEGCSA-N 294.395 2.308 10 10 CECE CC[C@@H](NCC[S@](=O)CC)c1ccccc1O 132530110 VTYKOFMQFDILNV-PXAZEXFGSA-N 255.383 2.202 10 10 CECE OC[C@H]1C[C@@H]1NCc1cc(Cl)cc(Cl)c1O 381624524 HWBOIMXPTLVJSJ-XCBNKYQSSA-N 262.136 2.169 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N1C[C@@H]2CC[C@H](C1)O2 220582748 HJOBGZBDGAYBLA-ZXKZAWIKSA-N 273.332 2.460 10 10 CECE Nc1ccc(CN2C(=O)c3cc(F)c(F)cc3C2=O)cc1 88570271 CNVRITXVOQAKSA-UHFFFAOYSA-N 288.253 2.343 10 10 CECE O=C(NC[C@@H]1CCCCS1)c1ccc(O)c(O)c1 230176917 PBBOSRVDCUCKHV-JTQLQIEISA-N 267.350 2.113 10 10 CECE Oc1nc(O)c(C(F)F)cc1I 238698572 WPHVMYYNJOHTCS-UHFFFAOYSA-N 287.003 2.035 10 10 CECE CC[C@@H]1CC[C@](NCCCN=[N+]=[N-])(C(=O)OC)C1 90259639 WEZOEMQBYWUROW-ZYHUDNBSSA-N 254.334 2.398 10 10 CECE CCN(CC(=O)Nc1ccc(N)cc1)Cc1ccccn1 94911047 XIWBEJZKJLRODF-UHFFFAOYSA-N 284.363 2.124 10 10 CECE N[C@H](c1c(O)ccc(O)c1Br)C1CC1 238568805 QSVYUDGIGGLKHV-JTQLQIEISA-N 258.115 2.270 10 10 CECE COc1cc(Br)cc([C@@H]2CCN2)c1O 95785074 GBZXBWCVHPPJPI-QMMMGPOBSA-N 258.115 2.198 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)N(C)C2CNC2)c1 90289447 JGEHXYKFBHATMI-NSHDSACASA-N 291.395 2.095 10 10 CECE Cc1cc(C)cc([C@@H](NCCCN=[N+]=[N-])C(N)=O)c1 90260191 MGGUQVSYJNAOFK-GFCCVEGCSA-N 261.329 2.120 10 10 CECE COC(=O)[C@@]1(NC2CC2)CC[C@H](Sc2nccs2)C1 93851738 ZYTYDTGDFUKLIH-GXFFZTMASA-N 298.433 2.452 10 10 CECE O=S(=O)(Cc1cccc(F)c1)Nc1ccc(O)cc1 243584159 OQELNLHZDPYRSZ-UHFFFAOYSA-N 281.308 2.473 10 10 CECE CC(C)(C)OC(=O)Nc1ccc(O)c([C@H](N)C2(O)CC2)c1 1952670340 LPGXCNBKNZRPGN-LBPRGKRZSA-N 294.351 2.264 10 10 CECE CC1=CCC2(C(=O)NNC2=O)[C@@H](c2ccc(Cl)cc2)C1 248342563 YJYKJYASCHHWAU-GFCCVEGCSA-N 290.750 2.311 10 10 CECE COc1cc(C(F)F)c(O)c([C@H](N)CCC(=O)O)c1 258788442 XZGSSXPKAJPWAX-SECBINFHSA-N 275.251 2.203 10 10 CECE COc1ccc(N2C[C@H](CCO)C(C)(C)C2)c(N)c1 2230123034 CPPFWVDQHBRSSJ-NSHDSACASA-N 264.369 2.122 10 10 CECE Cc1cccc(CN2CCCC[C@@H]2[C@H]2CNC(=O)C2)c1O 373216908 OZUWPSOJKGAXGY-HUUCEWRRSA-N 288.391 2.191 10 10 CECE C[C@H](NC[C@H]1CCCCN(C)C1)c1c(O)cccc1O 700818007 IPNSYBCJAXPLNF-QWHCGFSZSA-N 278.396 2.480 10 10 CECE CC(=O)C(=O)COC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 808505656 JUIDNGYXBYRIBS-IUCAKERBSA-N 280.242 2.056 10 10 CECE C[C@H]1[C@H](N)[C@H](C)CCN1c1ccc2c(c1)OCCCO2 2162658094 GNBOIJZMQXHQGP-BFQNTYOBSA-N 276.380 2.410 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)[C@@H]1CC[C@@H]2C[C@@H]21 2165543991 RCEVMCPLWZMPHN-HKCMKHECSA-N 273.380 2.326 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@](C)(N)C(F)(F)F)ccc21 2163109315 YCDBWUCEKRZYFY-CHWSQXEVSA-N 288.313 2.382 10 10 CECE Oc1cccc(Cl)c1CN1CCC[C@@H]2CNC[C@H]21 299919259 LLYUGHXDLAZRSC-ZWNOBZJWSA-N 266.772 2.229 10 10 CECE CC[C@H](O)CN(c1cc(OC)c(OC)cc1N)C1CC1 2163680891 NXUJMNVJZUOKLS-NSHDSACASA-N 280.368 2.026 10 10 CECE N[C@@H](c1cccc(Br)c1O)C1CCNCC1 709692447 ZSYXJMKSGIWMLR-LLVKDONJSA-N 285.185 2.154 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1nc(C)cn1C 2166634867 KBLRTQNTYWIJPG-OAHLLOKOSA-N 270.380 2.030 10 10 CECE Oc1ccccc1CN[C@@H]1CCN(C2CCCC2)C1 106473577 CVKUFJPXWYZXCV-CQSZACIVSA-N 260.381 2.499 10 10 CECE CC(C)[C@@](N)(C(=O)O)c1cc(Br)ccc1O 713758896 GEOOYYMRZYGWCL-NSHDSACASA-N 288.141 2.049 10 10 CECE C[C@H](N[C@H]1CNCC[C@H]1C)c1ccc(F)cc1O 817969039 QGVQPWKLNJIEFD-NRUUGDAUSA-N 252.333 2.180 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@H]2CO3)cc1Cl 718354484 OZUAIFIJQRNYDU-RYUDHWBXSA-N 252.745 2.037 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CNCC[C@@H]2C)c1 817968997 OVLWZZJZJJKZPK-MJVIPROJSA-N 264.369 2.049 10 10 CECE COc1cc(Cl)cc(CN2CCC3(COC3)C2)c1O 827642663 AWAUBGNHFXRUPW-UHFFFAOYSA-N 283.755 2.277 10 10 CECE COc1cccc(O)c1CN1CC2(CCOCC2)C1 839141642 USFPVFIMFSRICN-UHFFFAOYSA-N 263.337 2.013 10 10 CECE Cc1ccc([C@@H](C)N[C@H](C(=O)O)C(C)C)c(O)c1 43430214 VTLLKWQECHJWGC-MFKMUULPSA-N 251.326 2.460 10 10 CECE Cc1cc(O)c(CNCCc2n[nH]c(C)n2)c(Cl)c1 840908253 QWVCMCLKCCKHHE-UHFFFAOYSA-N 280.759 2.113 10 10 CECE CN(C)c1ccc(CN(C(=O)Cc2ccon2)C2CC2)cc1 746118179 SZWIBMSVNKBRMG-UHFFFAOYSA-N 299.374 2.474 10 10 CECE CCN(CCN=[N+]=[N-])CCNC(=O)OC(C)(C)C 1953341761 TWPUAHBFXUJHMX-UHFFFAOYSA-N 257.338 2.143 10 10 CECE CCN(CC)c1ccc(CN(C)C2CC(N)C2)cc1 843124581 CKBRIGIXVKUTMI-UHFFFAOYSA-N 261.413 2.454 10 10 CECE CC[C@H](N[C@@H]1CCc2nnn(C)c2C1)c1ccccc1O 927144814 JKLLZLZNBDICAE-YPMHNXCESA-N 286.379 2.119 10 10 CECE Cc1cc(O)c(CNCC(F)(F)CN)c(Cl)c1 841060395 XYFPFSSZKMVJQT-UHFFFAOYSA-N 264.703 2.038 10 10 CECE O=C(NCc1c(O)cccc1F)NCC1CC=CC1 923403844 SMWHQSVPPTXBBE-UHFFFAOYSA-N 264.300 2.297 10 10 CECE C[C@@H](N[C@H]1CCNC1=O)c1cc(Cl)c(Cl)cc1O 850480684 COHKCKYSFWAXTF-LDWIPMOCSA-N 289.162 2.238 10 10 CECE O=C(O)C1(CNCc2cc(Cl)ccc2O)CCC1 854244686 PCOWZABCYHENHJ-UHFFFAOYSA-N 269.728 2.390 10 10 CECE CCN1CC[C@H](N(CC)C(=O)c2cc(O)cs2)C1 855485649 GIISTGOOQCKTMU-JTQLQIEISA-N 268.382 2.010 10 10 CECE CCOc1ccc(CN2CCCC[C@H]2CC(N)=O)c(O)c1 769147223 COCYFEUQYDLDKE-ZDUSSCGKSA-N 292.379 2.021 10 10 CECE NCCc1nc2cc(F)ccc2n1-c1ccc(N)cc1 75976102 GDZRVLKORPHKIA-UHFFFAOYSA-N 270.311 2.248 10 10 CECE N#Cc1cccc([C@H]2NCCc3c(O)ccc(O)c32)c1 83657841 HVXRXZAHADUECJ-MRXNPFEDSA-N 266.300 2.205 10 10 CECE CC[C@H]1CN(c2ccc(CN)cc2F)CCCO1 393978425 VJJSXDPSTPGVFD-LBPRGKRZSA-N 252.333 2.290 10 10 CECE C[C@@H](Oc1ccccc1)C(=O)NCc1ccc(N)cc1 704325934 RBRCVNJFGYVPSQ-GFCCVEGCSA-N 270.332 2.353 10 10 CECE CN[C@H]1CCN(Cc2cccs2)[C@H]1CN=[N+]=[N-] 712157991 INPLQWVKKBGBCE-QWRGUYRKSA-N 251.359 2.221 10 10 CECE Cc1cccc(CCNCc2ccc(O)cc2O)n1 689412000 UWFYJDRCHSNMPJ-UHFFFAOYSA-N 258.321 2.134 10 10 CECE C[C@H](N)c1ccc(N(CCO)C(C)(C)C)c(F)c1 689947021 OAWRLZZAYRYJIO-JTQLQIEISA-N 254.349 2.443 10 10 CECE CCOc1cccc(CNCc2n[nH]c(C)c2C)c1O 716440111 KREFTDHGJAVEMZ-UHFFFAOYSA-N 275.352 2.421 10 10 CECE Cc1ccc(O)c(CNCC[C@H](O)C(F)(F)F)c1 717344978 CWWGXDGVSZUDNQ-NSHDSACASA-N 263.259 2.104 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1CCC[C@H](N(C)C)C1 1149871912 LQAIRCHAPUEOOJ-HIFRSBDPSA-N 290.407 2.471 10 10 CECE CC[C@@H](O)c1ccc(N2CCS[C@@H](CCO)C2)cc1 720007593 RTNFLRSQTXGNOG-LSDHHAIUSA-N 281.421 2.434 10 10 CECE C[C@@H]1CCC[C@H](CN)N1Cc1ccc(N(C)C)cc1 70151021 KBFFTHOUQUZJAN-CZUORRHYSA-N 261.413 2.454 10 10 CECE CCOc1cccc(CN2CCO[C@H](C)CC2)c1O 720492029 AYIPTVIHCCBOQQ-GFCCVEGCSA-N 265.353 2.402 10 10 CECE CCNCc1ccc(N(C)C[C@@H]2CCN(C)C2)cc1 71190011 BWXQQPCRXRKOMI-OAHLLOKOSA-N 261.413 2.184 10 10 CECE CC1(C)[C@@H]2[C@@H](CCCN2CCc2ccc(N)cc2)[C@H]1O 693062940 TWBBNMQXYKJSRZ-OWCLPIDISA-N 274.408 2.293 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)C1C2CC3CC(C2)CC1C3 693905386 DIQCTHHWVALJCC-RPEQISJESA-N 278.356 2.412 10 10 CECE O=C(NCc1cc(O)ccc1O)c1ccc(Cl)nc1F 1153884348 CRBKAJUTAGBHLP-UHFFFAOYSA-N 296.685 2.215 10 10 CECE C[C@H](NC1CCC(C(N)=O)CC1)c1cc(F)ccc1O 94617547 DONOOOHXMMCRAC-BMQDGWLCSA-N 280.343 2.226 10 10 CECE C[C@H](Cc1ccnn1C)NCc1c(O)cccc1Cl 2117694907 AXPMOKCVUCKRAQ-SNVBAGLBSA-N 279.771 2.500 10 10 CECE OCc1ccc(N2CCO[C@H]3C[C@@H]32)c(C(F)(F)F)c1 2115220307 PSHNZBLERQDLIN-RYUDHWBXSA-N 273.254 2.175 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)C1CC(C2CC2)C1 2120275250 ZNJABWUIPMCONH-UHFFFAOYSA-N 258.365 2.458 10 10 CECE CO[C@@H]1COC[C@H]1N(C)c1ccc([C@@H](C)O)cc1Cl 2120753360 CCELWUVIDPACRJ-OWYVNGRQSA-N 285.771 2.243 10 10 CECE C[C@H](O)[C@@H]1CCCCN1c1ccc2c(c1)CC[C@@H]2O 2128317516 PPTFZSQUGTYULW-UVBJJODRSA-N 261.365 2.406 10 10 CECE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)c(F)c1 2122173336 MLUFMBDCQJQXKJ-ZFVXVEAMSA-N 265.328 2.229 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)cc1 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C[C@H]1CN[C@H](C2CC2)CN1Cc1ccc(N(C)C)cc1 2160480466 MNUAXZFOXUZSRB-GUYCJALGSA-N 273.424 2.325 10 10 CECE CCNCc1ccc(N2CCC[S@](=O)CC2)c(C)c1 321996847 FPNCGZMIWLCILG-IBGZPJMESA-N 280.437 2.063 10 10 CECE c1cc2c(cc1CN[C@H]1C[C@@H]3CNC[C@@H]3C1)CCCO2 2160557221 TXELMNCHOWYDLQ-ZSHCYNCHSA-N 272.392 2.099 10 10 CECE Cc1cccc(O)c1CN1CCCC[C@@H]2[C@H](C(=O)O)[C@H]21 2160785651 FIODBWFDQSUEOP-UGFHNGPFSA-N 275.348 2.386 10 10 CECE C[C@@H]1CC[C@@H](CCN(C)C(=O)Cc2ccc(N)cc2)O1 2161113160 KWHQCZKPNZGZCL-DOMZBBRYSA-N 276.380 2.227 10 10 CECE CNCc1ccc(N(C)C2(CO)CCSCC2)c(F)c1 2171181064 ABAUPFYGHZIFOI-UHFFFAOYSA-N 298.427 2.239 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@@H]3[C@@H](C)[C@H]3C)ccc21 2161554212 YDNWTAMLVIUJJU-VWFLFCASSA-N 273.380 2.237 10 10 CECE C[C@H]1CN(c2ccc([C@H](C)N)cc2Cl)C[C@@H](CCO)O1 2179381300 KADNKPWGBPBXIU-GMXVVIOVSA-N 298.814 2.336 10 10 CECE CNCc1ccc(N2CC[C@@H](N3CCC3)C2)cc1Cl 702255260 LYFWHWGMSODVRK-CQSZACIVSA-N 279.815 2.344 10 10 CECE Oc1c(CN2CC[C@H]3COC[C@@H]3C2)ccc(F)c1F 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BUZKBTRCRLENQI-JQWIXIFHSA-N 279.336 2.026 10 10 CECE CN(Cc1cccn1C)c1ccc(CO)cc1[N+](=O)[O-] 2170999453 TXAIDEIBWAGWHW-UHFFFAOYSA-N 275.308 2.062 10 10 CECE CN(Cc1cncc(C(=O)O)c1)Cc1ccccc1O 2192595112 ZRRJAAOBKOAKTK-UHFFFAOYSA-N 272.304 2.117 10 10 CECE C[C@@H](Nc1nncc2c1CCNC2)c1ccccc1O 2192623279 QWGZDIXOLNBLJD-SNVBAGLBSA-N 270.336 2.001 10 10 CECE CN(C(=O)c1cc(O)c(O)c(O)c1)[C@@H]1C[C@H]2CCC[C@H]21 2188910103 RJPUSMXALIUVRV-FBIMIBRVSA-N 277.320 2.064 10 10 CECE CC(C)C(=O)N1CCN(c2ccc([C@H](C)N)cc2)CC1 2182585506 WLLYAVVXHHJDRM-ZDUSSCGKSA-N 275.396 2.011 10 10 CECE Nc1ccc(CC[C@@H](O)c2ncc3ncsc3n2)cc1 2189186010 WNQPDIDQNTVWNR-GFCCVEGCSA-N 286.360 2.335 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1ccc2c(c1)CCNC2 2189295623 UDOKRULLSOUSNJ-UHFFFAOYSA-N 270.332 2.438 10 10 CECE NCc1cc(F)c(N2CCCC[C@@H]2CC(N)=O)cc1Cl 2183265755 ODQPBAUONIWJPK-SNVBAGLBSA-N 299.777 2.172 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H]2CCC(=O)NC2)cc1Cl 2183442382 FHMRUVBXXHSGEE-JQWIXIFHSA-N 295.814 2.335 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)[C@@]1(C)COCCO1 2199254623 MVCYQQWAKXMBII-JKSUJKDBSA-N 278.396 2.209 10 10 CECE CNCc1cc(F)c(N2C[C@H](CO)CC2(C)C)c(F)c1 2184281990 RSOGOLRBERWFJX-LLVKDONJSA-N 284.350 2.281 10 10 CECE O[C@@H]1CCN(c2ccc(CNC3CC3)cc2)[C@@H]2CC[C@H]12 2190250294 RKNXGGXZIGZIED-GVDBMIGSSA-N 272.392 2.288 10 10 CECE CN(C)CC1CCN(c2ccc3c(c2)CC[C@H]3N)CC1 2184729061 FGHWIGBENOJBET-QGZVFWFLSA-N 273.424 2.411 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@]12CCOC[C@H]1C2 2194357543 VEGOUSGFHPFFDX-CZUORRHYSA-N 274.364 2.044 10 10 CECE O=C(CN1CC[C@H]2CCC[C@H]2C1)c1ccc(O)c(O)c1 2184826645 CGNSPGIOHDDSBD-YPMHNXCESA-N 275.348 2.403 10 10 CECE CC(C)[C@H](C)[C@@H](O)[C@@H](N)c1ccc(N(C)C)cc1 2044747992 KWOWAJPGFLNJHN-TUKIKUTGSA-N 250.386 2.405 10 10 CECE CC(F)(F)[C@H](NN)c1ccc(N2CCCC2)cc1 2044757034 TZLMHDXGEYLRAE-GFCCVEGCSA-N 255.312 2.446 10 10 CECE CCN1CCc2cc(N3C[C@@H]4CCC[C@]4(N)C3)ccc21 2198083030 KPBXFSYGHOFMSE-YOEHRIQHSA-N 271.408 2.387 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@@H](CO)[C@@H](F)C2)c(F)c1 2194694963 PUHNIOHQCKCLBU-DVYJOKAKSA-N 288.313 2.012 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)Cc2cnccn2)c(F)c1 2194690619 OOJMVJVCEQIDPG-SECBINFHSA-N 278.306 2.411 10 10 CECE C[C@H](N)c1ccc(N2CC[S@](=O)C[C@H]2C)cc1Cl 2051911196 LAGQLHKRIRTRAY-JJQCHNSYSA-N 286.828 2.317 10 10 CECE CC[C@@H](N)CN(C)Cc1cc(Cl)cc(OC)c1O 2053083023 NZEFJDMWPLOYQM-LLVKDONJSA-N 272.776 2.223 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)c2ccc(Cl)o2)CC1 2054031531 PEWSNNMINGTVRS-UHFFFAOYSA-N 290.732 2.302 10 10 CECE COc1cccc(O)c1CN(C)[C@]1(C)CCOC1 2055448260 KTXLKDYNZVVHCL-CQSZACIVSA-N 251.326 2.012 10 10 CECE O[C@H]1CCc2cc(N3CCC[C@]4(CC[C@H]4O)C3)ccc21 2186088546 DZKMTKMOKIJTFO-BBWFWOEESA-N 273.376 2.408 10 10 CECE CC1CCN(CCN2CCC[C@H]2CN=[N+]=[N-])CC1 2059056834 AQNNBUOLZOGUBK-ZDUSSCGKSA-N 251.378 2.493 10 10 CECE CC[C@@H]1CC[C@H]1N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 2105654997 XQRASGPINIXCNI-OWYVNGRQSA-N 260.337 2.297 10 10 CECE OCc1cc(F)c(N2C[C@@H](F)C[C@H](F)C2)c(F)c1 2062391263 FRRCTTOFVOBCJM-IUCAKERBSA-N 263.234 2.343 10 10 CECE COc1ccc(N(C)CCCCCCN)c(N)c1 2071851470 RTRIMJGPQQFFRW-UHFFFAOYSA-N 251.374 2.233 10 10 CECE COC(=O)CC(C)(C)N[C@H](C)c1ccccc1O 2072479180 GFGAPKFZKOINCQ-SNVBAGLBSA-N 251.326 2.385 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@H]2[C@@H](C)O)c(F)c1 2073332495 VVZDTQWDZSSVJN-BREBYQMCSA-N 253.317 2.229 10 10 CECE C[C@H](O)CCN(C)c1c(F)cc([C@@H](C)O)cc1F 2074078914 SVWGWWSLSXPLPJ-DTWKUNHWSA-N 259.296 2.225 10 10 CECE CCOC1CN(c2c(F)cc([C@H](C)N)cc2F)C1 2074208336 LDRYNAMPFAVZOT-QMMMGPOBSA-N 256.296 2.210 10 10 CECE Cc1cccc(O)c1CNCCN1CCP(C)(=O)CC1 2199637602 SWPHNQMDMYFNRL-UHFFFAOYSA-N 296.351 2.099 10 10 CECE CC1(C)[C@H](O)CCCN1c1ccc(CN)c(F)c1 2076222517 HWDPNHNXPJKBFU-CYBMUJFWSA-N 252.333 2.024 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H]1C[C@H]1C1CC1 2199907203 UCBHZLCMJRMDHK-MWDXBVQZSA-N 274.408 2.420 10 10 CECE COC[C@](C)(CN(C)c1ccc(OC)cc1)OC 2077559417 YDDFJHOVZYWTAY-AWEZNQCLSA-N 253.342 2.183 10 10 CECE CC12CC(C(=O)N3CCC[C@@H](CN=[N+]=[N-])C3)(CO1)C2 2100448543 VFQKEFQXMIKQLN-PKSQDBQZSA-N 264.329 2.104 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3CCN(C)[C@@H]3C2)cc1 2102331157 TWMKCOCMUDSQDA-DUVNUKRYSA-N 260.381 2.270 10 10 CECE CN(c1ccc(CN)cc1)[C@H]1CCCC(F)(F)[C@@H]1O 2103849244 QIDUOHABPIGGSQ-QWHCGFSZSA-N 270.323 2.130 10 10 CECE CNCc1ccc(N2CCC23CC(CO)C3)cc1C 2104540229 JEQNJKIYGNYOJJ-UHFFFAOYSA-N 260.381 2.066 10 10 CECE CCNCc1ccc(N(C2CC2)C2COC2)cc1C 2105065802 WNAZXALEBJCNIG-UHFFFAOYSA-N 260.381 2.472 10 10 CECE CN(C)[C@H]1CN(c2ccc(CO)cc2F)C(C)(C)C1 2105447054 NKDBSPPMUOOJLQ-GFCCVEGCSA-N 266.360 2.237 10 10 CECE C[C@H]1CC[C@@H]1N(C)C(=O)CCOc1ccc(N)cc1 2105662710 SPBBXYVZRXQHEM-FZMZJTMJSA-N 262.353 2.295 10 10 CECE CCO[C@H]1CCCC[C@]1(NCCCN=[N+]=[N-])C(=O)O 2105806531 LUGZUQKPJFPQKX-CMPLNLGQSA-N 270.333 2.079 10 10 CECE CN1CCc2cc([C@H](O)CC3(N)CCCC3)ccc21 2106797411 AKNBRAQRHQYFRC-OAHLLOKOSA-N 260.381 2.374 10 10 CECE CN1CCc2cc([C@]3(O)C[C@H]4OCCC[C@@H]43)ccc21 2106796861 VPBTWXKKIAFRBX-NUEKZKHPSA-N 259.349 2.065 10 10 CECE CNCC[C@](C)(O)c1ccc(N2CCCCC2)cc1 2106833774 NOEMMEQRQHZCII-INIZCTEOSA-N 262.397 2.494 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)c3ccsc3)ccc21 2106861096 XCEGUXJODXEPIH-GJZGRUSLSA-N 274.389 2.474 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)C[C@@H]2OCC[C@H]21 2106831793 UGSIGOKYLAHGNF-PMPSAXMXSA-N 259.349 2.283 10 10 CECE Cc1ocnc1[C@@H](N)c1ccc2c(c1)CCCN2C 2106829403 WORMMGCEYLZIIP-AWEZNQCLSA-N 257.337 2.414 10 10 CECE C[C@H]1C([C@@H](NN)c2ccc3c(c2)CCCN3C)[C@@H]1C 2106861373 IRWSDORZNHQIEQ-UVWXRNBGSA-N 259.397 2.475 10 10 CECE C[C@@H]1C[C@@]1(CN)[C@@H](O)c1ccc(N2CCCC2)cc1 2106826081 PZSKDANVGOKDGJ-KCXAZCMYSA-N 260.381 2.305 10 10 CECE Cc1occc1[C@H](O)[C@@H](N)c1ccc(N(C)C)cc1 2106852226 CRDLHCFONPOJAF-GJZGRUSLSA-N 260.337 2.387 10 10 CECE C[C@](O)(c1ccc(N2CCCCC2)cc1)C1CNC1 2106827577 FBVTYTBRPGSDAN-INIZCTEOSA-N 260.381 2.104 10 10 CECE CC[C@@]1(N)CCCN(Cc2cc(F)cc(F)c2O)C1 2087766705 RQNDKNYGOBICDI-CQSZACIVSA-N 270.323 2.374 10 10 CECE C[C@H](N[C@@H]1COC[C@@H]1C1CC1)c1cc(O)ccc1O 2088403933 VCCNTXRKGOWRPH-CUOATXAZSA-N 263.337 2.173 10 10 CECE Nc1cc2c(cc1N1CC[C@@H]1C1CCC1)OCCO2 2088651330 GYUIKJWMBNFXBO-GFCCVEGCSA-N 260.337 2.419 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1CC[C@@H]2C[C@H]21 2109226873 AYFCYCLEKKOMPB-BPLDGKMQSA-N 258.365 2.458 10 10 CECE C[C@@H](N)c1ccc(N2CCCNC(=O)CC2)cc1Cl 2089103983 OJDRMQYIDBQPAI-SNVBAGLBSA-N 281.787 2.076 10 10 CECE CC(C)CNCc1ccc(N(C)C2CN(C)C2)cc1 2089245119 KVICQDHLJVHZJY-UHFFFAOYSA-N 261.413 2.182 10 10 CECE Cc1cc(NS(=O)(=O)c2ccn(C)c2)c(C)cc1O 2089615456 LZLYZNUWXBHQHT-UHFFFAOYSA-N 280.349 2.148 10 10 CECE COc1ccc([C@@H](C)NC[C@H](CO)C2CC2)c(O)c1 2089970861 OBLQWCHDOFENEF-ZYHUDNBSSA-N 265.353 2.070 10 10 CECE Cc1ccc([C@H](N)[C@H](O)c2ccc(N(C)C)cc2)o1 2110796231 BLXTXZMJJIFFPZ-LSDHHAIUSA-N 260.337 2.387 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3[C@H](C2)[C@@H]3CO)cc1Cl 2093096736 AYCLKIDGMNOBEZ-NZPIUUIZSA-N 280.799 2.424 10 10 CECE CCOc1cccc(CN[C@H](CO)C2(C)CC2)c1O 2094127563 RQDMDVAMOXNKFN-CYBMUJFWSA-N 265.353 2.042 10 10 CECE CCc1cnn(CC)c1C(=O)Cc1ccc(N)cc1 2094504483 XGBNXMWSNJGNBA-UHFFFAOYSA-N 257.337 2.473 10 10 CECE COCc1nnc(SCCOc2ccc(N)cc2)s1 2095242480 BTWYGESJCFGQFI-UHFFFAOYSA-N 297.405 2.438 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CC(CC(F)(F)F)C1 2095986948 WFSNLMIIVSKPKC-UHFFFAOYSA-N 275.226 2.122 10 10 CECE Cc1cc(N(C)[C@H]2COCC[C@H]2C)ccc1CCN 2096254628 CVVAHGPEINSVEM-WBMJQRKESA-N 262.397 2.357 10 10 CECE Nc1ccc(CCN2CCOC3(CCCC3)C2)cc1 2096405404 ZLZQGAICOTUIRW-UHFFFAOYSA-N 260.381 2.456 10 10 CECE CNCc1ccc(N(C[C@@H]2CCOC2)C2CC2)cc1 2113737355 XDONHYBOIIMENI-AWEZNQCLSA-N 260.381 2.411 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@H]2CN1c1ccc(OC)c(F)c1F 2201642160 MJFISVXIHUWPNQ-HBNTYKKESA-N 282.334 2.408 10 10 CECE C[C@H]1CCc2nc(-c3ccc(O)c(O)c3)nc(O)c2C1 2203301633 HUAUQLLANRHQOI-QMMMGPOBSA-N 272.304 2.385 10 10 CECE COc1cc(N2CCC3(CCCO3)CC2)ccc1CN 2204560043 XTYBNDVGPUZHKN-UHFFFAOYSA-N 276.380 2.303 10 10 CECE CNCc1ccc(N2CC[C@H](CO)C[C@H]2C)cc1OC 2204540510 ZDYAGKLVJXVDBZ-OLZOCXBDSA-N 278.396 2.012 10 10 CECE COc1cc(N2C[C@@H](O)[C@H](C)C2)ccc1CNC(C)C 2204554076 LEEPQKOLFROMBV-IUODEOHRSA-N 278.396 2.010 10 10 CECE COc1ccc(N2C[C@H](O)C23CCC3)cc1Cl 2214335838 XKINJWJVESSMSV-LBPRGKRZSA-N 253.729 2.452 10 10 CECE Cc1cccc(CNc2nccc(N)c2[N+](=O)[O-])c1O 2204630048 RLQLVTGMCXKTJA-UHFFFAOYSA-N 274.280 2.198 10 10 CECE Cc1cccc(CNC(=O)C[C@H]2C[C@H](N)C2(C)C)c1O 2204621159 MBXCRPAZJMZGMQ-OLZOCXBDSA-N 276.380 2.080 10 10 CECE CCn1nc(C)cc1C(=O)NCc1cccc(C)c1O 2204620647 BWDREMGVAQXPQJ-UHFFFAOYSA-N 273.336 2.155 10 10 CECE CN(CCCC(=O)N1CCCC1)Cc1ccccc1O 2206235611 WKPRNTLFUZAJKL-UHFFFAOYSA-N 276.380 2.227 10 10 CECE CSc1ncc(CNCCCO[C@H]2CCOC2)s1 2208615535 BAYLGZFKJDZWGQ-JTQLQIEISA-N 288.438 2.150 10 10 CECE C[C@@H]1COCC[C@@H]1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2218740855 AMQCRGUCTVOLMI-RCWTZXSCSA-N 252.318 2.007 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H](O)C3)cc1F 2219617632 SCASGBQUWVCYRR-IAZYJMLFSA-N 251.301 2.326 10 10 CECE COc1ccc(N2CC[C@@H](CO)C23CC3)cc1F 2219606851 DNIXEJLIWQCZOG-JTQLQIEISA-N 251.301 2.186 10 10 CECE CN(c1ccc(CO)cc1[N+](=O)[O-])C1C[C@@H]2C[C@H]2C1 2230276875 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2.243 10 10 CECE COc1ccc(/C=C\C(=O)NCc2c(O)cccc2O)cc1 1647290263 QJRUGWDJLQNUEQ-YFHOEESVSA-N 299.326 2.436 10 10 CECE CON(Cc1ccc(C)o1)C(=O)Cc1ccc(O)c(O)c1 1644994339 SKIJPPYNIZLEDM-UHFFFAOYSA-N 291.303 2.132 10 10 CECE CCN(C)C[C@H](C)NCc1ccc2c(c1)CCCO2 231860125 MYVSQKUIXKXJNV-ZDUSSCGKSA-N 262.397 2.441 10 10 CECE COc1cc(N(C)Cc2cc(C)no2)ccc1CO 2139688265 QMQLUPOPOZHRMR-UHFFFAOYSA-N 262.309 2.120 10 10 CECE CCCN(Cc1ccc(OC)cc1O)C[C@H]1CCCN1 233113391 UNTOZRCINKDJJR-CQSZACIVSA-N 278.396 2.365 10 10 CECE Oc1ccc(CNC[C@H]2CCC3(CC3)CO2)cc1O 2140299546 AUDZBZNHBLBFNO-GFCCVEGCSA-N 263.337 2.147 10 10 CECE Nc1cc(S(=O)(=O)Nc2ccc(O)cc2)ccc1Cl 1876532506 BWVHYWYKUSLCEO-UHFFFAOYSA-N 298.751 2.429 10 10 CECE CCNCc1ccc(N2C[C@H](OC)[C@@H](OC)C2)cc1Cl 233548894 MMLHJLDEEZKJFS-GJZGRUSLSA-N 298.814 2.300 10 10 CECE CNCc1ccc(N2[C@@H](CO)CCC2(C)C)c(F)c1 2140774619 NIYKGZINBGMJPA-GFCCVEGCSA-N 266.360 2.285 10 10 CECE Cc1cc2c(cc1N(C)CC(C)(C)CO)OCCO2 258967240 YOCSQSJIZUJYAG-UHFFFAOYSA-N 265.353 2.221 10 10 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AXYPQSYAHXSMSG-DOFRTFSJSA-N 288.298 2.253 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(C3CC3)C3CC3)ccc21 2161343322 OTJFPAYLTNKIRZ-HNNXBMFYSA-N 271.364 2.421 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H]3C[C@@]3(O)C2)cc1O 2171030418 ZANJKHVGWVCQLT-BFQNTYOBSA-N 276.380 2.024 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CCOC(C)(C)C1 2161702483 MGCCQNWAZSBXHL-GHMZBOCLSA-N 284.360 2.023 10 10 CECE CN(C)CC[C@@H]1CCCN1c1ccc(CO)cc1F 701491768 PCVDGYLCYGIVCS-ZDUSSCGKSA-N 266.360 2.239 10 10 CECE CN1CCc2cc([C@H](N)C3(O)CC(C4CC4)C3)ccc21 2176793963 NOSJPFVAFOITEC-WIHSUSGWSA-N 272.392 2.230 10 10 CECE CCOc1cccc(CN(C)[C@@H]2COC[C@H]2C)c1O 688181153 YODBYZWXRJTXAG-DGCLKSJQSA-N 265.353 2.258 10 10 CECE CC(C)[C@@]1(O)CCCN(c2ccc(CN)c(F)c2)C1 710221520 SYMGKLCFUXQSQC-OAHLLOKOSA-N 266.360 2.272 10 10 CECE CCN1CC[C@@H](N(C)c2ccc(C[C@@H](C)N)c(C)c2)C1 689166891 ITISSCURIBDBHC-RHSMWYFYSA-N 275.440 2.415 10 10 CECE COc1ccc(O)c(CN2CCC[C@H]2CCC(=O)O)c1 380761321 OHGCFSJHLIHRRT-LBPRGKRZSA-N 279.336 2.230 10 10 CECE Cn1ncc(NCc2ccc(O)c(O)c2)c1Br 694090180 GPACLCMUGCZVQR-UHFFFAOYSA-N 298.140 2.206 10 10 CECE CNCc1ccc(N2CC[C@@]3(CCN(C)C3)C2)c(C)c1 383413396 KWQYWIXRGLMGAZ-QGZVFWFLSA-N 273.424 2.246 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(O)(CC)C2)cc1O 384094219 CSRYEWFJIWSAEY-NSHDSACASA-N 264.369 2.024 10 10 CECE COCC1(O)CN(c2ccc(CNC(C)C)cc2Cl)C1 384188981 YOIMHNVBKUAUNK-UHFFFAOYSA-N 298.814 2.036 10 10 CECE C[C@@H]1NCCC[C@H]1C(=O)N(C)[C@H](C)c1ccccc1O 384390993 NKKSNUBIXFRPSF-YNEHKIRRSA-N 276.380 2.300 10 10 CECE Nc1cc2c(cc1N1C[C@H]3CC=CC[C@@H]3C1)OCCO2 384618811 INCRMZLGPJVFEN-VXGBXAGGSA-N 272.348 2.442 10 10 CECE CC1=C(C)CN(CC(=O)Nc2ccc(N)cc2)CC1 384749633 DXUMPZDSSXMMGK-UHFFFAOYSA-N 259.353 2.249 10 10 CECE C[C@H]1CNCCN([C@@H](C)c2cc(F)ccc2O)C1 385299976 LHTOZCSYUSWQMO-QWRGUYRKSA-N 252.333 2.134 10 10 CECE C[C@H]1CCSCCN1C(=O)CCOc1ccc(N)cc1 385318430 AFFGVVJVWFXGCG-LBPRGKRZSA-N 294.420 2.392 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3O2)c(F)c1 718155328 NFAKEKDCWXTADH-QGANALPKSA-N 276.355 2.459 10 10 CECE C[C@@H](NCc1cccc(O)c1O)[C@H]1C[C@H]2CC[C@H]1O2 387391568 KFEKDWXMURGKLS-XIDUGBJDSA-N 263.337 2.143 10 10 CECE CCNCc1cc(F)c(N2C[C@H](O)C(C)(C)C2)c(F)c1 388165620 UTTNUUZMWDUOFD-ZDUSSCGKSA-N 284.350 2.281 10 10 CECE CC[C@H]1[C@@H](CO)CCN1c1ccc(CNC)c(C)c1 395236356 PNHUVOTZYZSAAF-ZBFHGGJFSA-N 262.397 2.312 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H]1COC(C)(C)C1 396540188 OKBLLJRDMTYLCO-LBPRGKRZSA-N 252.333 2.288 10 10 CECE Cc1cc([C@H](N)c2ccc3c(c2)CCN3C)nc(C)n1 2177315184 OXNPORZCJSBQDU-MRXNPFEDSA-N 268.364 2.134 10 10 CECE O=C(N[C@@H]1CCCCC1(F)F)c1ccc(O)c(O)c1 398374385 KTPRRXIUWNEZNY-LLVKDONJSA-N 271.263 2.406 10 10 CECE C[C@H](N[C@@H](C(=O)O)C1CCC1)c1cc(O)ccc1O 399113852 COWRSYDQCHKQNT-ISVAXAHUSA-N 265.309 2.002 10 10 CECE COc1cc(CN2CCC[C@@H]2CN=[N+]=[N-])cc(OC)n1 2179614772 ZCFHLCJHPCHERU-LLVKDONJSA-N 277.328 2.374 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)c1nccc(C)n1 2174419569 MSXMMUKAADIGSF-HNNXBMFYSA-N 268.364 2.086 10 10 CECE CNCc1ccnn1Cc1ccc(Br)cc1O 2069862823 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CC[C@H](O)c1ccc(N(CC)[C@@H](C)CS(C)(=O)=O)cc1 2170419840 IZOJKGUEGIDJAC-WFASDCNBSA-N 299.436 2.389 10 10 CECE Cc1cc(N(C)C[C@H]2[C@H]3OCCC[C@H]23)ccc1CCN 2176443726 HNFCRXPBTQNMRD-ZACQAIPSSA-N 274.408 2.357 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@H](C(=N)NO)C1CC1 2192599696 DLGVODQBJVTUCL-MFKMUULPSA-N 277.368 2.367 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC[C@H]2C[C@]1(C(=O)O)C2 2192560251 HNFGLDKWUWEMEQ-AMJWSMQMSA-N 277.320 2.098 10 10 CECE C[C@@H](NC(=O)[C@@H]1CCNC(C)(C)C1)c1ccccc1O 2192632319 RYHLMSJYVRSHST-VXGBXAGGSA-N 276.380 2.348 10 10 CECE C[C@@H](NC(=O)C[C@H]1N[C@H]2CC[C@H]1C2)c1ccccc1O 2192628437 YMPCURSZCSKCKK-OWTLIXCDSA-N 274.364 2.100 10 10 CECE Cc1ccc(O)c(CN(C)[C@@H]2CCCC(=O)N(C)C2)c1 2188460457 QVMWCIOKFWLGJP-CQSZACIVSA-N 276.380 2.143 10 10 CECE O=[N+]([O-])c1cc(N2CC[C@H]3[C@H](C2)C3(F)F)ccc1CO 2188575270 GPIAJJJLEVAYSO-QWRGUYRKSA-N 284.262 2.179 10 10 CECE C[C@H](N[C@H]1C[C@@H](n2cccn2)C1)c1c(O)cccc1O 2184165520 XCVNFUHQNZAOHI-SDDRHHMPSA-N 273.336 2.349 10 10 CECE CN(C)C1[C@@H]2CN(c3ccc4c(c3)CCC[C@H]4N)C[C@@H]12 2184686197 FINBMKCWKPUGGU-BZUAXINKSA-N 271.408 2.019 10 10 CECE CCN(c1ccc(OC)cc1F)[C@@H]1CCCNC1 2044277863 CHFWCHJULCEHIV-LLVKDONJSA-N 252.333 2.413 10 10 CECE CC(C)[C@@H]1CN(C)CCN1c1ccc2c(c1)CC[C@@H]2N 2184736153 POZDVAQBAAOSJD-IRXDYDNUSA-N 273.424 2.409 10 10 CECE OC[C@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)CC[C@H]2O 2184735920 MOKKKKAHXNGFRD-MBMVNNNZSA-N 273.376 2.406 10 10 CECE N[C@H]1CCc2cc(N3[C@H](CO)C[C@H]4CCC[C@H]43)ccc21 2184736905 ZKWCAFPBBIJAQU-NQZOLGFYSA-N 272.392 2.372 10 10 CECE CN1CCC[C@H]2[C@H]1CCN2c1ccc2c(c1)CC[C@H]2O 2184734224 QGOVSAKUXLAGMN-IXDOHACOSA-N 272.392 2.339 10 10 CECE CN[C@@H]1CCc2cc(N(C)Cc3ccnn3C)ccc21 2184718778 IXJOQOPKPBGQIK-MRXNPFEDSA-N 270.380 2.263 10 10 CECE Oc1ccc(CNC[C@H]2C[C@H](n3ccnc3)C2)c(O)c1 2184874045 WRWOBTFDBCNLKA-AULYBMBSSA-N 273.336 2.035 10 10 CECE CC[C@@H](COC)N(C)c1ccc([C@@H](C)N)c(O)c1 2047308635 NCIHKOLXUWOHFB-MNOVXSKESA-N 252.358 2.273 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)C1[C@@H]2CCCCC[C@@H]12 2048533081 CKBHYJBRXFONGU-KKZNHRDASA-N 252.318 2.166 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@@]3(O)C2)cc1Cl 2051364735 ALMUYRQPVXOJFJ-GPCCPHFNSA-N 267.756 2.354 10 10 CECE CC[C@H](NC(=O)c1ccc(O)c(O)c1)C(F)(F)F 2053722280 GPLJNKCXDLCKHW-VIFPVBQESA-N 263.215 2.169 10 10 CECE CC1(F)CC(CNC(=O)CCOc2ccc(N)cc2)C1 2185655692 NSEKJOCYJDNWRT-UHFFFAOYSA-N 280.343 2.292 10 10 CECE C[C@H](O)c1cc(F)c(N(C)Cc2cnn(C)c2)c(F)c1 2194512714 MWKNISKOPPNANS-VIFPVBQESA-N 281.306 2.388 10 10 CECE Nc1ccc(OCC(=O)OC[C@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 2191054003 UEXBIIMOARAENJ-ODNXTNNQSA-N 273.332 2.093 10 10 CECE C[C@H](N)Cc1cnc(Sc2ncc3n2CCC3)s1 2056819982 YVEIIBUSPHRKKV-QMMMGPOBSA-N 280.422 2.327 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC(C)(C)OC[C@H]1CN 2194637553 NJLLDSMURRNPCT-CMPLNLGQSA-N 282.359 2.030 10 10 CECE CN(c1ccc(CN)c(Cl)c1)[C@H](CCO)C(F)F 2058227757 ZLQPVVVTZVEMCG-LLVKDONJSA-N 278.730 2.251 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2C(F)(F)C23CC3)cc1 2062059645 SCYGBQPUVPKBBK-VIFPVBQESA-N 253.252 2.188 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)CCC(F)(F)F)C1 2065642408 UVFBJQWBPKKVJG-SSDOTTSWSA-N 286.279 2.043 10 10 CECE COc1ccc(N(CCCN)C(CF)CF)cc1 2066471986 OHEFIEKETRPIFW-UHFFFAOYSA-N 258.312 2.158 10 10 CECE CCC[C@@H](N[C@@H](CC)c1ccccc1O)C(N)=O 2066437634 XFZSYUYINYATIY-NWDGAFQWSA-N 250.342 2.087 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)[C@@H]2C2CC2)cc1C 2187157803 WFJCUKWBAKIAHA-SJORKVTESA-N 274.408 2.454 10 10 CECE CO[C@H]1C[C@H](CF)N(c2ccc([C@@H](C)N)cc2)C1 2069977701 TVCFZWZVSNYYID-HONMWMINSA-N 252.333 2.270 10 10 CECE Cc1ccnnc1CNCc1ccc(Cl)cc1O 2072625133 LCOGTOKRIZTCNW-UHFFFAOYSA-N 263.728 2.434 10 10 CECE CCCNCc1ccc(N2C[C@H]3C[C@H]2CN3C)cc1C 2187592846 UBZUYFYGTWJALC-SJORKVTESA-N 273.424 2.387 10 10 CECE C[C@H](O)c1cc(F)c(N(C)[C@H](C)CCO)c(F)c1 2074084880 XMPCAAJKQXLVLI-BDAKNGLRSA-N 259.296 2.225 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]3[C@@H]2CO)ccc1CNC(C)C 2198990093 AJGLUSPZLKALGG-UAGQMJEPSA-N 274.408 2.310 10 10 CECE NCC1CC(Oc2ccc(N)cc2)(C(F)(F)F)C1 2078232852 HGKWURPHKJEOQT-UHFFFAOYSA-N 260.259 2.317 10 10 CECE COC1CC2(C1)CC(C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C2 2100385007 KPMABIXQBRXRJW-AQICRGNOSA-N 264.329 2.103 10 10 CECE COCCO[C@@H]1CCN(c2ccc(CN)cc2Cl)C1 2102461755 RSTUEHXTHUKVFS-GFCCVEGCSA-N 284.787 2.040 10 10 CECE CCCN1CC[C@@H](N(C)c2ccc(CN)cc2F)C1 2103803400 KFVVCHOXXLKBII-CYBMUJFWSA-N 265.376 2.205 10 10 CECE C[C@@H](CNCc1ccc(F)cc1O)N1CCCC1 2084168677 PIIMWXMUCYSUFO-NSHDSACASA-N 252.333 2.105 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1CC[C@]12CCCO2 2104364732 FWPVRTATTFBASS-SMDDNHRTSA-N 262.309 2.091 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CCCC[C@@H]1O 2104440951 YTPVLARYHWMHGZ-AAEUAGOBSA-N 265.353 2.042 10 10 CECE COc1cnccc1[C@H](N)c1ccc(N(C)C)cc1 2106794276 VQPKUTZSLJSRKY-OAHLLOKOSA-N 257.337 2.204 10 10 CECE CCC[C@H](C)[C@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2106848839 NLLPSOFJOOPMRO-XZJROXQQSA-N 262.397 2.476 10 10 CECE CCN(CC)c1ccc([C@@]2(O)CCNC[C@@H]2C)cc1 2106819904 DVMJISWDILGOHW-XJKSGUPXSA-N 262.397 2.350 10 10 CECE CC(C)OC(C)(C)[C@@H](NN)c1ccc(N(C)C)cc1 2106855442 OISTUVMXSCJZGI-AWEZNQCLSA-N 265.401 2.461 10 10 CECE CN1CCc2cc([C@H](NN)C3(C4CC4)CC3)ccc21 2106862727 YCSHLIUCAPMKPL-HNNXBMFYSA-N 257.381 2.374 10 10 CECE CCN1CCc2cc([C@]3(O)CCCC[C@H]3N)ccc21 2106804842 GPUVRTOUEKZTDB-HZPDHXFCSA-N 260.381 2.158 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2CNCC23CCC3)cc1 2106804990 IIALCRXOEGNGKI-CABCVRRESA-N 260.381 2.176 10 10 CECE CN(C)c1ccc([C@]2(O)COC[C@@H]2CC2CC2)cc1 2106806077 UBNOJMBPLDLNGN-GOEBONIOSA-N 261.365 2.387 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2C[C@@H]3CNC[C@@H]3C2)cc1 2106806192 UVWMOKLPXOINFI-AYDFFVQHSA-N 260.381 2.032 10 10 CECE CCSC[C@@](C)(O)[C@H](N)c1ccc2c(c1)CCN2C 2106849661 YVTDJFSOMHBKOM-HUUCEWRRSA-N 280.437 2.183 10 10 CECE CCOC1CC([C@H](NN)c2ccc(N(C)C)cc2)C1 2106826370 SGZSOJDLULRUGM-PESDSKBTSA-N 263.385 2.072 10 10 CECE C[C@@](O)(c1ccc(N2CCCC2)cc1)[C@@H]1CCNC1 2106826994 YPJVWLMQLNNYPG-GDBMZVCRSA-N 260.381 2.104 10 10 CECE 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2151499401 MDVPKBCTWHLELR-IMSIIYSGSA-N 279.336 2.344 10 10 CECE COCc1nocc1CN[C@@H](C)c1cc(O)ccc1O 2152625503 PLXASRNXAJAMBK-VIFPVBQESA-N 278.308 2.083 10 10 CECE CC[C@]1(C)CN(C(=O)CCc2ccc(N)cc2)CCO1 2152674444 NRBSOXMSEQYUFX-MRXNPFEDSA-N 276.380 2.229 10 10 CECE C[C@H](O)c1ccc(N2CCOC[C@@H](C3CC3)C2)cc1O 2152889616 NXLINPLAVXFYTB-AAEUAGOBSA-N 277.364 2.308 10 10 CECE Cc1cc(N2CCOC[C@H](C3CC3)C2)ccc1CCN 2152887142 HDJYVBAXPYDZTO-MRXNPFEDSA-N 274.408 2.359 10 10 CECE C[C@H](O)[C@@H]1CCN1c1ccc([C@@H](C)N)cc1Br 2011144744 JDLMGYJDUNTSKB-PTRXPTGYSA-N 299.212 2.428 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CCC[C@@H](O)[C@H]2CC3)cc1O 2154107026 VUAAQXAUEMYMRV-BAESOJJISA-N 276.380 2.294 10 10 CECE CO[C@@H]1COC[C@H]1CN[C@H](C)c1ccc(N(C)C)cc1 2154131084 LESKYICRTSNTLM-XNRPHZJLSA-N 278.396 2.065 10 10 CECE CCN(CCOc1ccc(N)cc1)C[C@H]1CCCO1 48952687 OQZIPOPSCCXIDG-OAHLLOKOSA-N 264.369 2.149 10 10 CECE N[C@@H](c1ccccc1O)[C@@]1(O)CCCOC12CCCC2 2155118574 PNRSNQSYYDSPPV-HOCLYGCPSA-N 277.364 2.246 10 10 CECE CS[C@@H]1COC[C@H]1N[C@H](C)c1ccccc1O 2026366324 YRSKHFVFDXVCCD-IRUJWGPZSA-N 253.367 2.173 10 10 CECE Cc1cc(C(=O)NCCc2ccc(N)cc2)sn1 2028601419 WUSBYOBNFSNCRP-UHFFFAOYSA-N 261.350 2.006 10 10 CECE NN[C@@H](C[C@@H]1CCCOCC1)c1ccccc1O 2029556064 OSILCUIECWGTHF-YPMHNXCESA-N 250.342 2.103 10 10 CECE COCC[C@H](C)CN[C@H](C)c1cc(O)ccc1O 2029979079 ANJLEOQDNGIQDD-WDEREUQCSA-N 253.342 2.421 10 10 CECE Cc1nscc1NC(=O)COc1ccc(N)cc1 2032883894 SFKSTTVQNCNUDZ-UHFFFAOYSA-N 263.322 2.051 10 10 CECE COc1ccc(N(C)[C@@H]2CN[C@@]3(CCCOC3)C2)cc1 2156282647 YJFJENFHXHRNQH-HOCLYGCPSA-N 276.380 2.043 10 10 CECE COc1ccc(N2CC[C@@H](NC(C)C)C2)cc1OC 71197977 XYXQNWHMCAMVOU-GFCCVEGCSA-N 264.369 2.281 10 10 CECE Oc1ccc(F)cc1CN[C@H]1CC[C@H]2CC[C@H]1O2 401801028 NGKFJNAULRLKMP-SGMGOOAPSA-N 251.301 2.331 10 10 CECE CCN(CC)CC(C)(C)NCc1ccc(O)c(O)c1O 308616587 XWBISGRVHWDTHD-UHFFFAOYSA-N 282.384 2.013 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@H]2NCC[C@H]2C1 312110932 YYDOJKLNQABDGC-SUNKGSAMSA-N 264.344 2.276 10 10 CECE 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10 10 CECE OCC[C@H]1CSCCN1c1ccc2c(c1)CCC[C@@H]2O 2184682486 PBKADDFOKCQZNS-HOCLYGCPSA-N 293.432 2.361 10 10 CECE N[C@H]1CCc2cc(N3CC[C@H](N4CC=CC4)C3)ccc21 2184735063 BGPULAFQAZUVPV-RDJZCZTQSA-N 269.392 2.083 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@]23C[C@](C)(CO2)C3)cc1O 2194282114 VQHDYXASEYUQJF-KNXALSJPSA-N 276.380 2.417 10 10 CECE COc1ccc([C@H](C)NC[C@]23CCOC[C@@H]2C3)c(O)c1 2194437383 QIDWNVBJXIAVMU-MQIPJXDCSA-N 277.364 2.478 10 10 CECE CCOc1ccc(N(C)C[C@H](C)N)cc1OCC 2044260359 AZKWIMYFZUIRKM-NSHDSACASA-N 252.358 2.267 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H]3COC[C@H]3C2)c(F)c1 2194520678 VHQSPIROLMAEAZ-JBLDHEPKSA-N 283.318 2.491 10 10 CECE CN(Cc1cc(N)ccc1O)CC(F)(F)[C@@H]1CCOC1 2185369978 BMBMWAPIHPWUAC-LLVKDONJSA-N 286.322 2.078 10 10 CECE COc1ccc(O)c(CNC[C@H]2C[C@]23CCCOC3)c1 2198144707 CGJROVYOIZQQLW-CJNGLKHVSA-N 277.364 2.307 10 10 CECE C[C@H](N)c1cc(F)c(N(C)[C@H]2CN3CC[C@H]2C3)c(F)c1 2194706843 DKXCGVSRSUSMPX-BHDSKKPTSA-N 281.350 2.125 10 10 CECE 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2.386 10 10 CECE CC[C@H](NC)c1ccc(N(C)Cc2ncon2)cc1 2104162111 TZXWHINNGWJEET-ZDUSSCGKSA-N 260.341 2.377 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H]1CSCCN1C 2106793819 QUSKJDOWFYTTFU-GJZGRUSLSA-N 279.453 2.060 10 10 CECE CN1CCc2cc([C@H](O)CC3CC(CN)C3)ccc21 2106801242 MICWYZYEMWNSNY-ZEPSKSRBSA-N 260.381 2.087 10 10 CECE CN1CCCc2cc([C@](O)(CN)C(C)(C)C)ccc21 2106834990 ZIFIBYVIAGLTBE-MRXNPFEDSA-N 262.397 2.261 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCN3C)C[C@@H](C)[C@@H]1N 2106802028 RRVVOJVSXXJGIK-ATCWAGBWSA-N 259.397 2.098 10 10 CECE CC(C)[C@@](O)(CN)c1ccc(N2CCCCC2)cc1 2106830399 GJWWYGPEIBOBEN-INIZCTEOSA-N 262.397 2.479 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@]1(O)C[C@H](C)[C@H]1C 2106859153 GADZMASQGVUCIA-OJDYBEQGSA-N 262.397 2.420 10 10 CECE CCCNC[C@@](C)(O)c1ccc2c(c1)CCCN2C 2106832600 BODMVYYLGHAOMB-MRXNPFEDSA-N 262.397 2.276 10 10 CECE CN(C)c1ccc([C@H](O)[C@H](N)[C@H]2C[C@@H]3C[C@@H]3C2)cc1 2107676029 RQZPXUMNLGOAIZ-RHBQXOTJSA-N 260.381 2.159 10 10 CECE Oc1ccc(CNCC2(C(F)(F)F)CC2)c(O)c1O 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C[C@@H]1C[C@@H]2C[C@H]2C[C@H]1NC(=O)c1ccc(O)c(O)c1 2088190464 XTSPQKQDZBGCPV-KXGXSXBTSA-N 261.321 2.262 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N(CCN)CC(F)F 2089030838 QFPWADFJNYCUKN-NSHDSACASA-N 271.355 2.339 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)[C@@H]2CC3(CCC3)CO2)C1 2110149749 PPTGFJDYNXSYNM-MNOVXSKESA-N 264.329 2.104 10 10 CECE Cc1cc(CN)ccc1N(C)Cc1cc(Cl)n(C)n1 2110207865 DLCBCOMXAKBCJJ-UHFFFAOYSA-N 278.787 2.477 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(C[S@](C)=O)C2)cc1 2110347573 BDKJPXPDKOJFJL-BUXKBTBVSA-N 280.437 2.172 10 10 CECE COc1cc(CNc2ccc(N)cc2)cc(OC)n1 2110721714 UYEUXQGYBYPFDH-UHFFFAOYSA-N 259.309 2.293 10 10 CECE Nc1ccc(CCCN2[C@H]3CC[C@H]2CC(O)C3)cc1 2090608896 AVUDPNFMQYNHKU-GJZGRUSLSA-N 260.381 2.189 10 10 CECE O=C(O)[C@@]12CC[C@H]1CN(Cc1c(O)cccc1Cl)C2 2095030859 IBYZHNXOQVNNKH-LKFCYVNXSA-N 281.739 2.342 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H]4CC[C@@H]43)ccc21 2095444164 VLANBOIXWTXWNF-HERUPUMHSA-N 257.337 2.017 10 10 CECE CC1(C)CCO[C@H]1CCNCc1cccc(O)c1O 2098006805 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NN[C@@H](c1ccccc1O)c1occc1Br 1936973998 JIJJJRAXYLOMCT-JTQLQIEISA-N 283.125 2.300 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)[C@@H]1CCCNCC1 235189523 WKAZJQVNHHYAEQ-VXGBXAGGSA-N 264.369 2.233 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC[C@H]2C[C@@H]2C1 817549941 PVDZBSJKQMOXLM-YNEHKIRRSA-N 275.348 2.193 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCC[C@@H]2C[C@H]21 830530920 AQJSAJMMXUAGOA-JHJVBQTASA-N 275.348 2.193 10 10 CECE CCCCNC(=O)CCNCc1cccc(OCC)c1O 1857860338 ZPOZIOWQPLPBLP-UHFFFAOYSA-N 294.395 2.187 10 10 CECE Cc1ccc(O)c(CNCC(=O)Nc2ccccc2)c1 1857857843 PPBFQNMENUTTPK-UHFFFAOYSA-N 270.332 2.429 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H]2CO)c(Br)c1 1944103828 ZIXQCKULCJLILH-ONGXEEELSA-N 299.212 2.301 10 10 CECE CN(Cc1csnn1)c1ccc(CO)cc1Cl 1945144792 XODQBTZKMRLPID-UHFFFAOYSA-N 269.757 2.320 10 10 CECE Nc1cc(NCc2ccccc2O)ccc1[N+](=O)[O-] 236365821 SAYPKEWISGWZGN-UHFFFAOYSA-N 259.265 2.495 10 10 CECE CC[C@H](N)c1ccc(N2CCC[C@H]2C(=O)N(C)C)cc1 2143712616 JECNREIBWGRKOJ-GJZGRUSLSA-N 275.396 2.153 10 10 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O=C(N[C@H]1C(F)(F)C12CCCC2)c1ccc(O)c(O)c1 2153780417 PWQDDEPDSIWIHI-GFCCVEGCSA-N 283.274 2.406 10 10 CECE Cn1cc(Br)c(CN2CCC[C@@H]2CN=[N+]=[N-])n1 2009445813 RDRPBDIDSYTVFL-MRVPVSSYSA-N 299.176 2.457 10 10 CECE NCc1ccc(N2CCC=C[C@@H]2CO)cc1Br 2011253686 KYFBKGNGEKJFGR-GFCCVEGCSA-N 297.196 2.035 10 10 CECE Oc1ccc(Cl)cc1CNCC[C@H]1C[C@@H](O)C1 2017018561 HIKBBFVTJBHVRQ-WVSHTKLVSA-N 255.745 2.296 10 10 CECE C[C@@H]1SCCC[C@@H]1NCc1ccc(O)cc1O 2020609305 VFBSLPJLBUNAKM-CABZTGNLSA-N 253.367 2.472 10 10 CECE OCc1ccc(N2CC[C@H]3COC[C@H]32)c(Br)c1 2021413016 QFPBMSZCHOLCNI-GXFFZTMASA-N 298.180 2.167 10 10 CECE CC[C@@H](CNCc1cc(OC)ccc1O)COC 2027330830 DLRTZQRPDFWEKK-NSHDSACASA-N 253.342 2.163 10 10 CECE Oc1cc(Cl)ccc1CN1CC[C@@]2(CCNC2)C1 2029645245 GBBNHPYOBYJDQS-CQSZACIVSA-N 266.772 2.231 10 10 CECE CC[C@@H](c1ccccc1O)N(C)[C@H](C)CC(N)=O 2033938677 VXMROODUCZJNSY-PWSUYJOCSA-N 250.342 2.039 10 10 CECE CNCc1ccc(OC[C@@H](O)C(F)(F)F)c(C)c1 2037498859 IIBHCXGPNLQXKV-LLVKDONJSA-N 263.259 2.016 10 10 CECE 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2.367 10 10 CECE CN(C)c1ncc(CNCc2ccc(F)c(F)c2O)s1 2149562724 WIBKVTMVLFYZJE-UHFFFAOYSA-N 299.346 2.483 10 10 CECE CCC[C@@H](Nc1c(N)cccc1Br)C(N)=O 1987127183 BLDSRFSESMVSER-SECBINFHSA-N 286.173 2.097 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCNC[C@]1(C)C1CC1 2151091317 WURANEJIZDRIID-MEDUHNTESA-N 276.380 2.233 10 10 CECE C[C@H](Nc1ccc(S(C)(=O)=O)nc1)c1ccccc1O 36932076 QGKWQSKFGDALHI-JTQLQIEISA-N 292.360 2.364 10 10 CECE CC1=C[C@@H](C)CN(c2cc3c(cc2F)[C@H](O)C(=O)N3)C1 2152267897 JNZQMWSXOMDCHO-CLAHSXSESA-N 276.311 2.214 10 10 CECE Cc1ccc(CNC(=O)COc2ccc(N)cc2)cc1 38055386 NWRBCYWGCPJTOM-UHFFFAOYSA-N 270.332 2.272 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C1CCOCC1 38089705 APHSFCRIJIVRGC-LLVKDONJSA-N 263.337 2.338 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CCC[C@@H](F)C2)cc1 2152314187 CETCVIMICHXGAX-DGCLKSJQSA-N 280.343 2.435 10 10 CECE C[C@H](CNCc1ccc(Cl)cc1O)N1CCC1 1997052232 BUPXXIIDXCUROX-SNVBAGLBSA-N 254.761 2.229 10 10 CECE CNCc1ccc(N2CCC[C@@H](O)C2)c(C(F)(F)F)c1 163691225 DIHZNAVNJQINEN-LLVKDONJSA-N 288.313 2.386 10 10 CECE CC(C)NCc1ccc(N2CCN(C)C(=O)C2)c(Cl)c1 164111741 FNHUFADCRPJADH-UHFFFAOYSA-N 295.814 2.116 10 10 CECE CCNCc1cc(F)c(N2CC[C@H]3C[C@H]2CO3)c(F)c1 2153092594 MSCCFWWCWXHYGP-RYUDHWBXSA-N 282.334 2.442 10 10 CECE O=C(NCc1ccccc1O)C1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12 269158908 SWOZWMWFSYEUHV-NUZBWSBOSA-N 257.333 2.301 10 10 CECE CC(C)N(CCO)c1ccc(CN)cc1C(F)(F)F 166573555 AQLLOPSVTUSONA-UHFFFAOYSA-N 276.302 2.371 10 10 CECE CO[C@@H]1C[C@@H]2CC[C@H](C1)N2CCOc1ccc(N)cc1 2154900396 CXJALZKIIJAINZ-FOLVSLTJSA-N 276.380 2.289 10 10 CECE CC[C@@]1(C)OCCC[C@H]1NC(=O)Cc1ccc(N)cc1 2155090113 CHZFSZXRSVCAQZ-GDBMZVCRSA-N 276.380 2.275 10 10 CECE CC[C@]1(C)OCCC[C@@]1(O)[C@H](NC)c1ccccc1O 2155112212 YZQTZNCFDMPTKB-OWCLPIDISA-N 279.380 2.363 10 10 CECE CC(C)(O)[C@@H]1CCN1c1ccc(CN)cc1Cl 2016602572 KLGPHASZTRFQPE-LBPRGKRZSA-N 254.761 2.148 10 10 CECE COc1ccc(N(CCCN)CC2(CO)CCC2)cc1 2156402188 KPEZYGUXOZRVRQ-UHFFFAOYSA-N 278.396 2.013 10 10 CECE CCCCNC(=O)CNCc1ccc2c(c1)CCCO2 2160555930 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RFRACZYXSPIQGX-UHFFFAOYSA-N 280.736 2.446 10 10 CECE CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)N(C)C 2294311802 ALBPVHBMYNJXRS-UHFFFAOYSA-N 288.307 2.153 10 10 CECE C[C@@H](CCNCc1cc2c(cc1O)OCO2)OC(F)F 2290130255 NQYCPFGUTQJCAB-QMMMGPOBSA-N 289.278 2.228 10 10 CECE CN(C)c1ccc([C@H](N)C2(O)CC3(CC(F)C3)C2)cc1 2280420543 GYOYFCQSVRDOIC-FHXLJKASSA-N 278.371 2.396 10 10 CECE COC[C@@]1(C)C[C@@H]1CN(C)CCOc1ccc(N)cc1 2284635163 FYTYYRQNLPBCDH-CZUORRHYSA-N 278.396 2.252 10 10 CECE Cc1cc(N2CC[C@H]3OCCO[C@H]3C2)ccc1[C@@H](C)N 2285129646 JPTRWPYCVHTENA-WQVCFCJDSA-N 276.380 2.009 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H](C)CS(C)(=O)=O)cc1C 2285123802 IGIRXHFEADBXHC-CHWSQXEVSA-N 298.452 2.145 10 10 CECE Cc1cc(N2C[C@H](C(N)=O)CC[C@@H]2C)ccc1[C@H](C)N 2285146738 SQEAIOGFCJWGGS-RWMBFGLXSA-N 275.396 2.105 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H]2CC(N)=O)cc1C 2285717147 VEKHVXOEFFCFPY-OLZOCXBDSA-N 275.396 2.120 10 10 CECE CNCc1cc(OC)ccc1N(CC(C)C)C[C@@H](C)O 2288047456 HOMIPHGAARRORF-CYBMUJFWSA-N 280.412 2.258 10 10 CECE CN(C(=O)/C=C\c1cnccn1)c1ccc(F)cc1 491118464 LADWFQQPMLWRRH-DAXSKMNVSA-N 257.268 2.292 10 10 CECE CN(C)CCN(C(=O)/C=C\c1cnccn1)c1ccccc1 491280764 ZAPXRWICWRNHMY-HJWRWDBZSA-N 296.374 2.085 10 10 CECE Cc1cncc(C=CC(=O)N(C)c2cccnc2)c1 2302376738 PIESUSUNKIWVEW-UHFFFAOYSA-N 253.305 2.461 10 10 CECE Cc1ccc(CN[C@@H]2CNC[C@@H]2C)c(O)c1Br 2307568206 BZRIMTLEQLADPI-GXSJLCMTSA-N 299.212 2.161 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C=Cc1cccnc1 2308464809 VNFFLQLFPIEYIZ-GFCCVEGCSA-N 298.342 2.253 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1c1ccc(CN)c(F)c1 2315274722 YBIVVOLYKKQHLX-UONOGXRCSA-N 252.333 2.024 10 10 CECE CCN(CCO)c1ccc([C@H](C)NC)c(C)c1C 2318564089 SXCCMUZOACGDAV-ZDUSSCGKSA-N 250.386 2.402 10 10 CECE CSc1cc(N(C)[C@@H](C)C(C)(C)O)ccc1CN 2328547026 VUWDHUKJTCWCMF-JTQLQIEISA-N 268.426 2.463 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)cc1 2333105177 QQSCAAVFMOZKDT-HNKHHVNMSA-N 260.381 2.174 10 10 CECE CC(C)c1nnsc1CNCc1ccc(O)c(O)c1 2335725585 GJJXLYWIIZFFRU-UHFFFAOYSA-N 279.365 2.363 10 10 CECE CCCN(CCO)c1ccc(CNC)c(C2CC2)c1 2339142671 AVJQGLGAJMELIN-UHFFFAOYSA-N 262.397 2.492 10 10 CECE COc1ccc(O)c(CNC(C)(C)[C@H](O)C(C)C)c1 2340381026 LHHKEGYINPCQKQ-CQSZACIVSA-N 267.369 2.286 10 10 CECE C[C@@]1(CNCc2ccc3c(c2)CCO3)CCCCN1 2341309453 JHMJBTUWFGVCRD-INIZCTEOSA-N 260.381 2.243 10 10 CECE C[C@H]1C[C@H]2C[C@](CNCc3ccc(O)cc3O)(C2)O1 2342893028 KTSARFGWKOUQOY-ZIBATOQPSA-N 263.337 2.145 10 10 CECE CN(c1ccc2c(c1)C(C)(C)CO2)[C@@H]1CNC[C@H]1F 2343614853 VDBPEMSGIDLTEZ-CHWSQXEVSA-N 264.344 2.103 10 10 CECE Nc1ccc(CCN[C@H]2CCC[C@]34C[C@H](CO3)[C@H]24)cc1 2354168241 OMANPGXBCOHKID-XLNGHYISSA-N 272.392 2.359 10 10 CECE COc1ccc(O)c(CNC(=O)c2nc(C)sc2C)c1 179036424 ZKUKWXDFVLMUBI-UHFFFAOYSA-N 292.360 2.404 10 10 CECE C[C@@H](N[C@H]1CCC(=O)NC1)c1ccc2ccccc2c1O 111018537 GJYOZXAXTKEANZ-YPMHNXCESA-N 284.359 2.475 10 10 CECE C[C@H]1C[C@@H]1NC(=O)NCc1ccc2c(c1)CCCN2C 170808112 KVOMKJLCWPISBT-FZMZJTMJSA-N 273.380 2.277 10 10 CECE C[C@@H](NC[C@@]1(O)C[C@@H]2CCC[C@@H]21)c1cc(O)ccc1O 2357509840 VJCVWXFFZWFFBM-AZLWOZFGSA-N 277.364 2.300 10 10 CECE CCCN[C@H](C)c1ccc(N(C)CCO)c(F)c1 37899419 FIYKEVUKCDNYDF-LLVKDONJSA-N 254.349 2.315 10 10 CECE O[C@H]1CN(c2ccc(OC(F)(F)F)cc2)C[C@H]1F 2219387687 YZHIGILOQGYOSL-ZJUUUORDSA-N 265.206 2.104 10 10 CECE [N-]=[N+]=NCCCNS(=O)(=O)c1ccc(Cl)cc1 42013301 AYWVDEBKWZWUCH-UHFFFAOYSA-N 274.733 2.319 10 10 CECE COc1c(O)c([C@@H](C)N)cc(Br)c1F 213324951 CARYZGFJJRSDGR-SCSAIBSYSA-N 264.094 2.322 10 10 CECE CC(C)[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 32113587 GYHRKSYLDDQMDC-CQSZACIVSA-N 264.369 2.294 10 10 CECE C[C@@H](NC(=O)c1cccc(O)c1O)c1nccs1 126441254 PGNXLYWERMFRQR-SSDOTTSWSA-N 264.306 2.045 10 10 CECE CC1(C)CN(Cc2cc3c(cc2O)CCC3)CCO1 126280655 YBDUZERNIGSDCW-UHFFFAOYSA-N 261.365 2.492 10 10 CECE ONCc1c(O)cc(Cl)cc1Br 217719755 PVLJICPSHAEBAQ-UHFFFAOYSA-N 252.495 2.287 10 10 CECE CC[C@@H]1CO[C@@H](C)CN1C(=O)CCOc1ccc(N)cc1 40304558 HYAPEDWOJBVFKH-GXTWGEPZSA-N 292.379 2.064 10 10 CECE CNCCN(C)c1ccc(OC)c(Br)c1 82624488 QNZISKUAMAAQMS-UHFFFAOYSA-N 273.174 2.113 10 10 CECE CN[C@H]1CCN(c2ccc(OC)c(F)c2)[C@@H](C)C1 49710999 QOMZOYSCLWYKPN-QWRGUYRKSA-N 252.333 2.411 10 10 CECE Nc1ccc(CC(=O)Nc2cccc(CCCO)c2)cc1 138956535 PRKMLRXEXBMIBV-UHFFFAOYSA-N 284.359 2.375 10 10 CECE Nc1ccc(NC(=O)C(F)(F)C(F)(F)F)cc1 236349138 MMOYAHVNJNGLDZ-UHFFFAOYSA-N 254.158 2.405 10 10 CECE COC(=O)[C@H]1CCN[C@H]1c1ccc2ccccc2c1O 1952792481 HRCQCYDDIPYDFT-KBPBESRZSA-N 271.316 2.369 10 10 CECE C[C@H]1C(=O)N(c2ccc(N)cc2Cl)C(=O)[C@@H]1C 235443483 CFMUJHCXMVTTIU-RNFRBKRXSA-N 252.701 2.068 10 10 CECE C[C@@H](NCc1nnc2ccccn12)c1cc(F)ccc1O 94616968 PJCMYYQZDCANSV-SNVBAGLBSA-N 286.310 2.425 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CC12CC2 335544284 NFRRDIBDQBZIMS-GFCCVEGCSA-N 272.348 2.278 10 10 CECE C[C@@H](O)[C@H](N)c1cc(Cl)cc(Br)c1O 95684187 CWKOAMWNCYJZJD-VHWMUFPASA-N 280.549 2.189 10 10 CECE CC(C)(C)OC(=O)N1CCC[C@@](O)(CN=[N+]=[N-])C1 238082879 PKBLJVVAOHMNBY-LLVKDONJSA-N 256.306 2.059 10 10 CECE CO[C@H]1CCN(c2ccc(CN)cc2Br)C1 234979508 CFGMOHJJXWHBSW-JTQLQIEISA-N 285.185 2.133 10 10 CECE Oc1cccc(Cl)c1CN1CCN[C@H](C(F)(F)F)C1 1236978369 AUWJDDYZSIWMJY-NSHDSACASA-N 294.704 2.382 10 10 CECE Cc1cc(O)c(O)c(Br)c1-c1c[nH]nc1N 258674646 QIANNHWWJYBTTM-UHFFFAOYSA-N 284.113 2.141 10 10 CECE C[C@H](N[C@@H](C)[C@H]1CCOC1)c1ccc(O)cc1O 253078251 SUYXIQUDDQFGIL-DCAQKATOSA-N 251.326 2.173 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@]1(CN)c1ccccc1O 258287235 RSPNFSJCGRTUBO-OAHLLOKOSA-N 278.352 2.187 10 10 CECE COC(=O)CC1(NCc2cc(OC)ccc2O)CCCC1 279648917 KEXPDUSXKYDMAL-UHFFFAOYSA-N 293.363 2.366 10 10 CECE CCN1CCc2cc([C@@H](O)CCOCCOC)ccc21 2163072848 DDWHNHLTLYELLB-INIZCTEOSA-N 279.380 2.156 10 10 CECE CN1CCc2cc([C@](C)(O)C[C@H]3CCCCN3)ccc21 2163076578 OVZSCQRZWXOHBE-NVXWUHKLSA-N 274.408 2.419 10 10 CECE Cn1cc([C@H](O)c2ccc(N3CCCCC3)cc2)cn1 2163106352 JEZJHZIYPWEBRP-MRXNPFEDSA-N 271.364 2.492 10 10 CECE C[C@@H]1OCC[C@@H]1[C@H](NN)c1ccc(N2CCCC2)cc1 2163150485 WGALYINDOAKYCI-VBNZEHGJSA-N 275.396 2.216 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@](C)(O)C(F)F 2163230228 NQMBHGNQARNNHS-HIFRSBDPSA-N 284.350 2.346 10 10 CECE C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@H]1CCN 723922066 KZRADMGBJYCRIB-ZJUUUORDSA-N 270.323 2.087 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(-c2ccccc2F)o1 808498463 SSYGGAYOPTZITC-UHFFFAOYSA-N 290.246 2.401 10 10 CECE CCO[C@@H]1C[C@H](N[C@H](C)c2cc(OC)ccc2O)[C@H]1OC 290301183 HWTZHRWBDJEIMG-UCDYDWOKSA-N 295.379 2.244 10 10 CECE CCOc1cccc(CN[C@H](C)[C@@H]2CCC[C@@H]2O)c1O 2167859433 LWYNSXAAWCTSEA-XBFCOCLRSA-N 279.380 2.430 10 10 CECE CN1CCc2cc(CN[C@@H]3COCCC3(F)F)ccc21 2166685895 RAELESNUUQAVIT-CQSZACIVSA-N 282.334 2.193 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1C[C@@H](C)[C@](C)(C(=O)O)C1 710263992 LVEVREYOBJMKNJ-HFBDOXOYSA-N 279.336 2.201 10 10 CECE C[C@@H](N[C@@H]1CNCCC1(F)F)c1ccc(F)cc1O 817981654 UKWGFOPJXKPFFE-PRHODGIISA-N 274.286 2.179 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H]2CN3C(C)C)cc1 2131054318 RXLFLIBEEIDFOV-CVEARBPZSA-N 259.397 2.077 10 10 CECE CNC(=O)[C@@H]1CCCN1c1ccc([C@H](C)NC)c(Cl)c1 723190048 YFSPJRFBMYBMOC-HZMBPMFUSA-N 295.814 2.335 10 10 CECE Cc1cc(CN)ccc1N1CC[C@H]2CC[C@@H](O)[C@H]1C2 722205980 YZCGEAWXILZUCC-DAXOMENPSA-N 260.381 2.193 10 10 CECE COC[C@@](C)(CN(C)Cc1cccc(F)c1O)OC 1894308472 RGLCDENLSTVTBM-CQSZACIVSA-N 271.332 2.015 10 10 CECE CSCCCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832272500 GHXFXDRBFFDWHY-AWEZNQCLSA-N 295.452 2.012 10 10 CECE Cc1cc(N(C)C)ccc1CNC[C@@H]1CCCN1C 840934319 ZZNRJGJKEARNTI-INIZCTEOSA-N 261.413 2.245 10 10 CECE CNC[C@H]1CCN(Cc2cc(Cl)cc(C)c2O)C1 843052177 JWCPQYADVKGKDJ-LLVKDONJSA-N 268.788 2.395 10 10 CECE Cc1cc(O)c(CNCCCc2cnn(C)n2)c(Cl)c1 840948995 LUCBGHGPZYJFGM-UHFFFAOYSA-N 294.786 2.205 10 10 CECE Cc1cc(CN2C[C@H]3CC[C@H]2[C@@H](N)C3)ccc1N(C)C 923397687 FKPGOTFNBAPFJC-ZOBUZTSGSA-N 273.424 2.373 10 10 CECE C/C=C/CNCc1ccc(N2CCOCC2)c(F)c1 858290978 LCXBJXZEXVSRRA-NSCUHMNNSA-N 264.344 2.328 10 10 CECE CCN(C)c1ccc([C@H](C)NC[C@H]2COCCN2C)cc1 858522501 ZZKVAMTXYGKADP-YOEHRIQHSA-N 291.439 2.124 10 10 CECE CN[C@H]1CCN(c2ccc(OC)c(F)c2)C[C@H]1C 49710974 NLKBVXBJAHWMBJ-MFKMUULPSA-N 252.333 2.269 10 10 CECE OCc1cc(F)c(N2CCO[C@H](C(F)(F)F)C2)c(F)c1 698773435 OXBNSBCOFVTMHD-JTQLQIEISA-N 297.223 2.225 10 10 CECE CCCN(CCC)c1ccc(CNC[C@H](O)[C@H](C)O)cc1 865742341 YMCGXKGCSLLDDS-YOEHRIQHSA-N 294.439 2.144 10 10 CECE COc1ccc(N2CCN(C(=O)C3=CCC3)CC2)cc1 779718889 QCOJCXDEPQYWBG-UHFFFAOYSA-N 272.348 2.064 10 10 CECE CCN(C)c1ccc(CN2C[C@@H](O)CC(F)(F)C2)cc1 773887570 FXVVKIJXSDUOKL-AWEZNQCLSA-N 284.350 2.345 10 10 CECE Nc1nc(Sc2nccs2)nc(N2CCCCC2)n1 130397214 DXZDVMNPVJIPAM-UHFFFAOYSA-N 294.409 2.052 10 10 CECE Cc1cc(CN2CCNCC2)c(O)c(C(C)(C)C)c1 71464352 LOWANHPJQIYGFT-UHFFFAOYSA-N 262.397 2.403 10 10 CECE CO[C@H](CNCc1ccc(F)c(F)c1O)C(C)C 700715488 NLKSPDPZUBRLBY-LLVKDONJSA-N 259.296 2.431 10 10 CECE COc1ccc(O)c([C@]2(C)CO[C@H](C(C)C)CN2)c1 83482217 OMNHTDJLHUKVSS-GJZGRUSLSA-N 265.353 2.260 10 10 CECE Oc1ccc(O)c([C@@H]2NCCc3ccc(O)cc32)c1 83595840 XESFJDAFEKTYHJ-OAHLLOKOSA-N 257.289 2.039 10 10 CECE CCOc1cccc(CNC[C@H](CC)C(=O)OC)c1O 895120082 LIPKFSKOIDWNTF-NSHDSACASA-N 281.352 2.080 10 10 CECE CN(C(=O)[C@@H]1CCC[C@H](C(=O)O)C1)c1ccc(N)cc1 702056999 YVGJRPPPXHUWSI-MNOVXSKESA-N 276.336 2.123 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@H]2C(N)=O)c(Cl)c1 703056290 SUKQGSTWXTZTMG-NOZJJQNGSA-N 281.787 2.075 10 10 CECE COC[C@@H]1CCCN1Cc1ccc(F)c(F)c1O 703633962 QHWBHIRDOORDMQ-JTQLQIEISA-N 257.280 2.281 10 10 CECE CNc1ccc(CN(C)c2ccc(OC)cc2)nn1 703972949 LQHUNOTWSUPYGB-UHFFFAOYSA-N 258.325 2.163 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](CO)[C@@H](C)C2)c(Cl)c1 708754236 GYOBNELOXHDGRP-NHCYSSNCSA-N 269.772 2.458 10 10 CECE C[C@H]1CN(c2ccc(CO)cc2Cl)C[C@H](C)C1O 688083444 IGHGHUACURCTKY-UWVGGRQHSA-N 269.772 2.285 10 10 CECE CN[C@@H](C)c1ccc(N2CCn3cnnc3C2)cc1Cl 81536409 JEMORTGBCAXEJP-JTQLQIEISA-N 291.786 2.232 10 10 CECE COc1ccc(O)c(CNCc2n[nH]c(C)c2C)c1 716446862 MEVYRIYCSFHMBG-UHFFFAOYSA-N 261.325 2.031 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1n[nH]c(C)c1C 716684431 KYIILRFIOGLWSL-UHFFFAOYSA-N 272.352 2.271 10 10 CECE Oc1ccc(F)cc1CNCCO[C@H]1CC1(F)F 690727117 PBIWEXKANGCGRH-NSHDSACASA-N 261.243 2.045 10 10 CECE CCOC1CC2(C1)C[C@@H]2NCc1cccc(O)c1O 721229551 IONDHEKJVWTPLM-QRJNDHJOSA-N 263.337 2.145 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cn2c(n1)CCCC2 696227585 FDQFMNLGFMDAAR-UHFFFAOYSA-N 262.317 2.040 10 10 CECE CCOC[C@H]1CCCN1c1ccc([C@@H](C)O)c(O)c1 696591446 VGIGBINNHRNUKH-DGCLKSJQSA-N 265.353 2.451 10 10 CECE CC(C)Oc1ccc([C@H](NCCN=[N+]=[N-])C(=O)O)cc1 90256333 RFHLJQCNRWOJFL-LBPRGKRZSA-N 278.312 2.499 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@H](N)[C@@H](C)C2)c1 94339092 AKFZUKJTQGWCAA-MJVIPROJSA-N 264.369 2.131 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NC/C=C\Cl)cc1 1304681858 ARCSNBGKFQFEQG-UQGDFTQRSA-N 266.688 2.331 10 10 CECE Cc1cc(C)cc(S(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)c1 2118653279 QNSNICUEVHVCNT-NSHDSACASA-N 280.353 2.377 10 10 CECE C[C@@H](N)c1ccc(N(C)CCn2cccc2)cc1O 2115193897 AEBKQUQCYPBRIK-GFCCVEGCSA-N 259.353 2.350 10 10 CECE CCNCc1ccc(N2CCO[C@@H](CF)C2)cc1C 2115409417 GOCVHFFUCIBKOZ-HNNXBMFYSA-N 266.360 2.279 10 10 CECE CN(CCCc1ccc(N)cc1)C[C@@H]1[C@@H]2COC[C@@H]21 2118010683 WEPHWTICLVZRNA-MUJYYYPQSA-N 260.381 2.026 10 10 CECE C[C@H](NC[C@@H]1[C@@H]2CCCO[C@@H]21)c1ccc(O)cc1O 2119924211 KJZKQYRQRMULGI-WTKQLKIWSA-N 263.337 2.173 10 10 CECE CNCc1ccc(N2CC3(CC(COC)C3)C2)cc1 2129990492 ZJVQFFUNKIBJKJ-UHFFFAOYSA-N 260.381 2.269 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC(=O)N1CCCCCC1 2123018400 GKIJKFQAJCSOQZ-GFCCVEGCSA-N 265.361 2.164 10 10 CECE C[C@H](CN(C)c1cc2c(cc1N)OCCO2)C(F)F 2127522200 RTHNCSMRKGNWPW-MRVPVSSYSA-N 272.295 2.377 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@]3(CC[C@H]3O)C2)cc1 2129551990 JGCGQVKIHIVSLB-MAZHCROVSA-N 261.365 2.481 10 10 CECE O[C@@H]1CCCc2cc(N3C[C@H]4COC[C@@H]4C3)ccc21 2128279850 UWYNVTGRMIISMH-HEHGZKQESA-N 259.349 2.139 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@@H]4[C@@H]3C[C@H]4O)ccc21 2128278874 IFQMQIADBCEMKT-QKPAOTATSA-N 259.349 2.016 10 10 CECE N[C@H]1CCCc2cc(N3CC=C(CO)CC3)ccc21 2128278167 BMLPTRWYOJUBBA-INIZCTEOSA-N 258.365 2.152 10 10 CECE CC(C)OCCSC[C@@H](O)COc1ccc(N)cc1 2128312929 NHMQRNSZRBKHFF-ZDUSSCGKSA-N 285.409 2.167 10 10 CECE CN[C@@H]1CCc2cc(N3CCN(C)[C@@H](C)C3)ccc21 2128315363 RCDHPWREXWHCGF-BLLLJJGKSA-N 259.397 2.034 10 10 CECE CN(C[C@]12COC[C@@H]1C2)c1ccc2c(c1)CC[C@H]2N 2128310276 FLFKLKPFZYCXBU-APHBMKBZSA-N 258.365 2.105 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@H]4COC[C@H]4C3)ccc21 2128316956 LJLNTUUTBMWCNB-XJKCOSOUSA-N 259.349 2.139 10 10 CECE O[C@@H]1CCc2cc(N3CCOC[C@H]3C3CC3)ccc21 2128319607 VDOCCJRWCVIGLH-JKSUJKDBSA-N 259.349 2.281 10 10 CECE CCO[C@@H]1C=CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128320860 GMMGZYAWBZHIOB-ZBFHGGJFSA-N 258.365 2.414 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H]2C2CC2)cc1 2130608780 VSEOAQIHFAWDSU-BZUAXINKSA-N 261.365 2.480 10 10 CECE CCO[C@@H](CNCc1ccc(O)cc1O)C1CCC1 2131896815 VHRHQBZXUCNUCV-HNNXBMFYSA-N 265.353 2.393 10 10 CECE Cc1ccc(CN[C@@H]2CCOC2)c(O)c1Br 1905143510 OCDUIKVAEDEBAQ-SNVBAGLBSA-N 286.169 2.342 10 10 CECE Cc1ncccc1CN1CCc2cc(CN)ccc21 2133388475 PRNLQIWICAWIFC-UHFFFAOYSA-N 253.349 2.411 10 10 CECE C[C@H]1CC[C@@H](CN2CCc3cc(CN)ccc32)OC1 2133395465 ZZNQXWAOXGZMKU-WFASDCNBSA-N 260.381 2.323 10 10 CECE FC(F)CN[C@@H]1CCCN(c2ccc3c(c2)OCO3)C1 108047511 YYHJVNJSFIDQGN-SNVBAGLBSA-N 284.306 2.239 10 10 CECE CCN[C@H](CC)c1ccc(N2CC(C)(C(N)=O)C2)cc1 1914215522 LBINECOOFATYLH-CQSZACIVSA-N 275.396 2.059 10 10 CECE CC1(C)CN(c2ccc(C=CC(=O)O)cc2)CCO1 1911813783 RMJVGGBLFLVJIF-UHFFFAOYSA-N 261.321 2.400 10 10 CECE CN(CCCN=[N+]=[N-])CC(=O)N(C)c1ccccc1 1912178611 NRVOHQWEVWCSHO-UHFFFAOYSA-N 261.329 2.282 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)CCn2ccnc2)C1 1912192950 ATNSPORKUFDNLJ-LBPRGKRZSA-N 276.344 2.212 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCCc2ncno2)C1 1912189230 UCFLFPPCLUDWIL-SNVBAGLBSA-N 250.306 2.025 10 10 CECE OCc1ccc(N2CC3(CCCC3)C[C@H]2CO)c(F)c1 1912751431 RFGCOZPVLGMVLZ-ZDUSSCGKSA-N 279.355 2.449 10 10 CECE CN[C@H](CCCF)[C@@H](O)c1ccc2c(c1)CCN2C 1913265080 USOUJWYKOVMKPL-HIFRSBDPSA-N 266.360 2.050 10 10 CECE CCN(CCSC)[C@@H](CN)c1ccc2c(c1)CCN2C 1917019072 XXGMCCRULCWARL-INIZCTEOSA-N 293.480 2.364 10 10 CECE Cc1cc(CN)ccc1N1CCC2(C1)CC1(C2)OCCO1 1917356126 LKDZGSQTVFFYOC-UHFFFAOYSA-N 288.391 2.187 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2C[C@H]1[C@@H]1C[C@H]21 1917661103 MALQCTIFJAOEJR-JRIUUZRMSA-N 273.376 2.450 10 10 CECE CO[C@H]1CCC[C@H](CC(=O)NCc2cc(O)ccc2O)C1 1455350217 BFDFGIXNESDTAG-FZMZJTMJSA-N 293.363 2.309 10 10 CECE Cn1ccc(C(=O)NCc2cc(Cl)ccc2O)c1 1452936226 NYCUVMQARKNVLD-UHFFFAOYSA-N 264.712 2.314 10 10 CECE CC(C)(C)OC(=O)N1CCNC[C@@H]1c1cc(F)ccc1O 1535927835 FFKHKLNNUWHBAD-GFCCVEGCSA-N 296.342 2.413 10 10 CECE CC[C@@H](CO)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1539469070 UQFXWAKJEVFYMJ-HNNXBMFYSA-N 290.407 2.264 10 10 CECE COc1cccc(CNC(=O)c2onc3ccccc23)c1O 1545684449 XEXFXUNLCLPXSE-UHFFFAOYSA-N 298.298 2.472 10 10 CECE CCC[C@H](CCO)CNC(=O)CCc1ccc(N)cc1 227394232 IBPZZBIEMMLSMI-CQSZACIVSA-N 278.396 2.116 10 10 CECE CS[C@@H]1CC[C@H](NC(=O)CCOc2ccc(N)cc2)C1 235126221 HYHGXZYQBULKIE-GXTWGEPZSA-N 294.420 2.438 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@H](C)COC 1923967755 FNLVWIUWTWPLBK-GFCCVEGCSA-N 264.369 2.290 10 10 CECE Oc1ccc(CNC[C@H]2CCC3(CCC3)[C@@H]2O)c(O)c1 1924688531 AHAIPBIKHHWQLH-IUODEOHRSA-N 277.364 2.129 10 10 CECE CN(CCOC(F)F)c1ccc(C=CC(=O)O)cc1 2138181884 IOLYWGGABVCNSV-UHFFFAOYSA-N 271.263 2.460 10 10 CECE Cc1cc(C(=O)N[C@H](C)c2ccccc2O)cc(O)n1 1648889517 AACKWEUNHLMWCD-SNVBAGLBSA-N 272.304 2.292 10 10 CECE COc1ccc(N2CCC[C@@H](O)C2(C)C)cc1OC 259348443 JORHGKYNMDGPGN-CQSZACIVSA-N 265.353 2.444 10 10 CECE C[C@@H](Oc1ccccn1)C(=O)NCc1c(O)cccc1F 1652298050 DQEOEWMUHFFCJI-SNVBAGLBSA-N 290.294 2.010 10 10 CECE Cc1ccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)c(O)c1 2139772504 PTVXVJQTDAJQQF-AEGPPILISA-N 260.381 2.260 10 10 CECE COc1cc(N2CCC[C@H](OC)[C@@H]2C)ccc1CN 2139701554 VSANEFDJDOPMBU-FZMZJTMJSA-N 264.369 2.158 10 10 CECE CCCCN(Cc1ccc(O)cc1O)C[C@@H]1CCCN1 233036593 TVQHAKMVENBZIG-AWEZNQCLSA-N 278.396 2.452 10 10 CECE Cc1cc(OCC2CCOCC2)ccc1N1CCNCC1 161692309 YZYAQZYUQCUQCL-UHFFFAOYSA-N 290.407 2.210 10 10 CECE CC[C@@H]1CN(c2ccc([C@@H](C)NC)cc2)C[C@H]1CO 2140882864 LXDDSNHLDTVKGE-NFAWXSAZSA-N 262.397 2.422 10 10 CECE CNCc1ccc(N(CCO)C(C)C)c(Cl)c1 164003537 XCNLKKHDIGTLJY-UHFFFAOYSA-N 256.777 2.267 10 10 CECE Cc1cc(OCCF)ccc1N1CCC[C@H](N)C1 157410256 SJUYSVKPOMFDMS-LBPRGKRZSA-N 252.333 2.271 10 10 CECE CN1C(=O)CN(c2ccc(N)cc2)c2ccccc21 259173148 HAFZLRNYJOJFFT-UHFFFAOYSA-N 253.305 2.383 10 10 CECE COc1ccc(N2CCCNCC[C@H]2C)c(OC)c1 259455415 PSDMTABQLGTXQM-GFCCVEGCSA-N 264.369 2.282 10 10 CECE CC[C@H](C)CS(=O)(=O)[C@H](C)C(=O)Nc1ccc(N)cc1 233996980 RPGAHNPXZBNHEL-WDEREUQCSA-N 298.408 2.057 10 10 CECE NC(=O)[C@@H]1CC[C@H](Nc2c(N)cccc2Br)C1 1942366117 VAZGGZSEKUCCIK-SFYZADRCSA-N 298.184 2.097 10 10 CECE C[C@@H](NCc1ccc(Cl)cc1O)c1nc[nH]n1 1942492411 YEMARSOGGKCGPG-SSDOTTSWSA-N 252.705 2.015 10 10 CECE CNC[C@H]1CCCN1Cc1ccc(Cl)cc1O 1942497879 REKWJHZCUJUOBW-GFCCVEGCSA-N 254.761 2.229 10 10 CECE CN(Cc1ccc(N)cc1)c1nccc2c1ncn2C 234305388 CLJUEHCGDPXISB-UHFFFAOYSA-N 267.336 2.187 10 10 CECE Cc1nscc1NCc1ccc(O)c(O)c1O 1945157483 HKBFSUWIUOWGMX-UHFFFAOYSA-N 252.295 2.180 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1 873329266 XTGJUZMNLIBYEO-BPNCWPANSA-N 275.352 2.348 10 10 CECE CCN(C)C(=O)OCCNCc1ccc(Cl)cc1O 1876016060 ZUCCKSXMCHHRRL-UHFFFAOYSA-N 286.759 2.224 10 10 CECE CSc1nc(N)cc(=N[C@H](C)c2ccccc2O)[nH]1 1877590040 PRBPWKVEYWMTJL-MRVPVSSYSA-N 276.365 2.081 10 10 CECE CC[C@@H](C)[C@@H](N)CC(=O)N[C@H](C)c1ccccc1O 1877587850 PQLXJWULUNBAQV-WZRBSPASSA-N 264.369 2.333 10 10 CECE CCCC[C@H](N)CC(=O)NCc1ccc(N(C)C)cc1 1963243251 FMOBRLNTZOUARZ-AWEZNQCLSA-N 277.412 2.276 10 10 CECE CCNCc1ccc(N2CCC[C@@H]2[C@@H](C)O)c(C)c1 1879181172 GTLDDJRWEAQHHZ-CZUORRHYSA-N 262.397 2.454 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C[C@@H]1CCCO1 1963333138 QBZLCQVMEQUARP-ZDUSSCGKSA-N 262.353 2.130 10 10 CECE CCCN[C@@](CSc1nccs1)(C(N)=O)C1(C)CC1 1879635152 IIOJSNIDDKDTPG-ZDUSSCGKSA-N 299.465 2.259 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CC[C@@H](F)C2)cc1 1963539865 VOVVDXBVKUZKBH-NWDGAFQWSA-N 250.317 2.066 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]4CCCC[C@@H]43)ccc21 250023722 NHKPNELAOYDDGW-ONERCXAPSA-N 271.364 2.407 10 10 CECE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N(C)CCN=[N+]=[N-] 1885556765 GOEKDIWCNCQVKY-JTQLQIEISA-N 299.375 2.401 10 10 CECE CC(=O)NCCN[C@@H](C)c1ccc2ccccc2c1O 20148825 UNEMLWWSWCTNFI-NSHDSACASA-N 272.348 2.332 10 10 CECE Cc1c([C@H](CCN)CC(=O)O)c2ccccc2n1C 1951951220 DEBHMCJVKZEKLV-LLVKDONJSA-N 260.337 2.394 10 10 CECE CC[C@]1(C(=O)O)CCN([C@H](C)c2ccc(O)cc2O)C1 251262492 NZDXYQVYDCKIAG-BMIGLBTASA-N 279.336 2.346 10 10 CECE C[C@H](NC[C@H]1COCC(C)(C)O1)c1ccccc1O 1967471090 MHQAHAMMUJQJDF-RYUDHWBXSA-N 265.353 2.237 10 10 CECE CC1(C)CO[C@H](CNCc2ccc(F)cc2O)C1 1967812902 PFKRJGRSSPAUGQ-LBPRGKRZSA-N 253.317 2.436 10 10 CECE COc1nc(C(=O)N(C)[C@H](C)c2ccccc2O)co1 1968792028 QSNLWINEKLWLOW-SECBINFHSA-N 276.292 2.222 10 10 CECE CN(C)c1ccc(CN[C@H]2COCCC2(F)F)cc1 1972752914 GHXMMVFOGHFQIK-ZDUSSCGKSA-N 270.323 2.266 10 10 CECE CCc1c[nH]c(=NC)nc1Sc1nccs1 1977512994 ADEDXTCCDFAVLC-UHFFFAOYSA-N 252.368 2.110 10 10 CECE Oc1cc(Cl)ccc1CN1C[C@H]2CC[C@H]1[C@H]1CNC[C@H]21 2146322146 XDKUKTABZYGTNH-RABLLNBGSA-N 292.810 2.475 10 10 CECE Cc1cc(C2(C(=O)O)CCCC2)c(F)c(O)c1O 258542869 FOYRGBZYEOPBMP-UHFFFAOYSA-N 254.257 2.442 10 10 CECE COC[C@H]1C[C@H]1NCc1cc(Br)ccc1O 1982139396 VKRLZGFEVXREQJ-MWLCHTKSSA-N 286.169 2.279 10 10 CECE Cc1nc(=NCc2c(O)ccc3ccccc23)[nH]n1C 2146938984 ICZAMMHRGOXCCR-UHFFFAOYSA-N 268.320 2.016 10 10 CECE Cc1cnc(Sc2cn(C)nc2C(=O)O)s1 1985989828 OXUQMYSCBDWJPK-UHFFFAOYSA-N 255.324 2.034 10 10 CECE CC[C@@H]1CCN[C@H]1c1nc(-c2ccc(O)c(O)c2)no1 2151490945 BBBXXDMYPZUDAB-PRHODGIISA-N 275.308 2.208 10 10 CECE CNC(=O)[C@H](CC(C)C)NCc1cc(Cl)ccc1O 37161944 YOXXVNLWXUNDBO-LBPRGKRZSA-N 284.787 2.296 10 10 CECE Nc1ccc(NS(=O)(=O)c2ccc(F)cc2F)cc1 37327320 MKAMJDCGTPUQKD-UHFFFAOYSA-N 284.287 2.348 10 10 CECE Nc1ccc(CC[C@@H](O)c2cnc3n2CCCC3)cc1 2151140284 BBEZFHPLSAWAHQ-OAHLLOKOSA-N 271.364 2.468 10 10 CECE C[C@@H]1[C@@H](Sc2nccs2)CCC[C@@]1(N)C(=O)O 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2.372 10 10 CECE CCN1CC[C@H](N(C)C(=O)Nc2ccc(N)cc2)[C@H](C)C1 841298924 URZUCUSXAKXWFP-DOMZBBRYSA-N 290.411 2.463 10 10 CECE CC(C)c1cc(C(=O)NCc2c(O)cccc2F)n[nH]1 928712066 NXQXJJFDJVHCPY-UHFFFAOYSA-N 277.299 2.308 10 10 CECE CC(C)c1cc(C(=O)NCc2c(O)cccc2F)n(C)n1 928706567 XLBOIAVQDOPTMQ-UHFFFAOYSA-N 291.326 2.318 10 10 CECE COc1ccc(CN[C@@H]2CC[C@H](C)S(=O)(=O)C2)cc1C 850367776 DHBRCFAUTKZXDR-GXTWGEPZSA-N 297.420 2.059 10 10 CECE CCCCN(CC(N)=O)[C@H](CC)c1ccccc1O 132869157 AVDGLMPMBIRSQO-CYBMUJFWSA-N 264.369 2.431 10 10 CECE O=S(=O)(Cc1ccccc1F)Nc1ccc(O)cc1 244044731 SYPZZVNZRHZGKQ-UHFFFAOYSA-N 281.308 2.473 10 10 CECE C[C@@H]1C[C@@H](C)CN(CC(=O)c2ccc(O)c(O)c2)C1 34989366 IAJSCNZTOTVFNV-GHMZBOCLSA-N 263.337 2.258 10 10 CECE COCCCN(CCOC)[C@@H](C)c1ccccc1O 133095842 PORADIQNXQTEQA-ZDUSSCGKSA-N 267.369 2.438 10 10 CECE CCN(CC)CCCNC(=O)N[C@@H](C)c1ccccc1O 868014015 TYVDBLKXAJAOJB-ZDUSSCGKSA-N 293.411 2.484 10 10 CECE CC(=O)N1CCCN([C@@H](C)c2ccc(F)cc2O)CC1 133276949 GKWNJTFFIDHUQU-NSHDSACASA-N 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CO[C@@H](CS(=O)(=O)CCN=[N+]=[N-])c1ccccc1 2320509353 XNUZQOBBBBKTTA-NSHDSACASA-N 269.326 2.099 10 10 CECE C[C@H](NC(=O)[C@@H]1CCCC[C@@]1(C)N)c1ccccc1O 870988475 QPFKKVBWPMONMD-DETPVDSQSA-N 276.380 2.477 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](O)[C@H](F)C2)c(F)c1 2328762350 CBCAOBUGCHKKNU-MRCXROJRSA-N 270.323 2.015 10 10 CECE CNCc1ccc(N2CC[C@@H](O)[C@@H]3CC[C@@H]32)c(Cl)c1 2331946993 JFLUDQNJJJRMJO-OSAQELSMSA-N 280.799 2.409 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1[C@H]2CC[C@@H]1C[C@H]2CO 2333979117 GSHIAXAYDFYPAH-UJDVCPFMSA-N 261.365 2.398 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3[C@H](O)C[C@H]3C2)c(C)c1 2333979510 ZQPBZEVQJKRSLG-YYWXWVFPSA-N 260.381 2.092 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C[C@@H]1COC2(CCC2)CO1 2338087716 HYGGQSLDZAZMFR-VXGBXAGGSA-N 266.345 2.099 10 10 CECE CCN(CCCO)c1ccc(CNC)c(C2CC2)c1 2339144286 VRMYFUSCRGXPDF-UHFFFAOYSA-N 262.397 2.492 10 10 CECE CC(C)n1ncnc1[C@@H](C)NCc1ccc(N)cc1 2340540072 WNAUBQASHHXIJM-LLVKDONJSA-N 259.357 2.292 10 10 CECE Oc1ccc(CNC[C@@H]2CC[C@@H]2C2CC2)c(O)c1O 2342587587 OIJALZUCTGGDPR-CMPLNLGQSA-N 263.337 2.329 10 10 CECE Nc1ccc(CN2CCC[C@H](O)[C@H]2C(F)(F)F)cc1 2344162994 VQMQCFUVZRAQAL-RYUDHWBXSA-N 274.286 2.156 10 10 CECE CSc1cc(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)ccc1CN 2353857050 MNSIHBNZOANWTM-GZBFAFLISA-N 278.421 2.338 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2C[C@@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1 2355282518 MNXGGNFDAFEQJQ-HVQZGBDUSA-N 270.376 2.362 10 10 CECE COc1ccc(N(C)Cc2csc(CN)n2)cc1 52541824 VIOQRFBZXKXJEX-UHFFFAOYSA-N 263.366 2.247 10 10 CECE Cc1cc(N2CCCC[C@H]2C(N)=O)ccc1CNC1CC1 50584203 PBWQVMJFGFGHOS-INIZCTEOSA-N 287.407 2.091 10 10 CECE Nc1ccc(CCNc2ncc(Br)cn2)cc1 111751168 IARJTIQPNWHYEI-UHFFFAOYSA-N 293.168 2.476 10 10 CECE c1cc2c(cc1CN[C@@H]1C[C@@H]3[C@@H]1[C@@H]1CC[C@H]3O1)CCO2 2356909932 MYSGMSCBRZZHKN-DRBLLZIRSA-N 271.360 2.277 10 10 CECE NCc1ccc(N2CCC3(CC2)OCCO3)cc1Cl 125327853 OBPIKGSTIDSCNM-UHFFFAOYSA-N 282.771 2.142 10 10 CECE COc1ccc(N(C)CC(=O)Nc2cccc(N)c2)cc1 49968347 VNSWSMVRYXGONO-UHFFFAOYSA-N 285.347 2.352 10 10 CECE COc1ccc(N2CCN(CCCC[C@@H](C)O)CC2)cc1 45619318 MNCGQQRDKAUNKY-OAHLLOKOSA-N 292.423 2.368 10 10 CECE C[C@H]1C[C@H](C)CN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)C1 131340788 GPPZIBHGMBBNLR-ZIBATOQPSA-N 273.380 2.145 10 10 CECE COC(=O)C[C@H](C)NCc1c(O)cccc1Cl 380082080 SEFSJHYPMAQITE-QMMMGPOBSA-N 257.717 2.087 10 10 CECE [N-]=[N+]=NCC(=O)NCc1ccc(Br)cc1 228996266 MCONQIRGDJYFOJ-UHFFFAOYSA-N 269.102 2.376 10 10 CECE CC[C@@H]1CCC[C@@](NCCN=[N+]=[N-])(C(=O)OC)C1 90256841 YOVUICNURCZGSP-PWSUYJOCSA-N 254.334 2.398 10 10 CECE CCOc1cccc(CN2CCCC[C@@H]2CC(N)=O)c1O 92588614 DLOLYZLRYNPFNA-CYBMUJFWSA-N 292.379 2.021 10 10 CECE CNCc1ccc(N(CCO)CC(F)(F)F)cc1Cl 234410864 BDUMRXUNKAEGOD-UHFFFAOYSA-N 296.720 2.420 10 10 CECE CCNCc1ccc(N(CCOC)CCOC)c(C)c1 50561093 QBSMCRAMYIYNBV-UHFFFAOYSA-N 280.412 2.204 10 10 CECE C[C@@H](CCN)c1cc(Br)c(F)c(O)c1O 258772644 XFLZAIHDUKIYNS-YFKPBYRVSA-N 278.121 2.452 10 10 CECE CC[C@H](NCc1ccc(OC)c(C)c1)[C@H](O)C(F)F 295071647 PIEZKJMGJPLFAW-AAEUAGOBSA-N 273.323 2.498 10 10 CECE COc1ccc(N(C)CC2(CS(C)(=O)=O)CCC2)cc1 2165163864 HYFWURGAXQMLBC-UHFFFAOYSA-N 297.420 2.346 10 10 CECE CN1CCCc2cc([C@]3(O)CCNCC3(C)C)ccc21 2163091514 IDCJWUYEKOULET-QGZVFWFLSA-N 274.408 2.276 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2CC)[C@H](O)C1CC1 2163135771 NBZOBGOGJNAOHY-IAGOWNOFSA-N 274.408 2.491 10 10 CECE CCN1CCc2cc([C@@H](NN)c3csnc3C)ccc21 2163156176 NKIACXXDADBKPE-OAHLLOKOSA-N 288.420 2.387 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H](OC)C[C@@H](OC)C2)cc1 2165496201 UDGRDUHMXQQNOG-BZUAXINKSA-N 279.380 2.370 10 10 CECE CC(=O)c1ccc(O)c(CN2CC[C@H]3OCC[C@H]3C2)c1 724799977 ILIZADOEOFMXEN-XJKSGUPXSA-N 275.348 2.206 10 10 CECE Cc1nn(C)c(Cl)c1/C=C/C(=O)NCCCN=[N+]=[N-] 701290896 GGRRFFFBXHPEHL-SNAWJCMRSA-N 282.735 2.212 10 10 CECE c1cc2c(cc1N1CCN[C@H]3CCCC[C@H]31)COCC2 2162842918 BNEPKKLMJXRTES-DLBZAZTESA-N 272.392 2.480 10 10 CECE OC[C@H]1CCC[C@@H](c2cccc(Br)c2O)N1 713812564 LVINKDMMPADNBH-KCJUWKMLSA-N 286.169 2.330 10 10 CECE C[C@H](C(=O)N(C)Cc1ccc(N)cc1)[C@@H]1CCCCO1 711901439 QRFFAZFOKHIOGK-WFASDCNBSA-N 276.380 2.432 10 10 CECE Cc1ccc([C@H](C)NC[C@@H]2C[C@@H]3COC[C@H]3O2)c(O)c1 724586338 OBEDGZXCYNKNIH-RSUWNVLCSA-N 277.364 2.155 10 10 CECE CNc1ccc(S(=O)(=O)Nc2ccc(O)c(F)c2)cc1 722226378 QZAFYOXTWHDQNL-UHFFFAOYSA-N 296.323 2.374 10 10 CECE CN(C(=O)c1cccc(O)c1O)C1(C(F)(F)F)CC1 720393704 FTLFDEFTPKCPOV-UHFFFAOYSA-N 275.226 2.265 10 10 CECE CN(C)c1ccc(CN2C[C@@H](N)[C@@H](C(F)(F)F)C2)cc1 720926640 UNMMMEOTVKRDAR-QWHCGFSZSA-N 287.329 2.074 10 10 CECE CCCN(Cc1ccccc1O)C(=O)N[C@H](C)[C@H](C)N 842009200 ZZNPWXAJSPIGBB-NWDGAFQWSA-N 279.384 2.050 10 10 CECE CCc1nccn1[C@@H](C)CC(=O)NCc1ccccc1O 843833532 UTWXJBIUCUJVMV-LBPRGKRZSA-N 287.363 2.419 10 10 CECE CC(=O)c1cc(Cl)cc(CN[C@@H](CO)C2CCC2)c1O 852321079 QWKZABGQSVUIFP-AWEZNQCLSA-N 297.782 2.499 10 10 CECE C[C@H](NC[C@@H](O)c1ccnn1C)c1cc(Cl)ccc1O 927127995 BFLIKZCJDAGZKC-LKFCYVNXSA-N 295.770 2.163 10 10 CECE OC[C@H](NCc1c(O)ccc(Cl)c1F)C1CCC1 850350074 OAPODNXWIDSXOY-NSHDSACASA-N 273.735 2.435 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)CCOCC1CC1 751277901 JJDNCROOINQUFE-UHFFFAOYSA-N 290.407 2.494 10 10 CECE CCO[C@@]1(C)C[C@H]1N[C@@H](C)c1cc(C(=O)OC)ccc1O 858503086 VDHQDVRBSSXYMB-JJMVLAAESA-N 293.363 2.397 10 10 CECE CCOc1ccc(O)c(CN[C@H]2C[C@H](C)n3ncnc32)c1 850352008 LITGKOTXUMAABJ-GWCFXTLKSA-N 288.351 2.178 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)CC(=O)N1CCCC1 132702786 ASTHZBSBOWEFJC-NSHDSACASA-N 280.343 2.147 10 10 CECE Cc1cc(O)c(CN2C[C@H]3C(=O)OC[C@H]3C2)cc1C(C)C 863338101 OHEWUMYTFPLGSV-UKRRQHHQSA-N 289.375 2.429 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1[C@@H]3C[C@@H]4[C@@H]1OC[C@@H]4C3)CC2 866444722 CARSTEFIICMIKE-KUEHYUKNSA-N 271.360 2.393 10 10 CECE Cc1ccn([C@@H](C)CC(=O)N2Cc3cccc(O)c3C2)n1 871205756 KRMHQNHBOHXXIE-LBPRGKRZSA-N 285.347 2.391 10 10 CECE CN(C)c1ccc(/C=C\CN2C[C@H]3COC[C@H]3C2)cc1 872266526 XAKZSQDHNFWTNK-SSGMOAHOSA-N 272.392 2.344 10 10 CECE CC[C@@]1(C)CN([C@@H](C)CN)c2cc3c(cc2N1)OCCO3 76930965 HZAUMBMTTVGDKX-ZBEGNZNMSA-N 291.395 2.206 10 10 CECE C=Cc1nnc([C@@H](N)c2cc(Cl)ccc2O)o1 83385587 KRZFYNYUDGKWTM-JTQLQIEISA-N 251.673 2.120 10 10 CECE N[C@H](c1nc2c(s1)CCC2)c1cccc(O)c1O 83456324 UGYOPMDEKJRPFM-NSHDSACASA-N 262.334 2.091 10 10 CECE Oc1ccc([C@H]2NCCc3cccc(O)c32)cc1F 83594024 BYNWMUUFMQLHSX-OAHLLOKOSA-N 259.280 2.472 10 10 CECE COc1cc(CN(C)[C@H]2C[C@@H](OC)C2)c(O)cc1C 795676220 ZLLIZRVBVCZUBL-BETUJISGSA-N 265.353 2.318 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(Cl)c2)C[C@H]1O 399935437 LJPJTAZNBYGWCY-TVQRCGJNSA-N 254.761 2.006 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C(C)(C)CCO)c1 691024697 MIUBOECYFBKCGT-UHFFFAOYSA-N 265.353 2.188 10 10 CECE OCc1ccc(N2CCO[C@@H](C(F)(F)F)CC2)cc1 687561798 ZXSHQLIXTPZOPU-GFCCVEGCSA-N 275.270 2.337 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)c1 797071039 PGYCFQRFDGSYGI-VXGBXAGGSA-N 297.420 2.317 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)[C@H]1CCCC12CC2 706608656 PXNQZSGCSLWDRD-UONOGXRCSA-N 271.364 2.407 10 10 CECE Oc1c(F)cc(F)cc1CN1CCN(CCCF)CC1 708421792 IQASIZLZWBLBNJ-UHFFFAOYSA-N 288.313 2.148 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)[C@@H](CO)C2)cc1Cl 709219787 DYTRFGCGEHZQFZ-GARJFASQSA-N 268.788 2.424 10 10 CECE CC[C@H]1CN(c2cc3c(cc2N)OCCO3)C[C@H](C)O1 689090398 ZNDCYLHRQPHTKU-QWRGUYRKSA-N 278.352 2.044 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC(F)(F)C[C@H]1C(=O)O 713601792 PWEABFFCXHCJHX-XVKPBYJWSA-N 289.253 2.387 10 10 CECE F[C@H]1CN(c2ccc(CNC3CC3)cc2)C[C@H]1F 714701307 WFXULODKGWQMQS-OKILXGFUSA-N 252.308 2.435 10 10 CECE Cc1cc(CO)ccc1N1CCC[C@H]2[C@H]1C(C)(C)[C@@H]2O 693081438 OZUJGIFSRICDLV-CWRNSKLLSA-N 275.392 2.473 10 10 CECE [N-]=[N+]=NCCCCNC(=O)C1C[C@@H]2[C@@H](C1)C2(F)F 693302775 FXEDCLYGLHSEDV-RKDXNWHRSA-N 258.272 2.484 10 10 CECE C[C@@H]1CCC[C@](O)(CNCc2cccc(O)c2O)C1 87051438 TZMXRKDPXLXNRK-IAQYHMDHSA-N 265.353 2.129 10 10 CECE CC(C)[C@@H]1COC[C@H]1N[C@@H](C)c1cc(O)ccc1O 699455190 IHPCEHGVLROWCO-LEWSCRJBSA-N 265.353 2.419 10 10 CECE CC(C)CN(CCN(C)C)c1ccc([C@H](C)N)c(O)c1 93671224 SFPURXURACWTHU-ZDUSSCGKSA-N 279.428 2.436 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC(CO)CC2)cc1O 93670271 LXJOFHPQVQHIHO-LBPRGKRZSA-N 278.396 2.271 10 10 CECE Cn1nc(C(=O)NCc2ccccc2O)cc1C(F)(F)F 1150536680 RNOGHKJBRJHFDK-UHFFFAOYSA-N 299.252 2.075 10 10 CECE CC[C@H](NC(=O)COc1ccc(N)cc1)C(C)(F)F 2115284552 CSFPGHZAGUHCMD-NSHDSACASA-N 272.295 2.198 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2C[C@@H]3CC[C@H](C2)N3)cc1 2125254021 QWJPGPCTJAMSBV-FQLMCAECSA-N 260.381 2.317 10 10 CECE CCNCc1ccc(N(C)C[C@H]2[C@H]3OCC[C@H]23)cc1 2119934088 NLVOWPCFCAQXHM-OAGGEKHMSA-N 260.381 2.267 10 10 CECE C=C=CCC[C@@H](NC)[C@H](O)c1ccc(N(C)C)cc1 2125584023 KLUJGKXQXAXBBP-HZPDHXFCSA-N 260.381 2.495 10 10 CECE COc1cccc(CN(C)C[C@H]2CCO[C@H]2C)c1O 2121125331 FBZNYGNRXGJHGN-NWDGAFQWSA-N 265.353 2.258 10 10 CECE CN1CCc2cc([C@@H](O)CC[C@H]3C[C@H](N)C3)ccc21 2126104557 FLJOHANANHPROG-PJODQICGSA-N 260.381 2.230 10 10 CECE CCN1CC[C@H](N(C)c2ccc3c(c2)CC[C@@H]3N)C1 2128319393 SPGVRCIXCZEHEI-HOCLYGCPSA-N 259.397 2.163 10 10 CECE O[C@H]1CCc2cc(N3CCOCC4(CC4)C3)ccc21 2128320730 DVJQWGRKIIBXOD-HNNXBMFYSA-N 259.349 2.283 10 10 CECE CN[C@@H]1CCc2cc(N3CCC4(COC4)C3)ccc21 2128313344 RZMILZAVZAHJRN-OAHLLOKOSA-N 258.365 2.120 10 10 CECE CC1(C)C[C@@H](O)CN(c2ccc3c(c2)CC[C@H]3N)C1 2128328309 MQRUFSSXKMZGRQ-UKRRQHHQSA-N 260.381 2.230 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ccnn2C2CC2)C1 2121748856 KPQVAUXALYCNNV-VIFPVBQESA-N 260.301 2.133 10 10 CECE CCCN(Cc1ccccc1O)C(=O)c1coc(OC)n1 1329359794 BJPLVYAHIMIYGJ-UHFFFAOYSA-N 290.319 2.441 10 10 CECE C[C@@H](C(=O)N1CCC[C@H]1CN=[N+]=[N-])[C@H]1CCCCO1 2123016171 VDAHIYRJTZVOLJ-GRYCIOLGSA-N 266.345 2.493 10 10 CECE CC(C)c1nnsc1C(=O)NCc1c(O)cccc1O 1635850420 MECVCABNWQHYMA-UHFFFAOYSA-N 293.348 2.003 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)c(Cl)c1 2128760465 IYMLDISPZZOATN-CLLJXQQHSA-N 280.799 2.267 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CCC(C)CC3)ccc21 102452120 JBQXEHAYGYSIEG-CQSZACIVSA-N 259.353 2.136 10 10 CECE COc1cc2c(cc1OC)N1CCCCC[C@@H]1C(=O)N2 214177291 DAADAIFAIGOLGN-LLVKDONJSA-N 276.336 2.405 10 10 CECE CO[C@H]1CC[C@H]1CC(=O)N(C)Cc1ccccc1O 2130374570 GXLWKNZANMXXPC-FZMZJTMJSA-N 263.337 2.166 10 10 CECE NN[C@H](c1ccccc1O)[C@H]1CCOCC12CCC2 2133243553 YOTIPOCCUTZUOW-TZMCWYRMSA-N 262.353 2.103 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H]3C[C@@H]3[C@@H]2CO)cc1 1905555590 KBKZDYBBLFYVCC-TUUVXOQKSA-N 260.381 2.174 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@@H](O)[C@@H]2C)cc1O 1914305801 RXVALTIZQACVLG-TYNCELHUSA-N 278.396 2.412 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@H]2C3C[C@@H]4C2[C@@H]4C3)CC1 2134560949 KZMAVTZTRDVMGG-HBZWBMEYSA-N 260.341 2.437 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 1912176239 WPHKSGUOJHBLDF-UHFFFAOYSA-N 283.194 2.008 10 10 CECE CCC[C@H](C)NC(=O)[C@@H](C)N1CCC(N=[N+]=[N-])CC1 1912162249 UDBFJRXDZQGARJ-WDEREUQCSA-N 267.377 2.454 10 10 CECE CN1CCC[C@@H](CC(=O)N2CCC[C@H](CN=[N+]=[N-])C2)C1 1912206009 HYFGQCCCNWCBIB-QWHCGFSZSA-N 279.388 2.267 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)C1Cc2ccccc2C1 1912202962 NQSMRDUYQKJKIW-UHFFFAOYSA-N 294.380 2.164 10 10 CECE COC1(C(F)(F)C(=O)Nc2ccc(N)cc2)CCC1 1912526633 PGZBPSSQPYVEAS-UHFFFAOYSA-N 270.279 2.412 10 10 CECE CN[C@H](CCCF)[C@@H](O)c1ccc(N(C)C)cc1 1913289992 XGAQJXVCOOBNLR-KGLIPLIRSA-N 254.349 2.124 10 10 CECE CSCC[C@H](C)N(C)C[C@@H](O)COc1ccc(N)cc1 222310908 JDNSLWRPCPIPJH-GXTWGEPZSA-N 298.452 2.082 10 10 CECE Cc1ccnc2[nH]c(COc3ccc(N)cc3)nc12 111337908 SNGRYNBDZBDWOV-UHFFFAOYSA-N 254.293 2.428 10 10 CECE CC[C@H](C)[C@@H](CO)NCc1ccc2c(c1)CCN2C 2136528051 DUUVGUPATOOMFE-SWLSCSKDSA-N 262.397 2.176 10 10 CECE Nc1ccc(CCN=c2[nH]cc(Cl)s2)cc1 2212039713 PHZXXZRKHHFHPG-UHFFFAOYSA-N 253.758 2.455 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1ccc(C(F)F)nc1 1465953920 KSJXTGIVOWEYJV-UHFFFAOYSA-N 294.257 2.360 10 10 CECE CCN(CC)CCCN[C@@H](C(=O)O)c1cc(C)ccc1O 211722283 RSCROJBGGTZCIR-OAHLLOKOSA-N 294.395 2.148 10 10 CECE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1ncc[nH]1 1540488047 APPAXAGXQQDDPA-UHFFFAOYSA-N 298.390 2.211 10 10 CECE Cc1ccn2nc(NCc3ccccc3O)nc2c1 228427523 MQQDXIWHMWFLLH-UHFFFAOYSA-N 254.293 2.355 10 10 CECE Cc1ccnc(O)c1C(=O)N[C@H](C)c1ccccc1O 1648889570 BRLLNOMJORNKBX-SNVBAGLBSA-N 272.304 2.292 10 10 CECE [N-]=[N+]=NCCN[C@@]1(C(=O)O)CC[C@H]1OCc1ccccc1 1934875005 OXBTXZFIDPQELV-OCCSQVGLSA-N 290.323 2.089 10 10 CECE Cc1cc(OC[C@@H]2CCOC2)ccc1N1CCC[C@@H](N)C1 161710482 MQUAYNNNGBYGRL-HUUCEWRRSA-N 290.407 2.338 10 10 CECE CCN(CC)C(=O)CCN[C@@H](C)c1c(O)cccc1O 233457001 LEDPEBDWAQKEPY-NSHDSACASA-N 280.368 2.007 10 10 CECE Cc1cc2c(cc1N(C)[C@H]1CCC[C@H]1N)OCCO2 258842800 DUHQVGYNLCYETQ-NEPJUHHUSA-N 262.353 2.082 10 10 CECE Oc1cccc(F)c1CN[C@H]1C[C@H]2COC[C@H](C2)C1 2141826523 UPCCHTQRBOFQJZ-ZSBIGDGJSA-N 265.328 2.436 10 10 CECE Oc1ccc(Cl)cc1CN1C[C@@H]2CCC[C@H](C1)N2 843105607 SHLUXBRHTZXHFF-BETUJISGSA-N 266.772 2.372 10 10 CECE CC1(C)CCN(Cc2cc(F)cc(F)c2O)[C@H]1C(=O)O 1962965675 GYJRDNRZGJOSCS-LBPRGKRZSA-N 285.290 2.356 10 10 CECE CCNCc1ccc(N2C[C@H](CO)C3(CC3)C2)cc1C 2144089351 XHKYFXUBUWKWRY-OAHLLOKOSA-N 274.408 2.313 10 10 CECE Nc1ccc(CCC(=O)Nc2nccc(Cl)n2)cc1 236350648 IMSKWFZYNSEGRJ-UHFFFAOYSA-N 276.727 2.284 10 10 CECE CCn1cc(CN[C@@H](C)c2c(O)cccc2O)c(C)n1 2143437741 HBEVYEOQEPNTGU-NSHDSACASA-N 275.352 2.473 10 10 CECE C[C@H](NC(=O)CN1CCCCC1)c1ccccc1O 1877570947 LOYDXJAYQXXCND-LBPRGKRZSA-N 262.353 2.055 10 10 CECE C[C@@H](NC(=O)c1ccccc1N)c1ccccc1O 1877595297 HVFTWKUWZOUWOL-SNVBAGLBSA-N 256.305 2.465 10 10 CECE CCNCc1ccc(N2C[C@@H]3COCC[C@@H]32)c(F)c1 1878819897 UFRUCSRFUUAHPV-OCCSQVGLSA-N 264.344 2.160 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@H](C(=O)N(C)C)C2)cc1 2143703832 UHEYNUFRDQUDBB-ZFWWWQNUSA-N 275.396 2.011 10 10 CECE CN(C(=O)OC(C)(C)C)C(C)(C)C(=O)NCCN=[N+]=[N-] 1882298203 OJZLRSCYNNCRJA-UHFFFAOYSA-N 285.348 2.058 10 10 CECE CN(C)[C@H]1CCC[C@@H](NCc2c(O)cccc2F)C1 1964041232 YYVSABIRFQRLQQ-NEPJUHHUSA-N 266.360 2.494 10 10 CECE C[C@H](C=CC(=O)N(C)CCN=[N+]=[N-])NC(=O)OC(C)(C)C 1885557912 WFFPJWDGQMJQBM-SNVBAGLBSA-N 297.359 2.225 10 10 CECE [N-]=[N+]=N[C@H](CO)c1ncc(Br)cc1F 1951470561 SNVGPZLSQGFVRP-ZCFIWIBFSA-N 261.054 2.327 10 10 CECE CC(C)(C)OC(=O)C(C)(C)[C@H](N)c1c(O)cccc1O 1951862514 BULOKPYNSMNWRY-GFCCVEGCSA-N 281.352 2.466 10 10 CECE Oc1c(F)cccc1CNC[C@H]1CCCc2nccn21 1966081835 NPMXJODQPYPFQV-GFCCVEGCSA-N 275.327 2.395 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC=CCC3(C)C)ccc21 2150030302 OPOYYGUYGBZCNW-CQSZACIVSA-N 271.364 2.444 10 10 CECE CCCOc1ccc(CN2CC[S@](=O)C[C@H]2C)c(O)c1 1970310299 LRQAJILLUFKBOH-ODXCJYRJSA-N 297.420 2.134 10 10 CECE CC(C)N(CC1CC1)c1ccc2c(c1)NC(=O)[C@@H]2N 42585006 NDPOPIPZKQPWFG-CQSZACIVSA-N 259.353 2.263 10 10 CECE CNCc1ccc(N2CCC(C)(C)[C@@H](CO)C2)c(F)c1 2148684224 CWAXOIREFYRHSE-CYBMUJFWSA-N 280.387 2.390 10 10 CECE CCN(CC(F)(F)F)c1ccc2c(c1)NC(=O)[C@@H]2NC 42768960 DGOVBFCRDDFMTJ-LLVKDONJSA-N 287.285 2.288 10 10 CECE CNCc1ccc(N(C)CCc2ncccn2)c(C)c1 2146885791 BSHWVWITDBEOOK-UHFFFAOYSA-N 270.380 2.183 10 10 CECE Cc1nnc(CN(C)c2ccc([C@@H](C)N)c(Cl)c2)n1C 2146919918 SFGUCDIROHDHAS-SECBINFHSA-N 293.802 2.433 10 10 CECE C[C@H](CNCc1ccc2c(c1)CCN2C)N1CCCC1 160784796 SJVZEAMBHHXKTH-CQSZACIVSA-N 273.424 2.253 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC1OCCO1 1990916316 GNTYJAGVBDTAGF-MNOVXSKESA-N 263.337 2.211 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](CO)C2)c(Br)c1 162022428 AGUNOOPZPSGBCP-UWVGGRQHSA-N 299.212 2.287 10 10 CECE CCC1(F)CN([C@@H](CN)c2ccc3c(c2)CCN3C)C1 2149832359 JYHPKCORDRDNBL-HNNXBMFYSA-N 277.387 2.113 10 10 CECE CC[C@H](C)C[C@](O)(CN)CSc1nccs1 1995398544 ATGWABXYYWUOJH-ONGXEEELSA-N 260.428 2.361 10 10 CECE NCc1ccc(N2CCC[C@@H](CO)C2)c(C(F)(F)F)c1 163679603 YVDBXOQJBJJOLG-LLVKDONJSA-N 288.313 2.373 10 10 CECE CN(C[C@@H]1C=CCC1)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 2153102272 WAADJJFIWRYLAX-IAQYHMDHSA-N 271.364 2.065 10 10 CECE CCN(C)[C@H]1CCN([C@@H](C)c2ccc(OC)cc2O)C1 2153955366 ITRFHTOJMJELBE-STQMWFEESA-N 278.396 2.488 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@@H]1CCC12CCC2 2154891221 MCNISEVOXCWUBF-CQSZACIVSA-N 274.364 2.439 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H]2[C@H](C)O)cc1Cl 2011149546 QUMNXVLXEPEBJM-RVBZMBCESA-N 255.745 2.353 10 10 CECE C[C@H](O)[C@H]1CCN1c1ccc([C@@H](C)N)c(Br)c1 2011145606 MIPITYXYLNUUQU-VYUIOLGVSA-N 299.212 2.428 10 10 CECE COCCCCCN1CCN(c2ccc(N)cc2)C1=O 2155506009 YTACMROERMRCTD-UHFFFAOYSA-N 277.368 2.328 10 10 CECE C[C@H](O)[C@H]1CCCN1c1ccc(CN)c(Cl)c1 2018120031 VOIOQPYXFBHZTD-TVQRCGJNSA-N 254.761 2.148 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@H]1CCCOCC1 2028790166 CAHITYOUIHMCTG-LBPRGKRZSA-N 252.333 2.290 10 10 CECE CC[C@](O)([C@H](NC)c1ccccc1O)C(F)(F)F 2031155369 WNHJLXCGXXNTMI-MNOVXSKESA-N 263.259 2.356 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@@]1(C)CCCS1 2031160188 NQVAFENLHPQHNA-MGPQQGTHSA-N 267.394 2.299 10 10 CECE CO[C@@H]1CN(CCOc2ccc(N)cc2)CC[C@H]1C 299957455 SMGRMKNAIDCNOI-IUODEOHRSA-N 264.369 2.004 10 10 CECE C[C@@H]1CCN([C@H](C)c2cc(F)ccc2O)CCN1 2035746480 HLUFJKLKJUQEIY-GHMZBOCLSA-N 252.333 2.276 10 10 CECE CNCc1ccc(N2C[C@@H](CO)C[C@H]2C)cc1Cl 2038876247 YUYZXGLGWCKHGF-MNOVXSKESA-N 268.788 2.267 10 10 CECE COCCO[C@H]1CCCN(CCCCN=[N+]=[N-])C1 2040923341 OSSHYWWQNGQFKB-LBPRGKRZSA-N 256.350 2.204 10 10 CECE CC[C@H](C)[C@H](NCc1cc(C)ccc1O)C(=O)OC 71407729 AKPIVIFCLCTFLJ-FZMZJTMJSA-N 265.353 2.378 10 10 CECE COc1ccc(CNCCC2(O)CCCC2)c(O)c1 404162373 LBDONKAPQIQIDL-UHFFFAOYSA-N 265.353 2.186 10 10 CECE Nc1ccc(CCN2CCC3(CCOCC3)C2)cc1 311362397 FOZDLLRZSRATJQ-UHFFFAOYSA-N 260.381 2.314 10 10 CECE CC(C)CNC(=O)CN(C)[C@H]1CCc2cccc(O)c21 312825448 NGIKXXBDMFUCGN-ZDUSSCGKSA-N 276.380 2.084 10 10 CECE Cc1nc(CN(C)c2ccc(C=CC(=O)O)cc2)no1 2160426223 ANUBROGGZLFQTO-UHFFFAOYSA-N 273.292 2.112 10 10 CECE CC[C@H](N)c1ccc(N(C)[C@@H](C)CCS(C)(=O)=O)cc1 2160762498 HNJDPTLDGBKCTH-WFASDCNBSA-N 298.452 2.356 10 10 CECE Cc1cccc(O)c1CN[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)O 2160784248 JVSYADSYVFSGTN-LWWSYDQCSA-N 275.348 2.290 10 10 CECE COC[C@@]1(OC)CCCN(Cc2c(C)cccc2O)C1 2160776249 MCCJODLCOWXBOZ-MRXNPFEDSA-N 279.380 2.328 10 10 CECE CC[C@@]1(c2cc(N)cc(F)c2O)COC(C)(C)CN1 83510113 WHHNCXXVBCDQOI-AWEZNQCLSA-N 268.332 2.117 10 10 CECE Nc1ccc(OCC(=O)N2CCC[C@@H]3CCC[C@H]32)cc1 87765735 RBUSLLPTWCVOJO-SWLSCSKDSA-N 274.364 2.439 10 10 CECE CCn1nc(C)cc1C(=O)N(C)Cc1ccc(N)cc1 90122578 KIYDPTSGXNGBDY-UHFFFAOYSA-N 272.352 2.066 10 10 CECE COC(=O)c1ccc(CN2CCC(N=[N+]=[N-])CC2)cn1 2176735027 RJGICPDYUAEGGF-UHFFFAOYSA-N 275.312 2.143 10 10 CECE CCN1CC[C@@H](NCc2c(O)cccc2Br)C1 706881506 STYWFULRZPUEAR-SNVBAGLBSA-N 299.212 2.339 10 10 CECE C[C@@H](N)[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 708494866 QVYNVOGPBGPBKF-NXEZZACHSA-N 270.323 2.230 10 10 CECE CCC[C@H]1CN(c2cc(OC)c(OC)cc2N)CCO1 708882121 OLXDZOBHBACZLN-NSHDSACASA-N 280.368 2.291 10 10 CECE NCc1ccc(N2CC(O)(C(F)F)C2)c2ccccc12 2172109807 CXRWWJZWONQLCU-UHFFFAOYSA-N 278.302 2.115 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CC=CC[C@@H]43)c(Cl)cc2[C@H]1O 2177153379 QVTCNNLQCLVTFU-ORUWWINDSA-N 290.750 2.480 10 10 CECE CNCc1ccc(N2CC[C@H]3COC[C@H]3C2)c(F)c1 690286787 URWCYDVNRZACPN-QWHCGFSZSA-N 264.344 2.018 10 10 CECE COC1CN(c2ccc(CNC(C)(C)C)cc2C#N)C1 380183664 BPLJZEPQSWKINN-UHFFFAOYSA-N 273.380 2.281 10 10 CECE Cc1cccc(CN(C)[C@H]2CCCS(=O)(=O)CC2)c1O 694196533 TXQWKPNCQLJCJC-AWEZNQCLSA-N 297.420 2.100 10 10 CECE CN1CCc2cc(CNC3(CO)CC(C)(C)C3)ccc21 2163542966 WJTKASKOYPBJIA-UHFFFAOYSA-N 274.408 2.320 10 10 CECE CN[C@H](C)c1ccc(N2CC(O)(C3CC3)C2)c(F)c1 384038289 ITOMJPSNRKQSCU-SNVBAGLBSA-N 264.344 2.067 10 10 CECE CCNCc1ccc(N2C[C@@H]3C(N(C)C)[C@H]3C2)c(Cl)c1 384886620 KVCVYTVGNMOQNL-STQMWFEESA-N 293.842 2.446 10 10 CECE CCN(C(=O)CCOC(C)C)c1ccc(N)cc1 717798042 BTEADLBZKNLWQG-UHFFFAOYSA-N 250.342 2.437 10 10 CECE Oc1ccc(CCNCc2cnn(C(F)F)c2)cc1O 2177367796 PIXXDRFIWGAUCD-UHFFFAOYSA-N 283.278 2.022 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](O)C(C)(C)C2)cc1O 388100392 RYIYWUMDVQCZEP-ABAIWWIYSA-N 278.396 2.270 10 10 CECE NCc1ccc(N2CC(N3CCCCCC3)C2)cc1 698034348 PQYVMBRXOGNGEE-UHFFFAOYSA-N 259.397 2.210 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3[C@H]2CCCN3C)cc1O 720456415 FCLWYZIVJHCHRB-NILFDRSVSA-N 276.380 2.118 10 10 CECE C[C@@H](N[C@H](C)c1ccc(F)cc1O)c1cn(C)nn1 720546442 PVNJFOGQVLCHLT-RKDXNWHRSA-N 264.304 2.072 10 10 CECE CO[C@H]1CC[C@H]1N(C)c1ccc([C@@H](C)N)cc1F 724220374 CYKGRLPBHGCPJA-FZQKWOKYSA-N 252.333 2.459 10 10 CECE COc1ccc([C@H](C)N(C)[C@@H]2CCN(C)C2)c(O)c1 394062164 AQYIOVXUQUXOKG-NWDGAFQWSA-N 264.369 2.098 10 10 CECE CCC1(O)CN(c2ccc(CNC(C)C)c(C)c2)C1 394898728 ALMHZGYKEQZDMN-UHFFFAOYSA-N 262.397 2.454 10 10 CECE CCOC1(C)CN(c2ccc([C@@H](C)N)cc2F)C1 399221914 CEBBGYJFGLRIFH-SNVBAGLBSA-N 252.333 2.461 10 10 CECE Cc1c(N)nc(C(C)C)[nH]c1=NCc1ccc(N)cc1 2173895059 TXGPOIURPBQRME-UHFFFAOYSA-N 271.368 2.107 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](O)C3(CCCC3)C2)cc1O 2174376481 MMFRMPCJNXICLW-IAQYHMDHSA-N 276.380 2.153 10 10 CECE CO[C@@H]1C[C@H]2[C@@H]1CCN2Cc1cc(C(C)=O)ccc1O 2178294088 YGBWKDMIMQYXMT-OFQRWUPVSA-N 275.348 2.204 10 10 CECE CCc1cc(N)n([C@@H](C)c2ccc(OC)cc2O)n1 2070091119 AWGGOYXBHDOFDK-VIFPVBQESA-N 261.325 2.351 10 10 CECE CCc1cnn([C@@H](C)c2cc(OC)ccc2O)c1N 2070246730 IKELRFLELZYIHE-VIFPVBQESA-N 261.325 2.351 10 10 CECE CCNC(=O)[C@H]1CCCN1c1ccc([C@@H](C)N)c(Cl)c1 2169607811 TVCUJSPJZQHNKO-QMTHXVAHSA-N 295.814 2.465 10 10 CECE Nc1ccc(NC(=O)N2CCCO[C@@H]3CCC[C@H]32)cc1 2170170716 FWHJSDYXWCXXMY-ZIAGYGMSSA-N 275.352 2.444 10 10 CECE CN(CCc1ccsc1)C(=O)COc1ccc(N)cc1 2170309278 VPXMOCMDZJQECH-UHFFFAOYSA-N 290.388 2.410 10 10 CECE Cc1nc2n(n1)CCN(c1ccc([C@H](C)O)c(Cl)c1)C2 2170426024 WTFUKSOIYCRLJX-VIFPVBQESA-N 292.770 2.313 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cc(C(N)=O)ccn1 2192601112 USPBOPXDOIHQAQ-JTQLQIEISA-N 271.320 2.084 10 10 CECE C[C@@H](NC(=O)[C@@H]1CNC2(CCC2)C1)c1ccccc1O 2192626480 ZOSQHUDDMZLSRF-NEPJUHHUSA-N 274.364 2.102 10 10 CECE Nc1ccc(OCCC(=O)NOC2CCCCC2)cc1 2193225498 ZYAVGMDWWBUVPV-UHFFFAOYSA-N 278.352 2.418 10 10 CECE CS[C@H]1CC[C@@H](N(C)C(=O)c2cc(O)c(O)c(O)c2)C1 2188874340 GGHNNAVBCKAZIR-ZJUUUORDSA-N 297.376 2.160 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@@]12CCCNC2 2182062007 TWPCYGNBCGLGCF-MLGOLLRUSA-N 276.380 2.377 10 10 CECE C[C@@H](C1CCOCC1)N(C)C(=O)Cc1ccc(N)cc1 2182628918 DYUZAIUMGSFDOV-LBPRGKRZSA-N 276.380 2.085 10 10 CECE CCN[C@H](C)c1ccc(N2CCOC[C@H]2CF)cc1O 2182605453 MVANCAZVOUUFPG-DGCLKSJQSA-N 282.359 2.237 10 10 CECE 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N[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3[C@@H]3C[C@H]43)c(Cl)cc21 2354436321 OPTMXJHVLHWCFC-ORUVIQAWSA-N 289.766 2.137 10 10 CECE COc1cc(N2[C@H]3CC[C@H]2CC(N)C3)cc(OC)c1OC 108033072 PZADJHCLGVRMFE-RYUDHWBXSA-N 292.379 2.171 10 10 CECE N[C@H]1CCCN(c2ccc(OCC3CCOCC3)cc2)C1 52175084 FFEPACBUNJIMQM-HNNXBMFYSA-N 290.407 2.420 10 10 CECE Cc1cc([C@@H]2CNCCN2)c(O)c(Br)c1C 309366594 BIDWKGFFMOPGIQ-JTQLQIEISA-N 285.185 2.005 10 10 CECE COCC(C)(C)CN[C@@H](C)c1c(O)cccc1O 311019200 BWMUQYMSPBXAIK-JTQLQIEISA-N 253.342 2.421 10 10 CECE CCN1CCCN(Cc2cc(C(C)=O)ccc2O)CC1 307868156 NQKOVDOJDCURQB-UHFFFAOYSA-N 276.380 2.122 10 10 CECE CC[C@](C)(CO)NC(=O)/C=C\c1ccc(N(C)C)cc1 211689266 SDMTYHSXVYZULZ-JXMNSVBMSA-N 276.380 2.043 10 10 CECE CCC[C@H](NCc1c(O)cccc1Cl)C(=O)O 128809593 OHRMCUDGHBNYRK-JTQLQIEISA-N 257.717 2.389 10 10 CECE O=C(O)[C@@H]1CCCN1Cc1c(O)cccc1Cl 129407290 GGSPBGLYMXIBHI-JTQLQIEISA-N 255.701 2.095 10 10 CECE CN(CCOCC(F)(F)F)Cc1ccc(N)cc1 49311272 RIYZMMOUGQYBHM-UHFFFAOYSA-N 262.275 2.280 10 10 CECE CC(C)NCc1ccc(N(C)CC[C@@H](C)O)cc1 135582036 SDZSHRRBWLKUKG-CYBMUJFWSA-N 250.386 2.392 10 10 CECE CC(C)CCOCCNCc1cccc(O)c1O 45094359 GSRJJHQKWIBYFN-UHFFFAOYSA-N 253.342 2.250 10 10 CECE OC[C@H]1CCC[C@H]1NCc1cccc(Cl)c1O 224887461 HXOGOIWENGJJHR-ZYHUDNBSSA-N 255.745 2.296 10 10 CECE COc1ccc(O)c([C@@H](C)N2C[C@H](C)N[C@@H](C)C2)c1 225159821 TXFNZFSEIQILIA-SDDRHHMPSA-N 264.369 2.144 10 10 CECE CC(=O)C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 1952744362 PHJQREUMZALCHZ-ONGXEEELSA-N 269.341 2.038 10 10 CECE CCc1nccn1[C@H](C)C(=O)Nc1ccc(N)cc1 48821437 DZOAIOLTHLAVSN-SNVBAGLBSA-N 258.325 2.227 10 10 CECE Oc1c([C@H]2CNCCN2)ccc(Cl)c1Br 95718909 UAEYFZLZPXOUGP-MRVPVSSYSA-N 291.576 2.042 10 10 CECE CC(C)C[C@@H](CN)C(=O)N(C)Cc1ccc(N(C)C)cc1 94698369 CISXNMRFLSSKSS-HNNXBMFYSA-N 291.439 2.332 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCCC[C@@H]1C(=O)O 235175406 GUXCXBYCUDJJRI-NXEZZACHSA-N 265.309 2.098 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCNCC1(C)C 94621968 WDOWLNJSNUHMNQ-JTQLQIEISA-N 252.333 2.276 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])C1CCC(C)CC1 90256732 HLHCWJSVOMEDGO-VQXHTEKXSA-N 254.334 2.254 10 10 CECE CCC[C@H](N)[C@@H](N)c1cc(Br)ccc1O 95841619 UPUXQDUPOLKLET-ONGXEEELSA-N 273.174 2.282 10 10 CECE Oc1ccccc1CNC[C@H](n1cccn1)C(F)(F)F 527746578 VRYPCEKEUYRMKJ-LBPRGKRZSA-N 285.269 2.482 10 10 CECE CCN1CC[C@H](CN)[C@H]1c1ccc2c(c1)CCN2C 250309796 LQOZRQVBHUACGO-GDBMZVCRSA-N 259.397 2.021 10 10 CECE CN(C)c1ccc(-c2nc3c(o2)COCC3=O)cc1 606595104 KXMRFFVAFUSXFK-UHFFFAOYSA-N 258.277 2.121 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@@]3(CN)C2)cc1OC 2162633519 ZDYMKEARPZPUPX-BLLLJJGKSA-N 276.380 2.269 10 10 CECE CC[C@@H]1CCOCC[C@H]1NC(=O)Cc1ccc(N)cc1 2165387962 NXXDRIACOXIDKB-UKRRQHHQSA-N 276.380 2.133 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H](O)C1CCCC1 2167583556 KGMXNCHEOFCRII-INIZCTEOSA-N 278.396 2.131 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1[C@@H]2CCCN[C@@H]21 2163091940 MMGDQNZKYZNAIC-VVLHAWIVSA-N 272.392 2.318 10 10 CECE Cc1cc([C@H](O)[C@H](N)c2ccc(N(C)C)cc2)ccn1 2163136763 WRNYPWGUGJFFKH-CVEARBPZSA-N 271.364 2.189 10 10 CECE CN1CCc2cc([C@H](NN)[C@@H]3C(C)(C)C3(F)F)ccc21 2163143099 JWUQBSUEBDPKBW-QWHCGFSZSA-N 281.350 2.475 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@@]1(O)CCSC1 2163230307 NXRHEVMEXRVJBY-JKSUJKDBSA-N 292.448 2.198 10 10 CECE COc1ccc(N(CCCN)C[C@@H]2C[C@@H](C)CO2)cc1 2166383568 RFRDZKOOOHKOIZ-CJNGLKHVSA-N 278.396 2.275 10 10 CECE CC(=O)C(=O)COC(=O)C[C@@H](C)c1ccc(F)cc1 808517811 OAMDALCCMNCMML-SECBINFHSA-N 266.268 2.021 10 10 CECE Nc1ccc(N2CCN(CCc3ccns3)C2=O)cc1 719815724 IEZWXTSAPFMKCE-UHFFFAOYSA-N 288.376 2.210 10 10 CECE C[C@H](N[C@H]1CNCC[C@@H]1C)c1ccc(N(C)C)cc1 817968704 WFRCLRFWKARZHN-XEZPLFJOSA-N 261.413 2.401 10 10 CECE C[C@H](N[C@@H]1CCCCNC1)c1cc(F)ccc1O 817984441 SUUMWGRKAXASEY-CMPLNLGQSA-N 252.333 2.324 10 10 CECE CCCN1C[C@H]2C[C@H]1CN2c1ccc([C@H](C)N)cc1 2131053595 JYLKPLWZASGTKO-VBNZEHGJSA-N 259.397 2.379 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CC23CC3)c1 817549674 OGRSOHFFANOQFG-BXKDBHETSA-N 261.321 2.378 10 10 CECE CC[C@H](CNCc1cc(Cl)cc(F)c1O)C(=O)O 903704779 DWFJTJQRLBYSMH-SSDOTTSWSA-N 275.707 2.385 10 10 CECE CN(Cc1c(O)cccc1Cl)CC1COCCOC1 2131484107 DHESWFUEDZFTFA-UHFFFAOYSA-N 285.771 2.140 10 10 CECE COC[C@@H]1C[C@@H]1NCc1cc(Br)ccc1O 1895277482 VKRLZGFEVXREQJ-ONGXEEELSA-N 286.169 2.279 10 10 CECE O=C(c1cc(O)cs1)N1[C@H]2CC[C@H]1c1c[nH]nc1C2 913258613 ANCRAQQKWZGVIM-CPCISQLKSA-N 275.333 2.079 10 10 CECE COc1ccc(CN[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)cc1C 742392553 QPKMECXAPRPNCZ-KCPJHIHWSA-N 288.391 2.103 10 10 CECE C[C@H](NC(=O)CN1CC(C)(C)C1)c1ccc(N(C)C)cc1 847762033 XGOUTINWAJGPNP-ZDUSSCGKSA-N 289.423 2.272 10 10 CECE COCC1(CCNCc2cc3c(cc2O)OCO3)CC1 842728443 FRKKIJGLSPXJFT-UHFFFAOYSA-N 279.336 2.027 10 10 CECE O=C1CN(Cc2c(O)ccc3ccccc23)CCN1C1CC1 748271428 WVMNNENDJIYLSE-UHFFFAOYSA-N 296.370 2.352 10 10 CECE O=C(c1cc(O)cs1)N1CCC[C@H]([C@H]2CCOC2)C1 749296942 IJEIFDSNLQICEB-QWRGUYRKSA-N 281.377 2.342 10 10 CECE C[C@@H]1C[C@H](N[C@@H]2CCc3cccc(O)c32)c2ncnn21 850499804 XTBXZMPHRVKOBS-JLLWLGSASA-N 270.336 2.267 10 10 CECE Cc1[nH]nc(C(=O)NCc2cc(Cl)ccc2O)c1C 857547877 YHLCLWRXBAIYKN-UHFFFAOYSA-N 279.727 2.316 10 10 CECE Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)C=C1CCNCC1 852841679 IRFSNBRVPOOGCP-ZDUSSCGKSA-N 286.375 2.419 10 10 CECE Cc1cc(O)nc(C(=O)NCc2cc(Cl)ccc2O)c1 857548540 MUPQLTAJTVFZCT-UHFFFAOYSA-N 292.722 2.385 10 10 CECE CCOc1ccc(N2CC[C@@H]2CN)cc1OCC 696353387 GLRBZBHRSFXTEE-GFCCVEGCSA-N 250.342 2.021 10 10 CECE CC[C@H](NC[C@H]1CN(C)C[C@@H](C)O1)c1ccccc1O 697320994 KSOJBKWHOFTYFI-IPYPFGDCSA-N 278.396 2.152 10 10 CECE CN(Cc1c(O)cccc1Br)CC1CN(C)C1 862412940 DLNKZHVXUBHAPT-UHFFFAOYSA-N 299.212 2.148 10 10 CECE CC[C@@H]1NCC[C@H]1NCc1cc(Cl)cc(F)c1O 863481387 GFIRVRTZAJZUDA-NWDGAFQWSA-N 272.751 2.415 10 10 CECE CC(C)Cn1cc(C(=O)N2Cc3cccc(O)c3C2)cn1 871204894 RXYLHCLMUIAJJG-UHFFFAOYSA-N 285.347 2.401 10 10 CECE Cc1ccc(/C=C/C(=O)NCc2ccc(O)c(O)c2)cn1 778916497 JBROAGSRZGVORP-FNORWQNLSA-N 284.315 2.131 10 10 CECE CN(C)c1ccc(CN2CCSC[C@@H]2CCO)cc1 770306359 OWCBQNBJBKOWNT-HNNXBMFYSA-N 280.437 2.052 10 10 CECE NCc1ccc(N2CCO[C@H](CCF)C2)cc1Cl 700583873 CGHNSWICILTKJM-GFCCVEGCSA-N 272.751 2.364 10 10 CECE CN(C)c1ccc2c(c1)[C@H](CN)N(Cc1ccccn1)C2 82701815 YTILZJAOHQIIBJ-KRWDZBQOSA-N 282.391 2.163 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2c1cccnc1Cl 83656207 FKCKKPFVCLMBOU-LBPRGKRZSA-N 276.723 2.381 10 10 CECE Cc1cc(O)c2c(c1)[C@@H](c1cc(O)ccc1O)NCC2 83625980 XEDKVTHMMDQOSV-INIZCTEOSA-N 271.316 2.347 10 10 CECE CC(C)[C@H]1CN(CC(=O)O)c2cc3c(cc21)OCCO3 84804601 XLFVRVYRRCACSA-LLVKDONJSA-N 277.320 2.102 10 10 CECE COc1cc(N)c(N2CC[C@@H](OC(C)C)C2)cc1OC 701816293 BCRKMJCVGAARBG-LLVKDONJSA-N 280.368 2.290 10 10 CECE COc1cc(C)cc(CN[C@@](C)(CO)C(C)C)c1O 894793793 IWDOARNIBBQICY-HNNXBMFYSA-N 267.369 2.206 10 10 CECE COc1ccc([C@H](C)N[C@@H]2CCCN(C)C2)c(O)c1 40672579 LQRNRFVJFKESBW-NWDGAFQWSA-N 264.369 2.146 10 10 CECE C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2c1ccc(CO)cc1F 686171398 ZZTNPOAOIYCOGE-YYWQGFNFSA-N 265.328 2.056 10 10 CECE CCSC[C@H](C)N(C)C[C@H](O)COc1ccc(N)cc1 687962419 PXZLWGKBTBCLLV-JSGCOSHPSA-N 298.452 2.082 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@]2(CCCS2(=O)=O)C1 708632442 SMIWIRIHVUDLBR-SWLSCSKDSA-N 295.404 2.106 10 10 CECE Cc1ccncc1CN(C)C(=O)/C=C/c1ccc(O)c(O)c1 794198090 NTHMHQLPQUMZPX-GQCTYLIASA-N 298.342 2.473 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])c1csnc1OC 712894367 MBXSDLFGKAAXIE-SECBINFHSA-N 299.356 2.046 10 10 CECE Cc1ccc(O)c([C@H](C)NCC[C@@H]2CCCS2(=O)=O)c1 714352756 UZIQUGDHTZXEKY-STQMWFEESA-N 297.420 2.319 10 10 CECE CN(CCc1ccc(N)cc1)[C@@H]1CO[C@H](C2CC2)C1 691766592 NJRRLONWDNRMAM-HOTGVXAUSA-N 260.381 2.311 10 10 CECE COCCN(c1ccc(CN)c(Cl)c1)C1CCOCC1 716363920 PSWKTHJNHPVNLE-UHFFFAOYSA-N 298.814 2.431 10 10 CECE CO[C@@H](CNCc1cccc(O)c1O)C1CCC1 692870483 FSPREMSGCMCYFD-ZDUSSCGKSA-N 251.326 2.003 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)CCC(F)(F)F 88416545 NUIHRSAENYWUDY-VIFPVBQESA-N 289.301 2.480 10 10 CECE CNC(=O)[C@@H](CC(C)C)N[C@@H](C)c1cc(F)ccc1O 94617566 CICKAIXNVVFOOI-GXFFZTMASA-N 282.359 2.343 10 10 CECE COC[C@H](C)CC(=O)N(Cc1ccc(N)cc1)C1CC1 95033817 MCOIGJQCDJWCOL-GFCCVEGCSA-N 276.380 2.432 10 10 CECE CCCNCc1ccc(N2CC(F)(CO)C2)c(Cl)c1 2116283447 XOHKYTZBRZMTFE-UHFFFAOYSA-N 286.778 2.360 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@@H](CO)C2)cc1O 226455600 SCBFRTJOJLEQQI-CHWSQXEVSA-N 278.396 2.271 10 10 CECE C[C@H](O)c1ccc(N(C)C2(C)CCOCC2)cc1O 2118404699 RLZKNPARTQADBL-NSHDSACASA-N 265.353 2.451 10 10 CECE COC[C@H]1CN(c2ccc(CN)c(F)c2F)C[C@@H]1C 2118637591 SWNMNGPSZWLWFQ-GXSJLCMTSA-N 270.323 2.142 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H](c3ncc[nH]3)C2)c1O 2125153906 ZYGGNQXMZLPDTR-BETUJISGSA-N 257.337 2.460 10 10 CECE N[C@@H]1CCCc2cc(N3CCC[C@@H](CO)C3)ccc21 2128279158 MEFRTAACZFCOCH-MLGOLLRUSA-N 260.381 2.231 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3N)CC[C@@H]1O 2128273724 XKDZOMHJYFTBAF-RLCCDNCMSA-N 260.381 2.230 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@H]4COCC[C@H]43)ccc21 2128320325 BJUOZPBPVRLLCO-APHBMKBZSA-N 259.349 2.281 10 10 CECE CC(C)[C@H]1[C@@H](O)CCN1c1ccc2c(c1)CC[C@H]2N 2128314134 BOTFAKVQMDBTSV-PMPSAXMXSA-N 260.381 2.228 10 10 CECE 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2.372 10 10 CECE CN1CC[C@H]2[C@@H]1CCCN2c1ccc2c(c1)CC[C@H]2N 2184729016 DXCOPUGGORXEKS-IKGGRYGDSA-N 271.408 2.306 10 10 CECE CON1CCC(N(C)c2ccc3c(c2)CC[C@H]3O)CC1 2184731607 KOPGIRRIBXNEEI-MRXNPFEDSA-N 276.380 2.128 10 10 CECE CCCNCc1ccc(N(C)C[C@H](O)CC)cc1 2044560424 GAHOHQIBAGEBTD-OAHLLOKOSA-N 250.386 2.393 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H](NC(=O)Nc3ccc(N)cc3)C[C@@H]21 2190419004 BSLGXYPESNHZMW-NZPIUUIZSA-N 275.352 2.204 10 10 CECE C[C@H]1CC(F)(F)CN1CCOc1ccc(N)cc1 2052003579 PUGLALZQUOOJHO-JTQLQIEISA-N 256.296 2.377 10 10 CECE C[C@@H]1C[C@H]1N(C)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 2052746122 GIGZLGTXYXHKCB-KXHDPYLZSA-N 265.744 2.137 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@@H](N)CC(C)(C)O2)cc1 2194402231 ZOMSKFCGWHYSNU-IUODEOHRSA-N 278.396 2.416 10 10 CECE CN(CCOc1ccc(N)cc1)[C@@H]1CCC[C@H]1F 2055365630 KHHHGAJWOSARCJ-ZIAGYGMSSA-N 252.333 2.470 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c(F)c1 2194518742 PMTYCGUBJOQFGF-HJUHTLPRSA-N 282.334 2.014 10 10 CECE 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[N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)C1CC2(CCOC2)C1 2225792676 PDHHHFLHOWNCPJ-PCQVFGIUSA-N 264.329 2.151 10 10 CECE CCCNCc1cc(OC)ccc1N(C)[C@@H]1CCOC1 2235953650 DRDNLMQWDDBCOY-CQSZACIVSA-N 278.396 2.420 10 10 CECE COc1ccc(N2CCC[C@H]3[C@@H]2CCN3C)c(C=O)c1 2235986757 NXWIBRIMGJVNIL-HOTGVXAUSA-N 274.364 2.181 10 10 CECE COCCN(c1ccc(OC)cc1CN)[C@H]1CCSC1 2235963113 LAPYRGIIAWLVKL-ZDUSSCGKSA-N 296.436 2.112 10 10 CECE COc1ccc(N2CCCC[C@@H](N(C)C)C2)c(C=O)c1 2236005731 XVGBVIRQLGPSKE-CQSZACIVSA-N 276.380 2.428 10 10 CECE COc1ccc(N2CC[C@@H](COC(C)C)C2)c(CO)c1 2236003274 QOUFOWFHRALYET-CYBMUJFWSA-N 279.380 2.439 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@H]3CC[C@H]2O3)c(C(=O)O)c1 2236277292 HCPXKNWGUORXDD-LERXQTSPSA-N 277.320 2.150 10 10 CECE CCNCc1ccc(N2C[C@H](O)C[C@@H](F)C2)cc1Cl 2226292288 ZGWGXOVBXHMBIH-DGCLKSJQSA-N 286.778 2.359 10 10 CECE CC(C)NCc1ccc(N2C[C@@H](F)C[C@@H](O)C2)cc1 2226317326 ORCTXQQUJUUGNQ-DZGCQCFKSA-N 266.360 2.094 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3CCC[C@H]2CN(C)C3)cc1 2226361716 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10 10 CECE COC(OC)[C@@H](C)NCc1c(O)cccc1Cl 127331482 JVDIECHVBDITEE-MRVPVSSYSA-N 259.733 2.143 10 10 CECE c1cc(N2CCOCC2)ccc1CNCC[C@@H]1CCCO1 37996925 VVMRVRKAIHMYOY-KRWDZBQOSA-N 290.407 2.182 10 10 CECE C[C@@H]1C[C@@H]1NC(=O)NCc1ccc(N2CCCC2)cc1 75978531 LUGNJUFJRLERMV-DOMZBBRYSA-N 273.380 2.494 10 10 CECE CC(=O)c1cc(F)cc(CN[C@H](C)[C@@H]2CCCO2)c1O 183156233 TVDKZKOANLDHAI-OTYXRUKQSA-N 281.327 2.391 10 10 CECE CN[C@H]1CCN(c2cc(OC)c(OC)c(OC)c2)C[C@@H]1C 49694292 FGZFFGJHGWENKQ-AAEUAGOBSA-N 294.395 2.147 10 10 CECE C[C@H](N[C@H](C)[C@@H](C)CO)c1ccc(N(C)C)cc1 131720591 XUKZZWOXKFOWCO-XQQFMLRXSA-N 250.386 2.420 10 10 CECE COc1cc(N)c(N(C)[C@H]2CCCC[C@@H]2O)cc1OC 131132740 GNBOGRYHARTVJN-AAEUAGOBSA-N 280.368 2.026 10 10 CECE COCC[C@H](C)N[C@H](C)c1ccc(OC)cc1O 81707730 HLKXGJZVSPUJKM-WDEREUQCSA-N 253.342 2.476 10 10 CECE CCCNCc1ccc(N2CCCC[C@@H]2C(=O)NC)cc1 42423983 KDBNPFYTNHKWCF-MRXNPFEDSA-N 289.423 2.291 10 10 CECE CCN[C@](C)(CN(C)c1ccc(OC)cc1)C(=O)OCC 49972060 RKIWPCCTJXFPQR-MRXNPFEDSA-N 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[N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@H]1CCCC[C@H]1C(=O)O 2234172637 UQOFMYXRVFNRFC-GARJFASQSA-N 280.328 2.179 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)C2=C(C(=O)O)CCCC2)C1 2234171032 IYZGFNWBMARKSZ-VIFPVBQESA-N 278.312 2.100 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@H](F)C2)c(F)c1 2234673039 KFCGSWPJCALAHY-DRZSPHRISA-N 284.350 2.405 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCCN[C@@H](C)C2)c1 2224769297 LTZHUYXUVVZHGA-NWDGAFQWSA-N 264.369 2.146 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1OC[C@H]2CCC[C@@H]21 2224957316 GIXQMYOQSWPMHJ-ZLDLUXBVSA-N 265.328 2.436 10 10 CECE COc1ccc(N2CCO[C@H](C(C)(C)C)C2)c(CN)c1 2235953665 DVJAKGQEFUWHFD-HNNXBMFYSA-N 278.396 2.405 10 10 CECE COc1ccc(N(C)Cc2cc(Cl)n(C)n2)c(CN)c1 2235970365 PAVPEIREISBVOD-UHFFFAOYSA-N 294.786 2.177 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2CC(CO)C3)c(C=O)c1 2235994569 KFSXMMYEFVSKAY-KBPBESRZSA-N 275.348 2.247 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2CC12COCC(C1)C2 2236356780 WLOJJUFEOIXFPC-POZPTJLLSA-N 272.392 2.495 10 10 CECE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2CN(C)C3)c(F)c1 2226368517 MJUZZOVVKKKUKT-WCFLWFBJSA-N 263.360 2.128 10 10 CECE OCC1[C@@H]2CN(c3ccc(OC(F)(F)F)cc3)C[C@@H]12 2226542786 YDVHMTJZPSLWCW-GHMZBOCLSA-N 273.254 2.260 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCCO3)C[C@]1(C)CO 2226664537 GXQBSETYXHKMBM-MLGOLLRUSA-N 261.365 2.466 10 10 CECE COc1ccc(N(C)CC[C@H](C)OC)c(C(=O)O)c1 2227669523 DBXOHWIDQMYLQX-JTQLQIEISA-N 267.325 2.255 10 10 CECE COc1ccc(N2C[C@H](C)C[C@@H](O)[C@@H]2C)c(C=O)c1 2227696342 NCQRNWJNYOFLIG-JRPNMDOOSA-N 263.337 2.103 10 10 CECE CN(C)[C@H]1CN(CCc2ccc(N)cc2)CC1(C)C 2228104726 NYTQQLIIJHGVCH-HNNXBMFYSA-N 261.413 2.083 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H](N(C)C)C(C)(C)C1 2228107205 YMKLSXWPBLCFFU-OAHLLOKOSA-N 262.397 2.264 10 10 CECE Cc1cc(N2C[C@H](N(C)C)C(C)(C)C2)ccc1CO 2228105388 PPUGQKBBUIXRPW-HNNXBMFYSA-N 262.397 2.264 10 10 CECE Nc1ccc(N2CCN(C[C@@H]3C[C@@H]3CF)C2=O)cc1 2228667453 DMKJUNHEOJHIBX-MNOVXSKESA-N 263.316 2.116 10 10 CECE CCCN(CC(=O)N(C)C)c1ccc([C@@H](C)N)cc1C 2240845377 BNQDVNNWZMPFRH-CYBMUJFWSA-N 277.412 2.319 10 10 CECE CCN(CC)C(=O)CN(C)c1ccc([C@@H](C)O)cc1C 2240829887 KSQZYOHETAGYKI-CYBMUJFWSA-N 278.396 2.353 10 10 CECE CN[C@@H](CNCc1cnc(SC)s1)C(C)C 2243856662 PMPIFGIQPOMIAC-JTQLQIEISA-N 259.444 2.199 10 10 CECE CC[C@@]1(CO)COCCN1c1c(C)cc(OC)cc1C 2285073372 XSKAKWQLUAOAGA-MRXNPFEDSA-N 279.380 2.290 10 10 CECE CCCNCc1cnc(S[C@H]2CC[C@@H]2O)s1 2245953477 ZTKSRRCDNANVMQ-UWVGGRQHSA-N 258.412 2.258 10 10 CECE CN(c1ccc(OC(F)F)cc1)[C@H]1CNCC12CC2 2278475507 IJEVOLSVLLFZBE-LBPRGKRZSA-N 268.307 2.476 10 10 CECE CN(C)c1ccc([C@]2(O)CN[C@@H]3CCCC[C@@H]3C2)cc1 2279695953 NRBTWYDOBLXFIC-KBRIMQKVSA-N 274.408 2.492 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC[C@@H]2CCNC[C@H]21 2290247837 LGOGHUJTTZCGBS-QMTHXVAHSA-N 282.334 2.244 10 10 CECE N[C@H]1CCN(Cc2c(O)cccc2F)[C@H](C(F)(F)F)C1 2281179266 RIMIXATZPRZFEM-UFBFGSQYSA-N 292.276 2.385 10 10 CECE COC[C@]1(C)[C@@H]2C[C@H]2CN1c1ccc([C@@H](C)O)c(O)c1 2284509382 VVAPIEOHPWXWGL-YHYOWMERSA-N 277.364 2.307 10 10 CECE Cc1cc(N(C)CC2COCCOC2)ccc1[C@H](C)N 2285122708 WNHHDEDQQASGCK-ZDUSSCGKSA-N 278.396 2.114 10 10 CECE Cc1cc(N2CCOC(C)(C)[C@H]2CO)ccc1[C@@H](C)O 2285160346 KEGPGOOYRGORNP-IUODEOHRSA-N 279.380 2.024 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](C3CC3)C2)cc1C 2285136285 VOUHKELABVEGFT-OAUYIBNBSA-N 274.408 2.483 10 10 CECE COc1ccc(N2C[C@@H](O)C3(CCC3)C2)c(OC)c1C 2295466594 HJFGDLQZGNVNEB-CQSZACIVSA-N 277.364 2.363 10 10 CECE Cc1cccc(O)c1CNc1nn(C)nc1Br 2303350185 STFURGJSXZOMRF-UHFFFAOYSA-N 297.156 2.204 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)[C@H]1CC[C@@H]2C[C@@H]2C1 2309507348 FJXNGRAVZBUAQV-YTWAJWBKSA-N 252.318 2.166 10 10 CECE CCN(CCN=[N+]=[N-])C[C@H]1CC[C@@H](C(=O)OC)C1 2315986606 GBCDFZBORUUOIB-WDEREUQCSA-N 254.334 2.208 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2C[C@@H]3C[C@@H](N)[C@@H]3C2)cc1 2333002839 LACGPUPXFAYXGR-IPQWEPCOSA-N 260.381 2.159 10 10 CECE Nc1ccc(CN2[C@@H](CO)C[C@H]3CCCC[C@H]32)cc1 2333965508 ZLUJLSSEYBDLRN-FVQBIDKESA-N 260.381 2.394 10 10 CECE CN(Cc1ncno1)c1ccc(CN)c(C2CC2)c1 2339157526 KIRCYSYVUDZPHX-UHFFFAOYSA-N 258.325 2.042 10 10 CECE Cc1c([C@H](C)N)ccc(N2CCC=C[C@@H]2CO)c1C 2341065639 SMXZIMMCODYEEF-UONOGXRCSA-N 260.381 2.450 10 10 CECE Cc1ccc(CN2C[C@@H]3C[C@H]2C[C@H]3N(C)C)c(O)c1 2341130465 BGVYCPRMCHUGNL-SOUVJXGZSA-N 260.381 2.225 10 10 CECE C[C@H](O)c1cc(F)c(N(C)[C@@H](C)CN(C)C)c(F)c1 2351786148 NMWVMJXJZDNNET-UWVGGRQHSA-N 272.339 2.404 10 10 CECE Nc1ccc(OCCC(=O)OC[C@H]2C[C@@H](F)C2)cc1 2352252898 BWQOETIUGPYKNO-PHIMTYICSA-N 267.300 2.329 10 10 CECE CSc1cc(N2C[C@@H](C)C[C@H](CO)C2)ccc1CN 2353852139 RCJJXYHJFXWDOK-RYUDHWBXSA-N 280.437 2.322 10 10 CECE CN(C[C@H]1C[C@@H]2OCC[C@@H]2O1)c1ccc(CN)cc1Cl 2354620831 JBZKLHPBLZTLMF-UGFHNGPFSA-N 296.798 2.181 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@H]1C[C@@H]2C[C@@H]2CO1 2355831170 WORQXXLASPEUOZ-ABFRBSLYSA-N 272.392 2.364 10 10 CECE CCCN[C@@H](C)CN1CCN(c2ccc(OC)cc2)CC1 59260797 IUBKHDPDKQRJCF-HNNXBMFYSA-N 291.439 2.205 10 10 CECE C[C@H](NC[C@@H](O)CN1CCCCC1)c1ccc(F)cc1O 185114942 MRLUALLZLQWTKW-GXTWGEPZSA-N 296.386 2.029 10 10 CECE N[C@H](CCCC(=O)O)c1cc(Br)ccc1O 309224915 DAGBULOEFFQBSJ-SECBINFHSA-N 288.141 2.409 10 10 CECE C[C@@H](NC(=O)[C@@]1(N)CCC[C@@H]2C[C@@H]21)c1ccccc1O 2357205453 KKOVIPCULKLHSY-RLSLPTNOSA-N 274.364 2.087 10 10 CECE CCN1CCc2cc([C@@H](O)C(C)(C)C(=O)O)ccc21 1952247700 MSPPSJZVGKWJCC-CYBMUJFWSA-N 263.337 2.213 10 10 CECE CC(C)(C)OC(=O)Nc1cccc(O)c1CNO 1952296437 HZPZXSVHFGAOFD-UHFFFAOYSA-N 254.286 2.218 10 10 CECE O=C(O)[C@@H]1CCC[C@@H]1CNCc1cc(F)ccc1O 236440726 NAVFVMHQXMUFFX-BXKDBHETSA-N 267.300 2.122 10 10 CECE Cc1cc(Br)c(O)c(O)c1CN(C)C 218383521 LBTPONAOSOMEBH-UHFFFAOYSA-N 260.131 2.230 10 10 CECE C[C@H](CN(C)C)NCc1cccc(Br)c1O 130143048 MPDAKXIEOQLJJV-SECBINFHSA-N 287.201 2.194 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H](C(N)=O)CC[C@@H]2C)cc1 226951067 BQKWSTVCTARYBR-SGMGOOAPSA-N 275.396 2.057 10 10 CECE CC(C)(C(=O)O)[C@H]1CCCN(Cc2ccc(O)c(O)c2)C1 135048042 DFYGUQZODOMRSF-LBPRGKRZSA-N 293.363 2.421 10 10 CECE CN(CC(F)(F)F)c1ccc(CN)c(F)c1F 234264238 KPQJSJPQXRMTDL-UHFFFAOYSA-N 254.202 2.422 10 10 CECE Cc1ccc([C@H](NCCN=[N+]=[N-])C(N)=O)cc1Cl 235816627 UUXKRMCPEQFVKG-JTQLQIEISA-N 267.720 2.075 10 10 CECE COc1ccc(N(C)C[C@@H](CN)C(F)(F)F)cc1 234864618 WITHQYBSVQLUIU-SECBINFHSA-N 262.275 2.269 10 10 CECE CCCNCc1ccc(N2CCN(C)CC2)c(C)c1 50559741 ZEHLAIGEJQMMGH-UHFFFAOYSA-N 261.413 2.246 10 10 CECE CN(C)c1ccc(CNC(=O)[C@]2(C)C[C@H]3CC[C@H]2O3)cc1 248821343 FFHAFMPXECRJLR-BFYDXBDKSA-N 288.391 2.326 10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)C(=O)Cc1ccc(N)cc1 1952751040 GYCVALJBSIAYPC-SNVBAGLBSA-N 278.352 2.294 10 10 CECE NCC1(c2cc(Br)c(F)c(O)c2O)CCC1 258484979 IYASNSLWPVANDC-UHFFFAOYSA-N 290.132 2.380 10 10 CECE Oc1ccc(F)cc1CN1CCO[C@@H](C2CC2)C1 368414358 UDFDGZVXYYCQMU-CQSZACIVSA-N 251.301 2.142 10 10 CECE CC1(C)CN(Cc2ccccc2O)C[C@@]2(CCOC2)O1 280248352 KYLBLBUOTHDSMK-MRXNPFEDSA-N 277.364 2.162 10 10 CECE Oc1cc(F)c(Cl)cc1CNCCN1CCCC1 293765337 ZKYYOADYUQCIMX-UHFFFAOYSA-N 272.751 2.370 10 10 CECE CCCNCc1ccc(N2CC([C@H](F)CO)C2)c(C)c1 2166899119 KNGVPJINUPOMNY-OAHLLOKOSA-N 280.387 2.261 10 10 CECE CCOc1cccc(CN[C@H]2CN(C)CC2(C)C)c1O 722312438 VHIGKYZROKLZPQ-AWEZNQCLSA-N 278.396 2.221 10 10 CECE COc1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3CN2)c(F)c1 2162660990 WSOLQFTUMORCNX-MUYACECFSA-N 276.355 2.269 10 10 CECE CO[C@H](C)[C@@H](C)NC(=O)NCc1ccc(N(C)C)c(F)c1 290914429 JDMFPHQMCUKMIT-GHMZBOCLSA-N 297.374 2.114 10 10 CECE CCN1CCc2cc([C@@](C)(N)c3cn(C)cn3)ccc21 2163065445 ACAGRCKLHWKKGS-MRXNPFEDSA-N 270.380 2.025 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@]12CC[C@@H]1CNC2 2163095950 VDQOMTWQUTYVAQ-OIISXLGYSA-N 272.392 2.320 10 10 CECE CCCc1nnsc1[C@H](NN)c1ccc(N(C)C)cc1 2163110321 HSOJFLUJMYAUSP-CYBMUJFWSA-N 291.424 2.109 10 10 CECE COc1ccc(CNC2(CO)CC3(CCC3)C2)c(O)c1 2163544989 DRSVKWVZPIAUNT-UHFFFAOYSA-N 277.364 2.186 10 10 CECE Nc1ccc(NC(=O)CCN2CC3CC(F)(C3)C2)cc1 2163735785 MZUILDLIIYYOGS-UHFFFAOYSA-N 277.343 2.031 10 10 CECE CCN(CC)c1ccc([C@H](N)C2(S(C)(=O)=O)CC2)cc1 2167894444 JTQLWTBWGSUEGZ-AWEZNQCLSA-N 296.436 2.110 10 10 CECE CCOc1ccc(CN2CCC[C@@H](C)[C@H]2C(=O)O)c(O)c1 818631025 AGOMPPBHQCUDRM-ABAIWWIYSA-N 293.363 2.476 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CC[C@H]2C[C@@H]2C1 817550525 WQIIBFWNQBQZNC-QJPTWQEYSA-N 261.321 2.150 10 10 CECE CSc1sc2cccc([C@@H](O)C(=O)O)c2c1O 725307664 HKPOPUIWYOGQIU-MRVPVSSYSA-N 270.331 2.447 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H]2CN(C)CC2(C)C)c1 722309800 MXJLCNUDDQWRBN-IAQYHMDHSA-N 278.396 2.392 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@](C)(C(N)=O)C2)c(Cl)c1 723158127 IVMHAKARWVRRRX-BONVTDFDSA-N 295.814 2.322 10 10 CECE Cc1cccc(CN2CC[C@H](C(F)(F)F)[C@@H](N)C2)c1O 903983442 IIRAHRXKYKKURG-RYUDHWBXSA-N 288.313 2.412 10 10 CECE CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]2CS3)cc1 837380531 QOEJHGXCRZAPLC-KBPBESRZSA-N 291.420 2.152 10 10 CECE CN(C[C@@]1(C)CCOC1)C(=O)Nc1ccc(N)cc1 687507585 GLSVPYIJETWJAS-CQSZACIVSA-N 263.341 2.159 10 10 CECE Cn1nc2c(c1CNC(=O)Nc1ccc(N)cc1)CCCC2 841299294 IRNKALPTMGCTAO-UHFFFAOYSA-N 299.378 2.203 10 10 CECE C[C@H](NC[C@@H]1CNC[C@H]1C)c1ccc(N(C)C)cc1 925790561 ISWPUUKSPNCHEI-IPYPFGDCSA-N 261.413 2.259 10 10 CECE CO[C@@H]1CCC[C@H]([C@H](CO)NCc2cc(C)ccc2O)C1 850353490 DQGLJYIZKYTUQB-IMJJTQAJSA-N 293.407 2.356 10 10 CECE Cn1cc(/C=C2\SC(=S)N(C3CC3)C2=O)c(Cl)n1 856720077 ZRXSQZZYIZMIAB-YWEYNIOJSA-N 299.808 2.437 10 10 CECE CCOc1cccc(COC(=O)c2cccc(O)c2O)n1 758560744 KLXLXWOOXUMFCP-UHFFFAOYSA-N 289.287 2.249 10 10 CECE COC[C@H](C)OC(=O)NCc1ccc(N(C)C)cc1 866424721 KZQNYKSQQREWND-NSHDSACASA-N 266.341 2.014 10 10 CECE CN(CCCCO)Cc1c(O)cccc1Br 862339463 VCODBWJKRZWSCV-UHFFFAOYSA-N 288.185 2.359 10 10 CECE Cc1ccc([C@@H]2NC(=O)N(Cc3ccc(N)cc3)C2=O)cc1 57848752 OOZTZYAOPJRPEB-HNNXBMFYSA-N 295.342 2.370 10 10 CECE COc1ccccc1NC[C@H](O)C[C@](C)(O)C1CC1 872210204 QIANPIGRPXYZCF-DOMZBBRYSA-N 265.353 2.019 10 10 CECE CCC[C@H](N[C@H](C)Cc1ccc(N)cc1)C(=O)O 71428756 WVIUGIYJNMLELA-MFKMUULPSA-N 250.342 2.043 10 10 CECE Nc1ccc(Cn2c(CC(=O)O)nc3ccc(F)cc32)cc1 76005569 GUVZZJNXWRDVFK-UHFFFAOYSA-N 299.305 2.433 10 10 CECE Oc1c(Cl)cccc1CNC[C@H]1CN2CCC1CC2 1474735911 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COc1ccc(N2CC[C@H](OC)[C@@H](C)C2)c(CN)c1 2227674647 XBETWCLOJGDNBS-NHYWBVRUSA-N 264.369 2.015 10 10 CECE CC(=O)c1ccc(O)c(CN2CC[C@@H](OC(F)F)C2)c1 2238856065 WRGFMXXUVOXIBK-GFCCVEGCSA-N 285.290 2.408 10 10 CECE C[C@H](CO)CC1CN(c2ccc3c(c2)CCC[C@H]3N)C1 2239144790 PEMUSHZTANJCJU-YVEFUNNKSA-N 274.408 2.477 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)C[C@@]1(F)CCOC1 2229941196 UTRQXTFVKOVVHE-HZMBPMFUSA-N 269.316 2.219 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCS(=O)(=O)[C@@H](C)[C@H]1C 2240761733 PVLGNHKQXZZGCC-XQQFMLRXSA-N 296.436 2.027 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3[C@H](C2)[C@@H]3CO)c(C)c1 2240750874 FXNIKMCAKPRTIK-SYAUCNOPSA-N 274.408 2.340 10 10 CECE CCc1ccsc1[C@H](NCCCN=[N+]=[N-])C(N)=O 2255978137 LINGFUFWJBNXKY-VIFPVBQESA-N 267.358 2.127 10 10 CECE CCCC1(OC(=O)Nc2ccc(N)cc2)COC1 2260091317 MCERJYJFTFDNIY-UHFFFAOYSA-N 250.298 2.386 10 10 CECE COc1ccc(N)c(C(=O)NCCCCN=[N+]=[N-])c1 2271361361 MTLFGTSDSFCZIG-UHFFFAOYSA-N 263.301 2.098 10 10 CECE CN[C@@H](COc1ccc(N)cc1)Cc1ccccc1 2279029243 ATVLTXAPVISQFP-OAHLLOKOSA-N 256.349 2.478 10 10 CECE CSc1ncc(CNC(=O)[C@]2(C(C)C)CCNC2)s1 2269092733 KDZONDHNNHNKAX-CYBMUJFWSA-N 299.465 2.117 10 10 CECE Cc1cc(N2CC=C[C@H]2CN(C)C)ccc1[C@H](C)O 2269694466 GQGNQPQSCYIVHC-ZFWWWQNUSA-N 260.381 2.355 10 10 CECE C[C@H](c1ccccc1O)N1CCOC(C)(C)[C@H]1C(=O)O 2279765924 QHJRBKLBLMVFAD-ZWNOBZJWSA-N 279.336 2.017 10 10 CECE Cc1oc(C(=O)O)cc1COc1cccc(CCO)c1 2283637136 LYCRWQUNRFXEQL-UHFFFAOYSA-N 276.288 2.400 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@H](C)O)c(C)c2)C1 2285160154 IIRFPPZSBXXIJJ-QEJZJMRPSA-N 279.380 2.288 10 10 CECE CCCN(CC(N)=O)c1ccc([C@@H](C)NCC)c(C)c1 2285145547 FOAFDSJLDVMRGT-CYBMUJFWSA-N 277.412 2.367 10 10 CECE CCS(=O)(=O)C[C@H](C)N(C)c1ccc([C@@H](C)O)c(C)c1 2285149829 RBRGWHPBLQAECB-QWHCGFSZSA-N 299.436 2.308 10 10 CECE CCS(=O)(=O)C[C@H](C)N(C)c1ccc([C@@H](C)O)c(C)c1 2285169114 RBRGWHPBLQAECB-QWHCGFSZSA-N 299.436 2.308 10 10 CECE C[C@@H]1C[C@H](CC(=O)O)CN1CCCc1ccc(N)cc1 2285689643 TWCAYYCGIVBBHW-TZMCWYRMSA-N 276.380 2.387 10 10 CECE NC1CCN(c2ccc(OCC[C@@H]3CCO3)cc2)CC1 2296022750 LYUDDANQFIEUCD-MRXNPFEDSA-N 276.380 2.172 10 10 CECE C[C@@H](c1ccccc1O)N(CC(=O)O)C[C@H]1CCCO1 2288081614 OMSMMPGGJAKMCI-NWDGAFQWSA-N 279.336 2.019 10 10 CECE Cc1cccc(N)c1NC1CCN(C(=O)N(C)C)CC1 2288839105 HKUPNSOFGFUKOL-UHFFFAOYSA-N 276.384 2.135 10 10 CECE Cc1cc(N=NN2CCC(C(N)=O)CC2)ccc1[N+](=O)[O-] 2318776422 DUNCPJNXCSKANW-UHFFFAOYSA-N 291.311 2.099 10 10 CECE CSc1cc(N2CC[C@H](C)[C@H]2CO)ccc1CN 2328548686 JOEWCPZYXMZSBV-GXFFZTMASA-N 266.410 2.074 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@H]2NCc1ccc(O)c(O)c1 2329224002 SDEFCXHYEIZQHQ-RTWAVKEYSA-N 263.337 2.001 10 10 CECE C[C@@H](NC[C@@H]1[C@H]2CCCO[C@@H]12)c1c(O)cccc1O 2330703987 HDRIOFJWIOXLRT-UYUMYWFVSA-N 263.337 2.173 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)C[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21 2332259164 BSPHSDZHRRKUAP-VFZGUZRASA-N 264.329 2.166 10 10 CECE OC[C@H]1C[C@@H]2CC[C@H]1N2c1ccc2c(c1)CCCO2 2333686272 XUBKTUVATOJDNM-VNHYZAJKSA-N 259.349 2.361 10 10 CECE CC1(C)COC[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2336193372 BTSVPNNEWBAMDU-WDEREUQCSA-N 266.345 2.208 10 10 CECE C[C@H](N)c1ccc(N(C)CCOC2CCC2)cc1O 2338459026 ACHDMYYKRYBTBR-NSHDSACASA-N 264.369 2.417 10 10 CECE CN(Cc1ncon1)c1ccc(CO)c(C2CC2)c1 2339163815 PHWOJCNEXDBFHX-UHFFFAOYSA-N 259.309 2.076 10 10 CECE CNC[C@H]1CN([C@@H](C)c2ccccc2O)CC12CC2 2340549561 BUCKUUWUTRSOLH-STQMWFEESA-N 260.381 2.385 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)[C@@H]1C[C@H]2C[C@@H]1C2 2342025302 AVVWQNJPWHJKOU-VUBORPHZSA-N 261.365 2.450 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1 2349988510 CZEHBADVEYABLH-KSYCFECVSA-N 261.365 2.480 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H]4CC[C@H]3[C@H](O)C4)ccc2O1 2349994891 KGZQXXITTQCDNO-FDRIWYBQSA-N 259.349 2.360 10 10 CECE CSC1CC(OC(=O)CCOc2ccc(N)cc2)C1 2353068516 NJCBBONZYLPKKH-UHFFFAOYSA-N 281.377 2.475 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)c(C)c1 2355773500 HAVJDFVUYBTLBU-VYDXJSESSA-N 274.408 2.454 10 10 CECE CCCCCOCC(=O)NCc1cc(OC)ccc1O 114540969 KWZYFKVJRSYVLG-UHFFFAOYSA-N 281.352 2.224 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@@H](N)[C@H](C)C1 251713789 JOBWDAXDDVSYIJ-GBIKHYSHSA-N 252.333 2.261 10 10 CECE Oc1c(F)cc(Br)cc1[C@H]1COCCCN1 1952390456 QPGWUYWDCHRXEY-SNVBAGLBSA-N 290.132 2.345 10 10 CECE NC(=O)c1cc(NCc2ccc(O)c(O)c2)c(F)cc1F 36920665 NEFVQPCTDQAAOT-UHFFFAOYSA-N 294.257 2.087 10 10 CECE COCCN(Cc1cc(C(C)=O)ccc1O)C(C)C 123408298 LBSDXDMVEHGISB-UHFFFAOYSA-N 265.353 2.452 10 10 CECE N[C@H](CF)c1ccc(Br)c(F)c1O 307341076 UTUGKRDNPJRRCC-ZCFIWIBFSA-N 252.058 2.263 10 10 CECE Cc1c([C@@H]2CNCCN(C)C2)c2ccccc2n1C 1952493293 BFSLJYXVBKIFML-CYBMUJFWSA-N 257.381 2.105 10 10 CECE Cc1cccc(S(=O)(=O)NCCCCN=[N+]=[N-])c1 231733946 LCIRDQUTUWVFJA-UHFFFAOYSA-N 268.342 2.364 10 10 CECE COc1cc(C[C@H](N)c2ccc(N(C)C)cc2)sn1 400458048 REQSAJUQNLTYGQ-ZDUSSCGKSA-N 277.393 2.460 10 10 CECE Oc1c(F)cc(Br)c([C@@H]2CCNC2)c1O 213439900 NCWATUJVTIJXLS-RXMQYKEDSA-N 276.105 2.076 10 10 CECE C[C@H](NC1(CO)CCC1)c1ccc(N2CCOCC2)cc1 182419556 LHEVEMDSLWFQLJ-AWEZNQCLSA-N 290.407 2.089 10 10 CECE CC1(C)C[C@H](NCc2ccc(O)c(O)c2)CCO1 215683769 NPDRBFISEXQWHC-LLVKDONJSA-N 251.326 2.145 10 10 CECE COc1ccc(CN[C@H](C)C(=O)N2CCCCC2)cc1C 37784433 AMPQZSUYHZTNBL-CQSZACIVSA-N 290.407 2.494 10 10 CECE CCO[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc(N)cc2)C1 42408468 CHSHVCRXFHGZKZ-SWLSCSKDSA-N 291.395 2.097 10 10 CECE CC(C)(Br)C(=O)NCc1ccccc1O 41737838 KXSYKXNWVKHZEF-UHFFFAOYSA-N 272.142 2.182 10 10 CECE CO[C@@H]1CCCN(c2ccc(/C=C/C(=O)O)cc2)C1 230334822 FEGAUTLZFCWSDZ-VIIAAUOXSA-N 261.321 2.400 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H]1CC=CCC1 90257510 VFURJJFDQQGNIB-MNOVXSKESA-N 252.318 2.174 10 10 CECE C[C@H]1CN(c2ccc(CN)c(F)c2F)CCS1 235651969 VITRELYMFMDXIH-QMMMGPOBSA-N 258.337 2.365 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3C[C@@H]4CCCC[C@H]4N3C2=O)cc1 252426936 WUAONEHMJPBDEQ-GDLCADMTSA-N 285.347 2.369 10 10 CECE NC1(Cc2c(F)cc(O)c(O)c2Br)CC1 258425522 BFEZPJWAEPGJNG-UHFFFAOYSA-N 276.105 2.033 10 10 CECE CCCN[C@H](C)c1ccc(N2C[C@H](CO)OC[C@H]2C)cc1 250572113 YZAUMLBABCLDEF-CKEIUWERSA-N 292.423 2.333 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCCN(C)C2)c(F)c1 53245587 XTJPCZYBBNLPAP-DGCLKSJQSA-N 265.376 2.376 10 10 CECE CC(C)(CO)c1cc(Br)c(F)c(O)c1O 258728956 UUFCRKIEQKQDNR-UHFFFAOYSA-N 279.105 2.269 10 10 CECE CCOc1ccc(O)c(CNC[C@](C)(O)C(F)(F)F)c1 270441225 AGDAMFJROWMBNM-LBPRGKRZSA-N 293.285 2.194 10 10 CECE CN(Cc1ccnn1C)c1ccc(/C=C/C(=O)O)cc1 701651428 WYMBIMROVLOHBC-VMPITWQZSA-N 271.320 2.154 10 10 CECE CCN1CCc2cc([C@](C)(O)CC(OC)OC)ccc21 2163080287 SWXHBUSOPPTOCQ-MRXNPFEDSA-N 279.380 2.286 10 10 CECE CCN1CCc2cc(N3CC4(CCCNC4)C3)ccc21 2163080923 XCOSUJZLRPWKJN-UHFFFAOYSA-N 271.408 2.259 10 10 CECE Oc1ccc(F)cc1CNC[C@@H]1CCn2nccc2C1 2165200510 JWSGAGUAFMRAHL-LLVKDONJSA-N 275.327 2.080 10 10 CECE NN[C@@H](C[C@H]1CCCO1)c1ccc(N2CCCC2)cc1 2163104661 FVUYIGMTRYDFTI-CVEARBPZSA-N 275.396 2.360 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H](O)c3ccco3)ccc21 2163135111 GYRAHCNFFVKRKO-HZPDHXFCSA-N 272.348 2.395 10 10 CECE COc1cc(Cl)cc(CNCCc2ncccn2)c1O 2163208444 HFBZSOOLPSGZPS-UHFFFAOYSA-N 293.754 2.177 10 10 CECE O=C1Nc2cc(N3CC4CC(F)(C4)C3)c(Cl)cc2[C@H]1O 2163752943 DGALYSIEVQXYPH-BWQPLIALSA-N 296.729 2.264 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@@H]1CCCC12CC2 706547408 JTSVTYQDRQARHX-KGLIPLIRSA-N 272.348 2.441 10 10 CECE CC(C)(C)[C@@H]1CNCCN1c1ccc2c(c1)OCCO2 2162854027 GCPKDHAAJLDOKE-HNNXBMFYSA-N 276.380 2.282 10 10 CECE O=C(C1CC1)[C@H]1CN(Cc2cc(Cl)ccc2O)CCO1 811502324 PXJNVIMMGMYPNE-CQSZACIVSA-N 295.766 2.226 10 10 CECE CC(=O)N[C@H]1CCN(Cc2c(O)cc(C)cc2Cl)C1 817414315 FIGXJLWSZXEWPN-NSHDSACASA-N 282.771 2.064 10 10 CECE CCOc1ccc(CN2CCC3(CCN3)CC2)c(O)c1 817865109 HHIBVJPMOPFPHE-UHFFFAOYSA-N 276.380 2.119 10 10 CECE Cc1cc(O)c(CNCC2(CC(N)=O)CC2)c(Cl)c1 817411114 NDAYSWUHXAMMBV-UHFFFAOYSA-N 282.771 2.099 10 10 CECE Oc1cccc(F)c1[C@H]1CC(c2cccnc2)=NN1 725388871 QCAFJVWTUBPBTD-GFCCVEGCSA-N 257.268 2.365 10 10 CECE CCCCN(CC(N)=O)c1ccc([C@H](CC)NC)cc1 723195002 GZGAPRFNSIYHIW-HNNXBMFYSA-N 277.412 2.449 10 10 CECE CO[C@H]1C[C@@H](COC(=O)CCc2ccc(N)cc2)C1 721998196 HJZUIPQTZYEGST-XBXGTLAGSA-N 263.337 2.170 10 10 CECE CC1(CNC(=O)NCCc2ccc(N)cc2)CCC1 841855000 IRLOTGDHOQGRMT-UHFFFAOYSA-N 261.369 2.301 10 10 CECE CCNCc1ccc(N2CC[C@@H]3COC[C@@H]32)cc1C 1899188486 ZGFNNXFVURYBAN-ZBFHGGJFSA-N 260.381 2.330 10 10 CECE CCCCN(Cc1ccccc1O)C(=O)N[C@@H](C)[C@@H](C)N 842008143 WBDVXOVJNQKVSR-OLZOCXBDSA-N 293.411 2.440 10 10 CECE Cc1c(/C=C/C(=O)N(C)c2ccccc2)cnn1C 154923430 LCWLACCRAVQHIR-MDZDMXLPSA-N 255.321 2.405 10 10 CECE Cc1ccc(O)c(CN(C[C@H]2CCC(=O)N2)C(C)C)c1 840977184 UGPMURABCIDVDJ-CQSZACIVSA-N 276.380 2.190 10 10 CECE C[C@H](NCCCCCN1CCNCC1)c1ccccc1O 925846951 YTVPPRASRUYHIZ-HNNXBMFYSA-N 291.439 2.118 10 10 CECE C[C@H](N[C@H]1C[C@@H](O)C12CCC2)c1cc([N+](=O)[O-])ccc1O 850544922 BYNILQYEOVHWGF-QCZZGDTMSA-N 292.335 2.255 10 10 CECE COc1ccc(N2CC[C@@H](Nc3cccnn3)C2)cc1 853759544 WCEJHPNBXKONJB-GFCCVEGCSA-N 270.336 2.176 10 10 CECE CN(C)c1ccc(/C=C\CNCCO[C@H]2CCOC2)cc1 922936527 IPKQYVKTAGKACB-LIMHQNJXSA-N 290.407 2.161 10 10 CECE CCC1(S(=O)(=O)Nc2ccc(O)c(F)c2)CC1 696365983 YFWGALFWVRLBQK-UHFFFAOYSA-N 259.302 2.216 10 10 CECE CC(=O)C(=O)COC(=O)c1sccc1C(F)F 873423266 HZDQJDUDYRGAAP-UHFFFAOYSA-N 262.233 2.001 10 10 CECE C[C@H](NC(=O)N[C@@H](C)[C@@H](C)CO)c1ccc(N(C)C)cc1 776148825 VVMLNCKHPGMQSO-AVGNSLFASA-N 293.411 2.130 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2/C=C/c1ccncc1 75793730 IUEQHZIQIKVCKY-XYHHVPKHSA-N 268.316 2.393 10 10 CECE CC[C@@]1(C)CN(CCCN)c2ccc(OC)cc2N1 76931092 CQAPCOVYVZWVKG-HNNXBMFYSA-N 263.385 2.445 10 10 CECE CCCCCNC(=O)[C@@H](N)c1ccc(N(C)C)cc1 83460794 UMYPWAUKBJLVRT-AWEZNQCLSA-N 263.385 2.059 10 10 CECE COc1cc2c(cc1O)CCN[C@@H]2c1ccccc1O 83620646 KVSBJFKBEIPJSD-MRXNPFEDSA-N 271.316 2.342 10 10 CECE COc1ccc(N2CC[C@@]3(CCNC3)C2)cc1F 98169876 KWMRKIHYUDNRNA-CQSZACIVSA-N 250.317 2.024 10 10 CECE CCN1CCN(Cc2ccc(F)c(F)c2O)C[C@H]1C 703488890 BTUNLBKSNOAUGH-SNVBAGLBSA-N 270.323 2.196 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@]12CCC[C@H]1OCC2 687417840 HEAXSBJQHJVRIS-ZBFHGGJFSA-N 275.348 2.310 10 10 CECE C[C@H]1CC(=O)NCCN1c1ccc([C@@H](C)O)c(Cl)c1 687976577 FBTSLDRPTUWWTR-VHSXEESVSA-N 282.771 2.108 10 10 CECE CO/C(=C/c1ccccc1)C(=O)NCc1ccc(O)c(O)c1 1137443180 GHDLGKGXSIZJCM-MHWRWJLKSA-N 299.326 2.402 10 10 CECE CC(C)N(C[C@@H](C)O)c1ccc([C@@H](C)O)cc1F 691465839 UQVPPAYETQTVPB-GHMZBOCLSA-N 255.333 2.475 10 10 CECE Cc1cc(N2CCOc3cccnc3C2)ccc1CO 716473194 ZIBZTBSWUKLWEU-UHFFFAOYSA-N 270.332 2.281 10 10 CECE CNC(=O)CCCN(Cc1ccc(N)cc1)C(C)C 68818970 WMUHRGVDMOIREG-UHFFFAOYSA-N 263.385 2.005 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)CCCCC(=O)O 719356885 WMAIETZCPKPLPN-JTQLQIEISA-N 267.325 2.346 10 10 CECE Nc1ccc(NC(=O)NC[C@H]2CC[C@@H](C3CC3)O2)cc1 722315322 ULWPUCVCYGMAAP-KGLIPLIRSA-N 275.352 2.348 10 10 CECE Cn1ncc(NCc2ccc(O)cc2O)c1Cl 694180151 SLEFGNKLSDUGFR-UHFFFAOYSA-N 253.689 2.097 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(N)=O)CCCC[C@H]1C1CC1 695919420 VHNWHPJOOUZHPS-WCQYABFASA-N 265.361 2.101 10 10 CECE COCc1ccc([C@@H](NCCCN=[N+]=[N-])C(=O)O)cc1 90258976 HWWQIEAGAPRAHH-GFCCVEGCSA-N 278.312 2.249 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AQOBQYCLDUVFPF-SNVBAGLBSA-N 293.798 2.219 10 10 CECE CC(C)(C)OC(=O)N1CC[C@]1(C)CC(=O)NCCN=[N+]=[N-] 2209921767 XJYGHRUXPVYOCF-CYBMUJFWSA-N 297.359 2.203 10 10 CECE CO[C@H]1CC[C@@H]1CSCC(=O)c1ccc(O)c(O)c1 2230516586 KFTFMPQTSPFJAX-YGRLFVJLSA-N 282.361 2.439 10 10 CECE Nc1ccc(NC(=O)[C@@H]2OCC[C@@H]2C(F)(F)F)cc1 2231811084 HZSBYHMXEWNSPX-VHSXEESVSA-N 274.242 2.175 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(C)[C@@H]2CO)c(C)c1 2232094184 PAGCTCQRYCHLCC-WFASDCNBSA-N 262.397 2.483 10 10 CECE CO[C@H]1C[C@H](O)CN(c2ccc(OC(F)(F)F)cc2)C1 2234896177 ZFRWYYPVFKCOJQ-JQWIXIFHSA-N 291.269 2.171 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3[C@H]2C[C@@]3(C)O)cc1 2225422841 RZUWZTQVYOWCOZ-RAEVTNRLSA-N 260.381 2.317 10 10 CECE CCNCc1cc(OC)ccc1N1C[C@@H](C)O[C@H](C)C1 2235971414 AWUGTBTZMLRNNU-CHWSQXEVSA-N 278.396 2.418 10 10 CECE COc1ccc(N(C)[C@@H]2CCCOCC2)c(C(=O)O)c1 2235950871 AQCROVQLMYWNKZ-LLVKDONJSA-N 279.336 2.399 10 10 CECE COC(=O)[C@H]1CCN1c1ccc(OC)c(C(F)(F)F)c1 2235939565 UTOVESGLLBKZMN-SNVBAGLBSA-N 289.253 2.466 10 10 CECE COc1ccc(N2CC[C@H](CO)[C@@H](C)C2)cc1OC 2226798496 JHGLLTYKQDLAPC-NWDGAFQWSA-N 265.353 2.159 10 10 CECE CC1(C)C[C@@H](O)CN1c1ccc2c(c1)OCCCO2 2226805611 KHDLSWMYFCRGIH-GFCCVEGCSA-N 263.337 2.198 10 10 CECE COc1ccc(N2CCC[C@H]3COC[C@H]32)c(C=O)c1 2227694744 JWJAQEZURNGZCH-XHDPSFHLSA-N 261.321 2.123 10 10 CECE COc1ccc(N(C)[C@@H]2CCOC2(C)C)c(CN)c1 2227681736 KMSYHPBUDPFORY-CQSZACIVSA-N 264.369 2.158 10 10 CECE COc1ccc(N2CC[C@H]2C(=O)O)cc1C(F)(F)F 2227665419 QOKRALKOXKBBLJ-VIFPVBQESA-N 275.226 2.377 10 10 CECE COc1ccc(N2CCC[C@@H]2C2(O)CC2)c(C=O)c1 2227702585 MSSIXLSHLIQVJN-CQSZACIVSA-N 261.321 2.001 10 10 CECE COc1ccc(N(C)Cc2cc(C)on2)c(C=O)c1 2227709220 RECYWPPYQAKZRO-UHFFFAOYSA-N 260.293 2.441 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H]3CC[C@@H]3OC)ccc21 2227870965 TZPCHIYHAXZNPK-KBMXLJTQSA-N 260.381 2.494 10 10 CECE CN(C[C@H](F)[C@@H]1CCOC1)c1ccc(CN)c(F)c1F 2238326853 LMSKZEFCDHFWSF-MNOVXSKESA-N 288.313 2.234 10 10 CECE COc1cc(N)c(N2CC[C@H](OC(F)F)C2)cc1OC 2238924260 PRODQYCRNXVRIM-QMMMGPOBSA-N 288.294 2.104 10 10 CECE Nc1ccc(CCN2C[C@H]3COC[C@@H](C2)C3(F)F)cc1 2239830189 HIOVGLBVOPIZFW-BETUJISGSA-N 282.334 2.025 10 10 CECE OCC1=CCN(c2ccc(CNC3CCC3)cc2)CC1 2240075380 KQYYNALKPGDMBU-UHFFFAOYSA-N 272.392 2.458 10 10 CECE CN(C[C@H]1CCN1C)c1ccc(CNC2CCC2)cc1 2240021524 PJYZFKRDDSAQAL-QGZVFWFLSA-N 273.424 2.469 10 10 CECE CC[C@H](C)NCc1cc(OC)ccc1N1CC(CO)C1 2240068970 UAPDFLODCGSJRU-LBPRGKRZSA-N 278.396 2.012 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)CCc1cnn(C)c1 2240737395 BCVZSMGKZKVIFL-CYBMUJFWSA-N 272.396 2.427 10 10 CECE CNCc1ccc(N2C[C@@H](O)CC23CCCC3)c(F)c1 2241025735 FADLIWVIJMBEOS-ZDUSSCGKSA-N 278.371 2.429 10 10 CECE C[C@@H]1C[C@@H]1CN(C)Cc1ccc(N2CCNCC2)cc1 2286066790 YHDBXTAYKJUGEM-GDBMZVCRSA-N 273.424 2.184 10 10 CECE CSc1ncc(CN[C@@H]2[C@H](C)[C@@H]3OCC[C@H]32)s1 2248707775 KOJZQDRNSINVTA-BBHBSTQDSA-N 270.423 2.378 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)c1cc(C)cnn1 2272953382 QSUHGUHTAZQJCZ-HNNXBMFYSA-N 256.353 2.160 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1c(F)cc([C@H](C)N)cc1F 2273209418 BDVNILUDJHWYOD-HJIKLVIJSA-N 270.323 2.334 10 10 CECE FCOc1ccc(N2CCC[C@H]3NCC[C@H]32)cc1 2263928660 JUUUNXMDBQNFNI-ZIAGYGMSSA-N 250.317 2.323 10 10 CECE CCN(CCOCCO)c1ccc(OC(F)F)cc1 2278402363 UBUARCGHNSWCFQ-UHFFFAOYSA-N 275.295 2.123 10 10 CECE CSc1ncc(CNC(=O)C2CC3(CCCN3)C2)s1 2269096565 VJENKWZGOPBRCF-UHFFFAOYSA-N 297.449 2.013 10 10 CECE CN(C)c1ccc(OCC(C)(C)COCC(=O)O)cc1 2291034241 QQJZOFPFKREOHR-UHFFFAOYSA-N 281.352 2.259 10 10 CECE CCN1CCc2cc(C3(O)CCCNCCC3)ccc21 2284615469 VRZXRKKFYKVXNQ-UHFFFAOYSA-N 274.408 2.420 10 10 CECE CCCN[C@H](C)c1ccc(N(C)CC(=O)NC)cc1C 2285144248 QJOUKAMMXJOJET-CYBMUJFWSA-N 277.412 2.238 10 10 CECE COC[C@]1(C)COCCN1c1ccc([C@@H](C)N)c(C)c1 2285121914 PGFRMFQTFBDRAW-CZUORRHYSA-N 278.396 2.256 10 10 CECE CC1(C)CN(c2ccc(OC(F)F)cc2)[C@H](CN)CO1 2295961957 INYOOGSCPFVPCW-LLVKDONJSA-N 286.322 2.231 10 10 CECE CCN1CCc2cc([C@@H](N)[C@]34COC[C@H](C3)C4)ccc21 2288768111 PLMCUHPMPHGZDE-CSMYWGQOSA-N 272.392 2.495 10 10 CECE COC[C@H]1C[C@@H](CN)N([C@@H](C)c2cc(C)ccc2O)C1 2289500678 JRCBMTUCTCKPGG-IHRRRGAJSA-N 278.396 2.057 10 10 CECE Cc1c(C=CC(=O)N(C)Cc2ccccc2O)cnn1C 2304188510 ASYFGSCJNAHNSB-UHFFFAOYSA-N 285.347 2.106 10 10 CECE CC[C@H](NC(=O)C=Cc1ccc(O)c(O)c1)[C@@H]1CCCO1 2308005968 OSEQOLKFARLUPO-WFASDCNBSA-N 291.347 2.185 10 10 CECE CC(C)C=CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 2312272648 VWKCLWQJNKKFEO-LLVKDONJSA-N 263.337 2.357 10 10 CECE CCOC(CC(=O)N[C@H](C)c1ccccc1O)OCC 827941649 USVZXIKWNSPIQR-LLVKDONJSA-N 281.352 2.359 10 10 CECE CN1CCCc2cc([C@@H](N)CC3(C)OCCO3)ccc21 2307752640 UCEURMNAFYZWEJ-AWEZNQCLSA-N 276.380 2.222 10 10 CECE CSc1cc(N2CC[C@@H]3COC[C@H]32)ccc1CN 2328537119 WIWGQPMNOLKTJD-DGCLKSJQSA-N 264.394 2.092 10 10 CECE CN(C[C@H]1[C@@H]2CCO[C@@H]21)c1ccc2c(c1)CC[C@H]2N 2331550534 FEFDQUNEPNHHDX-JONQDZQNSA-N 258.365 2.104 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)CCc1ccccc1O 2337777304 LXIUNYWWTIWSDW-UHFFFAOYSA-N 262.313 2.484 10 10 CECE CO[C@H]1CN(Cc2cc(N)ccc2O)C2(CCC2)C1 2337851929 CIUPQXSOOXYREV-CYBMUJFWSA-N 262.353 2.118 10 10 CECE CC(C)C1(O)CN(c2ccc(CO)c(C3CC3)c2)C1 2339160311 LDIJHOHJAMORSO-UHFFFAOYSA-N 261.365 2.263 10 10 CECE CN[C@H](C)c1ccc(N2CC([C@@H](C)O)C2)c(C)c1C 2340849926 BAHAJFOZNKPHQQ-CHWSQXEVSA-N 262.397 2.401 10 10 CECE Cc1nc(CN2CCc3cc(O)c(O)cc3C2)cs1 2341215780 DAYYFBHOKYFCCT-UHFFFAOYSA-N 276.361 2.421 10 10 CECE CC(C)n1cnc(CN2CCC(CN=[N+]=[N-])CC2)n1 2342698721 OBEMEJNYROSAIQ-UHFFFAOYSA-N 263.349 2.381 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C[C@H]2C(C)C)cc1 2344614196 MBXKKZIIQXMNLI-HOTGVXAUSA-N 262.397 2.392 10 10 CECE CSc1cc(N2C[C@@H]3C[C@H](C2)[C@]3(C)O)ccc1CN 2353854745 YUSZCGZMXFCQKM-JYAVWHMHSA-N 278.421 2.074 10 10 CECE Nc1ccc(O)c(CNc2nccc(C(F)F)n2)c1 1892571015 OZZKPWQCBDFUSO-UHFFFAOYSA-N 266.251 2.314 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3[C@H]2CCCN3C)cc1O 2356098369 FPNPOIKDVZQPAD-KCPJHIHWSA-N 275.396 2.085 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)[C@@H]1CC[C@@]2(C)C[C@@H]12 2356239161 YJDFUWOQEPUBEI-AEIGPULVSA-N 271.364 2.263 10 10 CECE CCOc1ccc(N2CCC[C@H](NC)C2)cc1F 126707114 QBCUVKLJKQIZPH-NSHDSACASA-N 252.333 2.413 10 10 CECE C[C@H]1CN(c2ccc(CN)c(F)c2F)[C@H](C)CO1 300460275 UBRARDSRUUKHJD-BDAKNGLRSA-N 256.296 2.037 10 10 CECE COc1cc([C@H]2OCCc3cc(O)c(O)cc32)ccc1O 38817092 LVSSJKCTDCSHPX-MRXNPFEDSA-N 288.299 2.474 10 10 CECE C[C@H](c1cnn(C)c1)N(C)Cc1cc([N+](=O)[O-])ccc1O 180992835 IUFRJNIYHSXKCI-SNVBAGLBSA-N 290.323 2.227 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1cccn1C1CC1 182525817 XGMRBUNJRGBRIO-UHFFFAOYSA-N 272.304 2.164 10 10 CECE COC(=O)c1ccc(CNC(=O)Nc2ccc(N)cc2)cc1 217313690 OOARQCSUGYBPKU-UHFFFAOYSA-N 299.330 2.377 10 10 CECE Nc1ccc(CNc2nc(Cl)[nH]c3ncnc2-3)cc1 1162784585 RKPCYRFFRHRHQN-UHFFFAOYSA-N 274.715 2.152 10 10 CECE CC[C@@](C)(NC(=O)/C=C\c1ccc(N(C)C)cc1)C(=O)O 211280647 PRLRCGIABDBNDH-JXMNSVBMSA-N 290.363 2.135 10 10 CECE CCCCCCNS(=O)(=O)Cc1ccc(N)cc1 40328636 CHKVMZVSCKILBP-UHFFFAOYSA-N 270.398 2.269 10 10 CECE Cc1cccc([N+](=O)[O-])c1C(=O)NCCCN=[N+]=[N-] 42013126 JHWZZRDRAVFIHK-UHFFFAOYSA-N 263.257 2.333 10 10 CECE Oc1ccc2ccccc2c1CNCCCc1nnc[nH]1 80568038 NXEWWSJKBBTNEW-UHFFFAOYSA-N 282.347 2.386 10 10 CECE O=C(NCc1c(O)ccc2ccccc12)c1cnccn1 222120811 WJDVKYRKIZEEFO-UHFFFAOYSA-N 279.299 2.265 10 10 CECE COc1cccc(C(=O)N(C)Cc2ccccc2O)c1N 88651565 HUPLYRUXIVDBPY-UHFFFAOYSA-N 286.331 2.255 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](C)C3)c(Cl)cc21 92750693 NZZCDQFZBBWAIC-SDBXPKJASA-N 279.771 2.399 10 10 CECE Oc1ccc(Cl)cc1CN1CCN2CCC[C@@H]2C1 179952597 DPQUQJHXDYDOLS-CYBMUJFWSA-N 266.772 2.326 10 10 CECE C[C@@H]1CN[C@H](C)CCN(c2ccc3c(c2)OCO3)C1 49665594 HWBPEONLZZIIHD-VXGBXAGGSA-N 262.353 2.240 10 10 CECE O=C1NC[C@H](c2ccc(OCc3ccccc3)cc2O)N1 95689955 MUVAXBLSGQSAQI-CQSZACIVSA-N 284.315 2.325 10 10 CECE C[C@H](N)c1cc([N+](=O)[O-])cc(Br)c1O 95767857 GYTGNYXVYDERDU-BYPYZUCNSA-N 261.075 2.083 10 10 CECE COc1ccc(CS(=O)(=O)Nc2ccc(N)cc2)cc1 242579072 CGZFIAYMHOBLRT-UHFFFAOYSA-N 292.360 2.219 10 10 CECE C[C@]1(Br)C[C@H]1C(=O)NCc1ccccc1O 528855748 UEHCALIIQDHSOO-CABZTGNLSA-N 284.153 2.182 10 10 CECE COc1cc(Cl)cc(CN2CCO[C@@H]3C[C@@H]32)c1O 366563128 XHSHXXSBITUYPK-WDEREUQCSA-N 269.728 2.027 10 10 CECE CN(C(=O)/C=C\c1cccnc1)c1ccc(N)cc1 702049794 RQRIKRKIMOMTLP-WTKPLQERSA-N 253.305 2.340 10 10 CECE CN1CCc2cc([C@]3(O)CC[C@@H]4NCC[C@H]4C3)ccc21 2163070908 JUJKKFLDPNKACU-QRTARXTBSA-N 272.392 2.029 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3[C@@H]4CCCN[C@H]43)ccc21 2163072638 CBNBVNXHRJOTRQ-SVGFKBNWSA-N 272.392 2.100 10 10 CECE CCN(CC)c1ccc([C@@H](NN)c2ncoc2C)cc1 2163145841 XOVBNRPYSRCNSD-OAHLLOKOSA-N 274.368 2.382 10 10 CECE CO[C@@H](C)CCOc1ccc(N2CCNCC2)cc1C 2165539666 SCISXFYYDBDJGR-AWEZNQCLSA-N 278.396 2.208 10 10 CECE Nc1ccc(N2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@@H]3C2=O)c(Cl)c1 2166914799 DGPFSPDOLSBSED-XMUKKISLSA-N 290.750 2.458 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3OCC[C@@H]3C2)c(F)c1 724693538 QBDMHOZYYHEQFD-IXPVHAAZSA-N 265.328 2.494 10 10 CECE O=C(c1cccc(O)c1O)N1CC[C@@H]1C1CC(F)(F)C1 2165962375 ZSJZNUAYTSGDBY-SNVBAGLBSA-N 283.274 2.358 10 10 CECE CCN(C)C(=O)[C@@H](C)NCc1cc(Cl)c(F)cc1O 294625468 JJTMHQGWTZBJIM-MRVPVSSYSA-N 288.750 2.141 10 10 CECE CCNCc1cc(F)c(N2C[C@@H]3C[C@H]2CO3)c(F)c1 718377961 GIFRABKWAKKJLD-QWRGUYRKSA-N 268.307 2.052 10 10 CECE CC[C@@H](NCc1ccc(O)cc1O)[C@@H]1CCCOC1 724016038 ZDYJQMONKKPGHA-TZMCWYRMSA-N 265.353 2.393 10 10 CECE CCc1cccc(CN2C[C@@H]3COC[C@]3(C)C2)c1O 827283054 OTFLNVLFVNPMRN-ZBFHGGJFSA-N 261.365 2.423 10 10 CECE CCn1cc(CNCc2cc(Cl)cc(C)c2O)nn1 827087063 HHBXHDLXVMEKMW-UHFFFAOYSA-N 280.759 2.255 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)[C@@H]1CCCO1 906714436 SWOHZIVQEWWJNI-CJNGLKHVSA-N 290.407 2.492 10 10 CECE CC1(C)CN(Cc2cc(Cl)cc(F)c2O)C[C@H]1N 903986765 RLNREMWJECEGSG-LLVKDONJSA-N 272.751 2.354 10 10 CECE COc1cccc([C@H](C)NC[C@@H]2CCCN2C)c1O 846142206 DFQJEPNWQLGGAU-RYUDHWBXSA-N 264.369 2.146 10 10 CECE Cc1cc(O)c(CN2CC[C@@H]3CNC[C@@H]32)c(Cl)c1 841026859 SWGJUNRGNWCUMU-MFKMUULPSA-N 266.772 2.148 10 10 CECE COc1cccc(O)c1CN1CCC[C@H]([C@H]2CCCN2)C1 843045443 QQGVDPCZHGIWMU-DZGCQCFKSA-N 290.407 2.365 10 10 CECE O=C(OCCO[C@H]1CC1(F)F)c1cc(O)cs1 849727744 GIFUGOYLPRWUFV-QMMMGPOBSA-N 264.249 2.035 10 10 CECE C[C@H]1CNCC[C@@H]1NCc1c(O)cccc1Cl 841064005 NVYSOWMIYUMBHZ-CABZTGNLSA-N 254.761 2.133 10 10 CECE N=C(NCc1cc(Cl)cc(Cl)c1O)NC1CC1 849028661 UATYWAUKNJBLFH-UHFFFAOYSA-N 274.151 2.475 10 10 CECE COc1ccc(N(C)CCN(C)CCC(C)=O)cc1 844398716 ACYLBMOFXCFMDK-UHFFFAOYSA-N 264.369 2.042 10 10 CECE COc1ccc(CNCC[C@H]2CCCC[C@@H]2O)c(O)c1 2179617367 FWKRRFHWJCSMNO-DOMZBBRYSA-N 279.380 2.432 10 10 CECE COc1cc(C)cc(CN2CCC[C@@H]2C[C@@H](C)O)c1O 754748432 LYVIFGNLGGFPIY-TZMCWYRMSA-N 279.380 2.445 10 10 CECE COc1cncc(CN(C)c2ccc(OC)c(F)c2)n1 859163795 RBEURCVKVSKPFG-UHFFFAOYSA-N 277.299 2.269 10 10 CECE CN1CCc2cc([C@H](O)CNC(=O)OC(C)(C)C)ccc21 1955942580 AHGULDDXXWRSCA-CQSZACIVSA-N 292.379 2.237 10 10 CECE C[C@@H]1CC[C@@H](N[C@H](C)c2ccc(F)cc2O)CN1 863546635 MBVUPWOYGJDFRM-CKYFFXLPSA-N 252.333 2.322 10 10 CECE CC(C)[C@@H](N)CCN(C)[C@@H](C)c1ccc(O)cc1O 133379162 TWJOFDMARHVSAY-FZMZJTMJSA-N 266.385 2.464 10 10 CECE CC[C@@H](C)NC(=O)CCNCc1ccc(F)c(F)c1O 700742273 HFWQUPPLNMSNNV-SECBINFHSA-N 286.322 2.065 10 10 CECE Oc1ccc([C@H]2NCCc3c(F)cccc32)c(O)c1 83596411 RYTYCQISHSLLRS-HNNXBMFYSA-N 259.280 2.472 10 10 CECE Oc1ccccc1[C@H]1NCCc2c(O)ccc(F)c21 83626026 AWRURCGBRJGKCF-OAHLLOKOSA-N 259.280 2.472 10 10 CECE Oc1ccc2c(c1)CCN[C@H]2c1ccc(F)cc1O 83659922 PEYCPWZOULAQNX-OAHLLOKOSA-N 259.280 2.472 10 10 CECE O=C(c1cccs1)[C@H]1NCCc2ccc(O)c(O)c21 83724810 GPWUGRSADCPCDE-LBPRGKRZSA-N 275.329 2.229 10 10 CECE CCNCc1ccc(N2CCC(C(=O)O)CC2)cc1 84847040 LLCLLJRQLCDWJF-UHFFFAOYSA-N 262.353 2.097 10 10 CECE C[C@H]1C[C@@H](CO)CN(c2ccc(CNC3CC3)cc2)C1 398819053 BNBUPLBWXBYHDY-DZGCQCFKSA-N 274.408 2.393 10 10 CECE C[C@H]1CC[C@@H](C(N)=O)CN1c1ccc([C@@H](C)N)c(Cl)c1 78906035 HIMZPYODJAWGNL-HBNTYKKESA-N 295.814 2.450 10 10 CECE CCC(O)(CC)CN(C)c1cc2c(cc1N)OCCO2 706427800 KOOITLMOXONBTF-UHFFFAOYSA-N 280.368 2.027 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@]12CCC[C@@H]1OCC2 687393224 ZEEIXDYJNHJEFO-JQWIXIFHSA-N 252.318 2.152 10 10 CECE C[C@@H](O)c1ccc(N(C)CCn2cccn2)c(F)c1 707644951 SOUUKWCLCGMXEL-LLVKDONJSA-N 263.316 2.212 10 10 CECE CNCc1ccc(N2CCNC(=O)CC2(C)C)c(Cl)c1 708155035 JRHKEBYWUZNUHS-UHFFFAOYSA-N 295.814 2.164 10 10 CECE C[C@H](N[C@H]1COC2(CCC2)C1)c1ccc(O)cc1O 688284104 CGAROVOHUBBPCH-WDEREUQCSA-N 263.337 2.460 10 10 CECE CCN1CC[C@H](N(C)CCCc2ccc(N)cc2)C1 688586030 KCVVTOPFHBUXRL-INIZCTEOSA-N 261.413 2.227 10 10 CECE O=C(O)[C@H]1CCC[C@H](CNCc2ccc(O)cc2O)C1 713998856 SAJITLHQEYSFCA-QWRGUYRKSA-N 279.336 2.078 10 10 CECE CN(c1c(F)cc(CO)cc1F)[C@H]1CO[C@H](C2CC2)C1 691777869 VYKBGJLMHZLZAP-RISCZKNCSA-N 283.318 2.461 10 10 CECE CN(CCc1ccc(N)cc1)[C@H]1CO[C@@H](C2CC2)C1 691766594 NJRRLONWDNRMAM-HZPDHXFCSA-N 260.381 2.311 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@@H](CO)C(C)(C)C 689703837 BGMZEWNGDMCCPF-LBPRGKRZSA-N 265.357 2.140 10 10 CECE CC1(C)CO[C@@H](CNCc2ccc(O)cc2O)C1 717284974 MSWNUSLCWAOTBH-GFCCVEGCSA-N 251.326 2.003 10 10 CECE O=C(O)[C@H]1CN(Cc2cc(F)ccc2O)CCC1(F)F 717886509 DCXIUJOVUIAKJT-SNVBAGLBSA-N 289.253 2.073 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H]1COc2ccccc21 692843202 WPMINBHIBQFLTC-PWSUYJOCSA-N 272.308 2.464 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1ccc(F)c(F)c1F 693356317 TWBOMINVEJUFRP-VIFPVBQESA-N 274.202 2.130 10 10 CECE Nc1ccc(OCC(=O)NCc2ccc(Cl)o2)cc1 698049546 QEUFIRUTOITZIW-UHFFFAOYSA-N 280.711 2.210 10 10 CECE CCOC(=O)[C@](C)(CC(C)(C)OC)NCCCN=[N+]=[N-] 90259912 CZGGVMMUTJQBTC-ZDUSSCGKSA-N 286.376 2.413 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NOC2CCCC2)cc1 1152464070 HHHXYXIPZYMXTC-UHFFFAOYSA-N 276.296 2.453 10 10 CECE CN(CC(F)(F)CO)c1ccc2c(c1)CCC[C@H]2N 2128272683 HTUCQMAOFFMOCO-CYBMUJFWSA-N 270.323 2.087 10 10 CECE CN(C)[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3N)C1 2128268604 JBCIKIYXXDSBGU-GOEBONIOSA-N 259.397 2.163 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1S(=O)(=O)[C@H]1CCCC[C@@H]1F 2118942157 UNVDLJUYYJSDKK-DCAQKATOSA-N 290.364 2.372 10 10 CECE CCCNCc1ccc(N2CC3(C=CCO3)C2)cc1 2127317704 PZWQQBFOWNKHJA-UHFFFAOYSA-N 258.365 2.331 10 10 CECE COC(=O)[C@@](C)(C[C@@H](C)C(F)F)NCCCN=[N+]=[N-] 2121391149 BOMBWQLQZKTYAR-LDYMZIIASA-N 278.303 2.499 10 10 CECE CC1(C)[C@@H]2[C@H](CCN2c2ccc(CN)c(Cl)c2)[C@H]1O 2121680464 BNNXYNBDYQVFOU-FPMFFAJLSA-N 280.799 2.394 10 10 CECE COc1cc(Cl)cc(CN[C@]2(C)CCC[C@H]2O)c1O 2126313017 HSNSVOWGMHFIJS-TZMCWYRMSA-N 285.771 2.447 10 10 CECE C[C@@H]1O[C@H](C)C[C@]1(Sc1nccs1)C(=O)O 1904752418 HLRYPMUMZKWAJV-MATHAZKKSA-N 259.352 2.256 10 10 CECE Nc1ccc(CN2CCCCCC[C@H]2C(=O)O)cc1 1891409917 DDTZNTLDDBRNQS-AWEZNQCLSA-N 262.353 2.488 10 10 CECE CC[C@H](N)C(C)(C)[C@H](O)c1ccc2c(c1)CCN2C 2131857479 IFOLHMZTQIMPJP-LSDHHAIUSA-N 262.397 2.476 10 10 CECE CC[C@@]12C[C@@H]1CN(c1ccc(CO)c([N+](=O)[O-])c1)C2 2132058006 KZLREOYRVJHYQX-RISCZKNCSA-N 262.309 2.323 10 10 CECE Cc1cc(CN)ccc1N1CCC(C2(O)CC2)CC1 2130505091 XONCPLJNAAEKPN-UHFFFAOYSA-N 260.381 2.195 10 10 CECE CC1(C)C[C@@H](CN2CCCc3cc(CN)ccc32)O1 2133050368 KXCDWNJAEVGIEX-AWEZNQCLSA-N 260.381 2.465 10 10 CECE O=C(NCCCC1CCC1)c1cc(O)c(O)c(O)c1 2132351415 XGMQQDBBRDSBMM-UHFFFAOYSA-N 265.309 2.114 10 10 CECE CO[C@@H]1C[C@@H](C(=O)Nc2ccc(N)cc2)C12CCC2 2133848395 TWRLJTFZTOIGPL-QWHCGFSZSA-N 260.337 2.413 10 10 CECE OCc1ccc(N2C[C@H](CO)C3(CCC3)C2)cc1Cl 1914529160 OTDGJINBUSYYJZ-GFCCVEGCSA-N 281.783 2.431 10 10 CECE CCn1cnc(C(=O)N2CCCC[C@@H](CN=[N+]=[N-])C2)c1 1912165350 JONBSVBVTCJNEI-NSHDSACASA-N 276.344 2.456 10 10 CECE CC(C)C(C(C)C)[C@](C)(NCCN=[N+]=[N-])C(N)=O 1912149107 BITYCBFRNGJUSF-LBPRGKRZSA-N 255.366 2.059 10 10 CECE C[C@H]1CN(CCN2CCC[C@H](CN=[N+]=[N-])C2)C[C@@H](C)O1 1912175589 NQIDENMRRPZGNZ-HZSPNIEDSA-N 281.404 2.118 10 10 CECE Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)c1 1912153414 GRBMNLSBEGXGGJ-SECBINFHSA-N 275.268 2.428 10 10 CECE C[C@H](C(=O)N1CCCCC1)N1CCC[C@H](N=[N+]=[N-])C1 1912201520 VQVYABQDGYKGBK-NEPJUHHUSA-N 265.361 2.162 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC(C)(C)C[C@@H]1C(=O)O 1912570800 HTLDWIFAYXGXMO-BXKDBHETSA-N 279.336 2.344 10 10 CECE C[C@@H](N)c1ccc(N(C)C2COC2)c(Br)c1 1915661211 HALHLEPXYXOMRR-MRVPVSSYSA-N 285.185 2.304 10 10 CECE COc1ccc(C=O)cc1C(=O)NCc1ccccc1O 1294924726 IILQJHDZKUDXBF-UHFFFAOYSA-N 285.299 2.143 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2C[C@H]1[C@H]1C[C@@H]12 1917661104 MALQCTIFJAOEJR-YDGKCPMDSA-N 273.376 2.450 10 10 CECE Cn1cnc(/C=C\C(=O)N2CCc3cc(F)ccc32)c1 1539889576 ZMOPBQXEMGQWDR-HYXAFXHYSA-N 271.295 2.162 10 10 CECE Cc1ccc(NN=NCCCN2CCOCC2)cc1 1860493668 XQGBVMQYUUGGLR-UHFFFAOYSA-N 262.357 2.496 10 10 CECE COC[C@@H]1CCCN(Cc2cccc(F)c2O)C1 226565010 BPLOKHVTWZNKSQ-LLVKDONJSA-N 253.317 2.390 10 10 CECE COc1cc(CNCCCO)ccc1N1CCCCC1 212694999 YXUOKZXWBXOLSA-UHFFFAOYSA-N 278.396 2.158 10 10 CECE COc1ccncc1C(=O)N(C)Cc1ccccc1O 1927267923 OFQNOINWIVXBRX-UHFFFAOYSA-N 272.304 2.068 10 10 CECE CO[C@@H]1COC[C@H]1N(C)[C@H](C)c1ccc(Cl)cc1O 2138543197 DQRDUOYNDHINTJ-GAJTVXKRSA-N 285.771 2.452 10 10 CECE COc1ccc(N(C)C(C)(C)CO)c(OC)c1C 258954061 XCPNOHXCVNIQMX-UHFFFAOYSA-N 253.342 2.219 10 10 CECE CCN(C(=O)COCC(F)(F)F)c1ccc(N)cc1 232323642 HLZVOZPQERYGDC-UHFFFAOYSA-N 276.258 2.201 10 10 CECE COc1cc(N2C[C@@H](C)OCC[C@@H]2C)ccc1CN 2139683251 SUMVPVBQJIXSCK-NWDGAFQWSA-N 264.369 2.158 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(OC)c2)C[C@H](C)O1 2139687228 MJRXBZGFABGRNO-SMDDNHRTSA-N 264.369 2.158 10 10 CECE C[C@]1(CCO)CCN1c1ccc(CNC2CC2)cc1 2140578817 LBPGWXSDKQFQSC-MRXNPFEDSA-N 260.381 2.290 10 10 CECE Cc1cc2c(cc1N(C)CC1(CN)CCC1)OCO2 258851063 FXUHSJDUCNSQET-UHFFFAOYSA-N 262.353 2.289 10 10 CECE CC[C@@H]1CN([C@H](C)C(C)=O)c2cc3c(cc2N1)OCO3 251882183 VHMGFXBKEIIZBQ-MWLCHTKSSA-N 276.336 2.403 10 10 CECE CC[C@H](CNC)CN(C)c1ccc(OC)cc1OC 258990558 MXZZECZKWHNWDM-GFCCVEGCSA-N 266.385 2.386 10 10 CECE CCOC[C@@H](C)OCCC(=O)Nc1ccc(N)cc1 233724603 SZUDMPGDRISYEA-LLVKDONJSA-N 266.341 2.039 10 10 CECE C[C@@H](NC(=O)[C@@H]1CCCOCC1)c1ccccc1O 827946305 DAHURGOVCGGTPV-VXGBXAGGSA-N 263.337 2.386 10 10 CECE COc1cccc(O)c1CN[C@@H]1COC(C)(C)C1 850341139 AEBWTCWDICUZJG-JTQLQIEISA-N 251.326 2.058 10 10 CECE C[C@H]1CN2CCC[C@@H]2CN1c1ccc(CN)c(F)c1F 235664195 PIACRPKXUFSBLN-CMPLNLGQSA-N 281.350 2.096 10 10 CECE CN1C[C@H](NCc2ccc3c(c2)CCCO3)C(C)(C)C1 2143828503 DUTCLGBALOCTHM-INIZCTEOSA-N 274.408 2.441 10 10 CECE C[C@H]1CCN(Cc2cc(Br)ccc2O)CCN1 1947743095 USFMGUIJDBPZBX-JTQLQIEISA-N 299.212 2.339 10 10 CECE C[C@@H]1CCN(CCCc2ccc(N)cc2)C[C@]1(C)O 1876944220 RZSOFEPKCZGJCU-CJNGLKHVSA-N 262.397 2.294 10 10 CECE C[C@H](N[C@H](C)c1ccc(O)cc1O)c1ccn(C)n1 1876945369 ZDIHWUBNZDQBAR-ZJUUUORDSA-N 261.325 2.243 10 10 CECE CCc1nn(C)c(C=O)c1C1=S=Nc2ccccc21 1877171269 XYXCPPGSCZCJQT-UHFFFAOYSA-N 271.345 2.275 10 10 CECE C[C@H](NC(=O)[C@]1(C)CCCN1C)c1ccccc1O 1877569729 DFJKIMMHCSGQNT-NHYWBVRUSA-N 262.353 2.054 10 10 CECE C[C@@H]1CN(c2ccc(OCC(F)F)cc2)C[C@@H]1CN 1879916122 ZARVEFDXOFZJQL-MNOVXSKESA-N 270.323 2.362 10 10 CECE Nc1ccc(CC(=O)NCC(F)(F)C(F)(F)F)cc1 1963539860 VNPNFVLKEZEPHV-UHFFFAOYSA-N 282.212 2.125 10 10 CECE Cc1nc(CCNCc2ccc(F)cc2O)c(C)o1 1964565420 JEJHBTBTLNAHRJ-UHFFFAOYSA-N 264.300 2.468 10 10 CECE COC(=O)CCCN[C@H](C)c1cc(C)ccc1O 37417175 CZSGIQBYPYMPMQ-LLVKDONJSA-N 251.326 2.304 10 10 CECE OC[C@H]1CC[C@H](CNCc2c(O)cccc2F)CC1 1964055496 KNZQMPGUBKPTOY-HAQNSBGRSA-N 267.344 2.420 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2COCCO2)c(Cl)c1 2143689542 XUZNUHRXTBHVFS-DGCLKSJQSA-N 298.814 2.472 10 10 CECE CC[C@@](O)(CN1CC[C@@H](N=[N+]=[N-])C1)C(F)(F)F 1949778059 CZCOBXLQODQVGN-HTQZYQBOSA-N 252.240 2.074 10 10 CECE CC(=O)C(=O)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1951517045 SIWWERQGLRFDKM-LLVKDONJSA-N 269.341 2.182 10 10 CECE CC(C)(C)OC(=O)N1CCC(=O)[C@H]1c1ccc(O)c(O)c1 1951852835 DZWXISBVZQZSIM-CYBMUJFWSA-N 293.319 2.349 10 10 CECE CCn1ncnc1CN(C)[C@@H](C)c1ccccc1O 1968793567 YZECUBJTUSOBNX-NSHDSACASA-N 260.341 2.197 10 10 CECE Nc1ncccc1OCc1cnn(-c2ccccc2)c1 2144698641 QHMCTNHNUCRGCU-UHFFFAOYSA-N 266.304 2.429 10 10 CECE Oc1ccc(CN2CCC[C@H]([C@H]3CCCN3)C2)c(O)c1 252417301 QXRGPLWEXWDMHH-SWLSCSKDSA-N 276.380 2.062 10 10 CECE Cc1nsc(CN2CCOc3cc(N(C)C)ccc32)n1 1971448990 LXADKRLQLJHPBT-UHFFFAOYSA-N 290.392 2.312 10 10 CECE CN1CC(CCNCc2ccc3c(c2)CCCN3C)C1 2145119925 GSMSGABJGAHTRV-UHFFFAOYSA-N 273.424 2.110 10 10 CECE Cc1c([C@H](O)c2ccc3c(c2)CCCN3C)cnn1C 2145404004 GDFYQTIPCLSCQR-MRXNPFEDSA-N 271.364 2.193 10 10 CECE CC(C)CN(CC(N)=O)c1ccc(CNC(C)C)cc1 42691789 YKWGLMXZUCYRRV-UHFFFAOYSA-N 277.412 2.132 10 10 CECE CN(C)Cc1cc(F)cc(C[C@@H]2CCCNC2)c1O 258395494 ASFIXTSQNBTIGF-NSHDSACASA-N 266.360 2.135 10 10 CECE CCN1CCC[C@H]1CN(C)Cc1cccc(OC)c1O 156084185 LOCQSGFBDNLZQV-AWEZNQCLSA-N 278.396 2.317 10 10 CECE NC1(c2c(O)c(F)cc3c2OCCO3)CCCC1 258786021 XMYUAODOQSOLFG-UHFFFAOYSA-N 253.273 2.031 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)C2(Br)CCC2)C1 1980143251 MKMXRXLHQXYWAS-MRVPVSSYSA-N 287.161 2.463 10 10 CECE C[C@@H](N(C)C[C@H](O)COc1ccc(N)cc1)C(C)(C)C 42737001 NSSQVSNAZQBPSP-OCCSQVGLSA-N 280.412 2.375 10 10 CECE COC(=O)CC[C@@H](N)c1cc(C(F)F)ccc1O 260009413 BCQSHULHPRSIDG-SECBINFHSA-N 259.252 2.283 10 10 CECE CCOC(=O)c1cccc2c3c(n(C)c12)C(=O)CC3 260691583 JFLSOUJESHJMFZ-UHFFFAOYSA-N 257.289 2.484 10 10 CECE Cc1[nH]ncc1CCCNCc1cccc(F)c1O 158750817 IZHKCZLWFXWWFH-UHFFFAOYSA-N 263.316 2.285 10 10 CECE CC(C)CN(CCN)Cc1ccc2c(c1)CCCN2C 2146873322 SIPDINUXGRQSJF-UHFFFAOYSA-N 275.440 2.486 10 10 CECE Nc1ccc(OCCNC(=O)Cc2ccsc2)cc1 38079586 DVINLTYNZSGWPW-UHFFFAOYSA-N 276.361 2.068 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@]1(C)CCOC1 2006845287 YHUSYOMWQDNGDD-CYBMUJFWSA-N 255.745 2.448 10 10 CECE Oc1cccc(CNCc2cccn3ccnc23)c1O 2151525906 AQZYXSHKEUSCPJ-UHFFFAOYSA-N 269.304 2.035 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@@H](N)C(F)(F)C2)c1 2151607825 HQQPOEQTSYWMTD-TVQRCGJNSA-N 286.322 2.130 10 10 CECE CCNCc1cc(F)c(N(CC)CCCO)c(F)c1 165270019 NUQAQVITDKIPOB-UHFFFAOYSA-N 272.339 2.283 10 10 CECE Nc1cc2c(cc1N1CC(CC(F)(F)F)C1)OCCO2 2152300757 NUWZFLMXZNIWHV-UHFFFAOYSA-N 288.269 2.429 10 10 CECE OCc1cc(F)c(N2CC[C@H]([C@@H]3CCOC3)C2)c(F)c1 2153069901 KMJLDGINAUKTAZ-NWDGAFQWSA-N 283.318 2.320 10 10 CECE C[C@H]1[C@H](CN(C)CC(=O)c2ccc(O)c(O)c2)C1(F)F 2153630873 QVZGMYNYBAPRAV-WPRPVWTQSA-N 285.290 2.114 10 10 CECE CCN(C(=O)Cn1ccc2cc(N)ccc21)C1CC1 49302760 UZCAATNDHOPGJP-UHFFFAOYSA-N 257.337 2.234 10 10 CECE 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C[C@@H](N)c1ccc2c(c1)CCN2C[C@H]1CC(F)(F)CO1 2144790445 NRHHNDARKDNJFH-ZWNOBZJWSA-N 282.334 2.493 10 10 CECE CN(C(=O)CN1CC[C@@H]1C1CCC1)c1ccc(N)cc1 2144899958 YDWKVQLLSVVNON-OAHLLOKOSA-N 273.380 2.106 10 10 CECE Cc1cc(Sc2ncc([C@@H](C)N)s2)n(C)n1 1976519489 FFFNXJOFVFZBMU-SSDOTTSWSA-N 254.384 2.356 10 10 CECE C[C@H](NCc1cccc(Cl)c1O)c1cnn[nH]1 2003286962 ZMOPRVJMIKVUOQ-ZETCQYMHSA-N 252.705 2.015 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N(C)C3CCCC3)cc21 155740740 QOMJVODZIGILCJ-AWEZNQCLSA-N 259.353 2.042 10 10 CECE NN[C@H](c1ccc(C(F)(F)F)nc1)c1ccccc1O 2146240414 KKEIXNJSIICUDL-GFCCVEGCSA-N 283.253 2.359 10 10 CECE CCOC(=O)C[C@@H]1CCN[C@H](c2ccccc2O)C1 260456894 RBZNTCJUFNCVMJ-YPMHNXCESA-N 263.337 2.386 10 10 CECE CC[C@H](C)S(=O)(=O)CCCC(=O)Nc1ccc(N)cc1 35320212 RWJGGPCISOIGLI-NSHDSACASA-N 298.408 2.201 10 10 CECE COc1ccc(N(C)C2(CN)C[C@@H]3CC[C@H](C2)O3)cc1 2149200994 DVNBESOSFDXXQF-XYPWUTKMSA-N 276.380 2.170 10 10 CECE Nc1ccc(OCCC(=O)NC[C@@H]2CC[C@@H](F)C2)cc1 2150369898 LFDCFAWGJYGVAW-VXGBXAGGSA-N 280.343 2.292 10 10 CECE CC[C@H](N)c1ccc(N(C)Cc2nnc(C)n2C)cc1 2146932042 YLEUNOHEVRCUHO-AWEZNQCLSA-N 273.384 2.170 10 10 CECE C[C@@H](NC[C@@H]1CCN(C2CC2)C1)c1ccc(O)cc1O 37649122 KHFOTLKRNQYKHH-NEPJUHHUSA-N 276.380 2.233 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCC[C@@H]2CS(C)(=O)=O)c1 2151229889 COXBOVKGHHDYMO-QWHCGFSZSA-N 297.420 2.271 10 10 CECE COc1cccc(CN[C@H]2CCCN(C(C)C)C2)c1O 2158774571 PVVMASTVHFTKBX-AWEZNQCLSA-N 278.396 2.363 10 10 CECE CN1CCc2cc([C@H](CN)N3C[C@H]4C[C@@]4(C)C3)ccc21 2152469698 QWXCXRDZDKFOQU-PVAVHDDUSA-N 271.408 2.021 10 10 CECE Nc1ccc(NC(=O)Cn2ccc(C(F)(F)F)n2)cc1 43298039 UVMTZDQADCGNJK-UHFFFAOYSA-N 284.241 2.123 10 10 CECE CCc1c(CN[C@H](C)c2ccc(O)cc2O)cnn1C 2152901912 IKFTUZJNOWCJLS-SNVBAGLBSA-N 275.352 2.245 10 10 CECE Cn1nc(CN2CCC[C@@H]2CN=[N+]=[N-])cc1Cl 2009447592 YWAPVPSPGXYNPT-SECBINFHSA-N 254.725 2.348 10 10 CECE Cc1cc(N(C)C[C@@]2(C)CCCN2C)ccc1CCN 2154953560 SUWIOSBTBHJJOI-QGZVFWFLSA-N 275.440 2.417 10 10 CECE C[C@H](NC(=O)c1ccc(O)c(O)c1)c1cncs1 2027079856 UAIOMBMXXQPPBF-ZETCQYMHSA-N 264.306 2.045 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H]2CC[C@@H]3O)cc1Cl 2028281963 BWDPTWVEPLKXNP-GYSYKLTISA-N 266.772 2.148 10 10 CECE C[C@H](NCCC1CN(C)C1)c1ccc(F)cc1O 2028460662 BGFARZQCTRNTBP-JTQLQIEISA-N 252.333 2.134 10 10 CECE CC[C@H](NCc1ccc(O)c(O)c1O)[C@@H]1C[C@@H]1C 2029900087 RKIPVXSFKXAFCJ-GDPRMGEGSA-N 251.326 2.328 10 10 CECE C[C@@H](N)c1ccc(N2CC3CC2(CF)C3)cc1O 2030291558 BCTHFGFGXVQEMJ-NAUIOFCNSA-N 250.317 2.350 10 10 CECE CC1(F)CN(c2ccc(C=CC(=O)O)cc2F)C1 2032481856 SLKANDXZSLMBGW-UHFFFAOYSA-N 253.248 2.472 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)C[C@@H]1CCNC1 2036982601 RTABEGRZVUHKEO-WDEREUQCSA-N 252.333 2.134 10 10 CECE CCOC(=O)CCCN1CCC[C@H](N=[N+]=[N-])CC1 2038006135 BBJURSKROUSYQL-NSHDSACASA-N 254.334 2.495 10 10 CECE CN(Cc1c(O)cccc1Cl)[C@H]1CN2CC[C@H]1C2 2040875447 ZFBUMYZOKUBTOQ-GWCFXTLKSA-N 266.772 2.182 10 10 CECE C[C@H]1CN(C(=O)COc2ccc(N)cc2)C[C@@H](C)S1 70381527 VLHLHSKHMWNILX-PHIMTYICSA-N 280.393 2.000 10 10 CECE CO[C@@H](CN1CCc2cc([C@@H](C)N)ccc21)C1CC1 400180396 RHFGLIHNHAKABZ-BZNIZROVSA-N 260.381 2.494 10 10 CECE CCN([C@H]1CCNC1)[C@@H](C)c1ccc(N(C)C)cc1 71311904 DRGWPMZABUBQHK-BBRMVZONSA-N 261.413 2.497 10 10 CECE NCc1ccc(N2CCC(CCCO)CC2)c(F)c1F 401085379 UVYGVVNYNSWXAJ-UHFFFAOYSA-N 284.350 2.412 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CC[C@H]3CC[C@H]2O3)cc1 401656457 NMEBKZJVXWTBNV-BZUAXINKSA-N 276.380 2.170 10 10 CECE CCNCc1ccc(N(CCCO)C2CC2)c(C)c1 404231319 HGJQOJZWEJRXHX-UHFFFAOYSA-N 262.397 2.456 10 10 CECE C[C@@H](N[C@H]1CCc2cn(C)nc2C1)c1ccccc1O 2159965390 TVEXGFWOIMNRGV-YPMHNXCESA-N 271.364 2.334 10 10 CECE COc1cc(F)cc([C@@H](NCCCN=[N+]=[N-])C(=O)O)c1 312363405 AUDUJWFCHDDOSJ-LLVKDONJSA-N 282.275 2.250 10 10 CECE CNCc1ccc(OC)c(CN(C)C(C)(C)COC)c1 312987690 LVAOIUTWPFPCJI-UHFFFAOYSA-N 280.412 2.271 10 10 CECE C[C@H](NCCCc1cn[nH]c1)c1ccc(O)cc1O 314779992 XVIFAQDQRFKHBT-JTQLQIEISA-N 261.325 2.104 10 10 CECE CCN1CCCN(c2c(F)cc(CN)cc2F)[C@H](C)C1 319962306 ITXHDIPMEREHHD-LLVKDONJSA-N 283.366 2.344 10 10 CECE CCNCc1ccc(N(C)Cc2cn(C)cn2)c(F)c1 2160348456 LQWYXDHICLYTLD-UHFFFAOYSA-N 276.359 2.305 10 10 CECE Nc1ccc(CCc2nc(CN3CCCC3)no2)cc1 328014411 QUJWPMRCXIZXAG-UHFFFAOYSA-N 272.352 2.033 10 10 CECE COc1cccc(O)c1CN[C@H](C)c1c(C)cnn1C 2160730094 ZIINQPFXEGNSBM-LLVKDONJSA-N 275.352 2.294 10 10 CECE Cc1cccc(O)c1CNCc1cccc(C(N)=O)c1 2160786387 QTZYUVSYKHWYSV-UHFFFAOYSA-N 270.332 2.089 10 10 CECE Cc1cccc(O)c1CN[C@H]1CCS(=O)(=O)C(C)(C)C1 2160784697 PYHOXBNINZWHBE-LBPRGKRZSA-N 297.420 2.146 10 10 CECE Nc1ccc(OCC(=O)NC2(C3CC3)CCCC2)cc1 2161149997 KEBNNYCIHVOKRI-UHFFFAOYSA-N 274.364 2.487 10 10 CECE Cc1ncccc1[C@@H](C)NC(=O)Cc1ccc(N)cc1 2176563843 XLSHPXCJIQFFBS-GFCCVEGCSA-N 269.348 2.392 10 10 CECE Nc1ccc(C[C@H](O)c2c(F)cncc2F)cc1 702855248 QCXYXYQPZRSPFU-LBPRGKRZSA-N 250.248 2.218 10 10 CECE Cc1nnc([C@@H]2CCCN2c2ccc(CN)cc2C)o1 2171825705 HACIAYRLGISBTR-AWEZNQCLSA-N 272.352 2.487 10 10 CECE Cc1cc(N2CCCNCC2)ccc1O[C@@H]1CCCO1 686722657 VGVLXVQUUSMMPV-MRXNPFEDSA-N 276.380 2.310 10 10 CECE CO[C@H]1CC[C@@H](C)N(c2c(F)cc(CN)cc2F)C1 687205450 PBPDWUMFEADJNF-KOLCDFICSA-N 270.323 2.427 10 10 CECE NCc1ccc(N2CCO[C@H](CF)C2)c(C(F)(F)F)c1 2172050540 MCVQMLDSZVIXJD-SNVBAGLBSA-N 292.276 2.339 10 10 CECE COc1ccc(N(C)[C@H](C)c2cnn(C)c2)c(N)c1 710507270 IAMJJLCXWSLDCM-SNVBAGLBSA-N 260.341 2.208 10 10 CECE CN(C)c1ccc([C@H](CN)N2CC(F)(C3CC3)C2)cc1 2172092604 DZOBKXFNCHTHGZ-HNNXBMFYSA-N 277.387 2.186 10 10 CECE C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)CCS1 379522807 PJGFAEDNEBTEAB-NSHDSACASA-N 264.394 2.165 10 10 CECE CNCc1cc(F)c(N2CC[C@H](CF)C2)c(F)c1 711519808 RODRFTOHKQHPRG-SECBINFHSA-N 258.287 2.480 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])C[C@H]2CCCC[C@@H]21 712413559 GUCQZZADLGXUIY-MDZLAQPJSA-N 266.345 2.398 10 10 CECE CN[C@H](COCCOC)c1ccc(N2CCCC2)cc1 2163096074 GRDATLQWTIVTBD-MRXNPFEDSA-N 278.396 2.210 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@@H]4OCCC[C@@H]43)ccc21 2163066624 NVYXFFKXTDORCR-BHYGNILZSA-N 272.392 2.422 10 10 CECE CCCOc1cc(N2CC[C@@](C)(CO)C2)ccc1N 381244976 WHHNDPWFHLRBPZ-OAHLLOKOSA-N 264.369 2.266 10 10 CECE CN1CCC[C@@H]([C@H](N)c2ccc3c(c2)CCCN3C)C1 2163110994 NQDRZZSGYAOLMU-NVXWUHKLSA-N 273.424 2.411 10 10 CECE CN(Cc1cccc(F)c1O)[C@@H]1CN2CCC1CC2 382428264 KPPWPCZZRPXPHN-CQSZACIVSA-N 264.344 2.057 10 10 CECE CC(C)[C@@H]1CN(c2ccc3c(c2)CCO3)[C@@H](C)CN1 383692393 FBHILLBUXSFABZ-WFASDCNBSA-N 260.381 2.444 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3COC[C@H]3C2)c(F)c1 718243107 FBKKMBHNMUVLNL-RAIGVLPGSA-N 264.344 2.189 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2CC(CO)C3)c(F)c1 719166828 AAFIZDZUTCGFKA-STQMWFEESA-N 264.344 2.024 10 10 CECE CCC[C@@H]1COC[C@@H]1NCc1cc2c(cc1O)OCO2 699474975 QBWMVLDALMBROS-PWSUYJOCSA-N 279.336 2.026 10 10 CECE CC[C@H](N)CCC(=O)N(C)[C@@H](C)c1ccccc1O 391692574 JZSJOMXUQIFNJZ-RYUDHWBXSA-N 264.369 2.429 10 10 CECE CN(Cc1cc(N)ccc1O)CC1([C@H]2CCCO2)CC1 2164386808 VSEFHVNHYBTIFB-OAHLLOKOSA-N 276.380 2.365 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@H](C)C[S@@](C)=O)c(F)c1 398879880 HCPIOYPIVQUXDD-CLFVBBPSSA-N 272.389 2.049 10 10 CECE CC(C)n1ccc(CC(=O)Nc2ccc(O)c(O)c2)n1 2064076077 AMWCPMOLOFPWMU-UHFFFAOYSA-N 275.308 2.056 10 10 CECE O=C(CCC1CCOCC1)Nc1ccc(O)c(O)c1 2065023942 OTENCZDLMGTXNI-UHFFFAOYSA-N 265.309 2.243 10 10 CECE CCN1CCc2cc([C@H](O)[C@]34C[C@@H]3CC[C@@H]4N)ccc21 2177826973 JKYIPIUKPJJBEK-QSPRXWTASA-N 272.392 2.230 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3CCC[C@H](C2)C3O)c(F)c1 2167786940 KRWQTJVIWOGDAK-JYOYUFGNSA-N 278.371 2.443 10 10 CECE C[C@H](C(=O)NCc1ccco1)N1CCC[C@@H]1CN=[N+]=[N-] 2179616150 AERAVGYHIZFHSA-GHMZBOCLSA-N 277.328 2.059 10 10 CECE C[C@H](CC1CN(Cc2ccc(N(C)C)cc2)C1)C(=O)O 2178487488 WWOBQKLLDQPHFY-GFCCVEGCSA-N 276.380 2.295 10 10 CECE CN(C(=O)[C@@H]1CNc2ccccc2N1)[C@H]1CCC[C@@H]1F 2175596167 KOMOIOLNKJHISF-BPNCWPANSA-N 277.343 2.242 10 10 CECE CC[C@H](C(F)F)N(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 2178787354 DUCXTELHDXRDOW-PWSUYJOCSA-N 283.322 2.143 10 10 CECE CCN(CC)CCN(C)c1ccc([C@H](C)NC)c(O)c1 2170086960 BRDUQLKOABXGDM-ZDUSSCGKSA-N 279.428 2.451 10 10 CECE Nc1cnn(Cc2c(O)cccc2F)c1C(F)(F)F 2079042088 DLSXACOJMQALPI-UHFFFAOYSA-N 275.205 2.377 10 10 CECE CN(Cc1ccccc1O)c1ccc(N)c(C(=O)O)c1 2192593865 KQFNBOLVFPCMEM-UHFFFAOYSA-N 272.304 2.309 10 10 CECE COc1ccc(N(C)Cc2ccc3nncn3c2)cc1 2187803778 GRXQGLOCBNDPGY-UHFFFAOYSA-N 268.320 2.374 10 10 CECE Nc1ccc(CNc2ncc3ncsc3n2)cc1 1162786446 WCEVVSYYGZNQRG-UHFFFAOYSA-N 257.322 2.281 10 10 CECE CN1[C@H]2CCC[C@@H]1C[C@@H](NCc1ccccc1O)C2 1172101608 GAIMXRSNNPSKAB-QKDCVEJESA-N 260.381 2.497 10 10 CECE C[C@H]1CC[C@@H](N(C)C(=O)c2cc(O)c(O)c(O)c2)CS1 2188868003 KNLXJDDKGOHUER-WCBMZHEXSA-N 297.376 2.160 10 10 CECE Oc1ccc2ccccc2c1CN1CC[C@H]2CNC[C@@H]21 2188884709 SDTGKRDFBKJZMT-BBRMVZONSA-N 268.360 2.339 10 10 CECE CCC1(CC)C[C@H](NC(=O)Cc2ccc(N)cc2)CO1 2189448836 WXUAHGJFJOZVLD-AWEZNQCLSA-N 276.380 2.275 10 10 CECE CC(C)(C)n1ccnc1[C@H](O)[C@H](N)c1ccccc1O 2189818817 DOEPVUXNTBVWAL-CHWSQXEVSA-N 275.352 2.077 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1cccc2c1ncn2C 2184199684 ZFPMYLQNOSASBT-UHFFFAOYSA-N 272.312 2.346 10 10 CECE 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10 10 CECE C[C@](NCCN=[N+]=[N-])(C(=O)O)c1cccc(F)c1 90256610 GPGFALSAXFRCPF-LLVKDONJSA-N 252.249 2.025 10 10 CECE N[C@@H](c1cc(Cl)cc(Cl)c1O)[C@@H](N)C1CC1 95837094 ROOYUQVWEPXQNS-UWVGGRQHSA-N 261.152 2.436 10 10 CECE CCOc1ccc(O)c(CN2C[C@H](C)OC[C@@H]2C)c1 92018208 FYCAOYSGLMRZAK-RYUDHWBXSA-N 265.353 2.400 10 10 CECE Cc1ccc([C@H](C)N[C@H](C)[C@H](C)N2CCOCC2)c(O)c1 248523092 SJIQATRQJDQFLV-ILXRZTDVSA-N 292.423 2.460 10 10 CECE Cc1c(/C=C\C(=O)NCc2ccc(N(C)C)cc2)cnn1C 255423883 XMXJAKPZVQKOBP-YFHOEESVSA-N 298.390 2.124 10 10 CECE Cc1cc(SCC(=O)Nc2ccc(N)cc2)n(C)n1 52308799 KGXDEEGMPZNLLU-UHFFFAOYSA-N 276.365 2.042 10 10 CECE O=C(O)C1(c2c(Br)ccc(O)c2O)CCC1 258416873 CFTVNOAVXMOTCB-UHFFFAOYSA-N 287.109 2.367 10 10 CECE O=C(Nc1cncc(Cl)c1)c1ccc(O)c(O)c1 691071837 CMZTYJYPBDQNES-UHFFFAOYSA-N 264.668 2.399 10 10 CECE Oc1ccc(F)cc1CNCC1(O)Cc2ccccc2C1 371528359 LHTMYIFONXFZSQ-UHFFFAOYSA-N 287.334 2.151 10 10 CECE Cc1cc(CN(C)CCCCO)ccc1N(C)C 294511429 IRJDTQLIXKGZFA-UHFFFAOYSA-N 250.386 2.265 10 10 CECE CCN1CCc2cc([C@H](N)Cn3cc(C)cn3)ccc21 2163063386 QMHSBAVCNVIEHK-OAHLLOKOSA-N 270.380 2.274 10 10 CECE CCN1CCc2cc([C@@]3(N)CCN(C)[C@@H](C)C3)ccc21 2163063086 OZYYFZWGLSTESW-SUMWQHHRSA-N 273.424 2.337 10 10 CECE CN(C)c1ccc([C@]2(O)CCC3(CCNCC3)C2)cc1 2163067829 AOYFYUMBXZIBAP-KRWDZBQOSA-N 274.408 2.494 10 10 CECE CCN1CCc2cc([C@]3(O)CO[C@H](C4CC4)C3)ccc21 2163074010 OIZAZWMFKNHROG-DLBZAZTESA-N 273.376 2.456 10 10 CECE CN1CCc2cc([C@@H](O)[C@H]3CCNC4(CC4)C3)ccc21 2163074701 VLTCHVHBJVGGAV-GOEBONIOSA-N 272.392 2.245 10 10 CECE NC[C@@H]1[C@H]([C@@H](O)c2ccc(N3CCCC3)cc2)C1(F)F 2163102645 MLTUSVQJEIULDK-MCIONIFRSA-N 282.334 2.160 10 10 CECE CN1CCCc2cc([C@]3(N)C[C@@]4(C)CCO[C@H]43)ccc21 2163104020 AHTGNGVGPNZZOF-BRWVUGGUSA-N 272.392 2.422 10 10 CECE C[C@@H]1CSC[C@]1(O)[C@@H](N)c1ccc2c(c1)CCCN2C 2163242387 HKHGYCZQPCHVKW-XFBWCDHKSA-N 292.448 2.183 10 10 CECE COC(=O)[C@@H](C(C)C)[C@H](O)c1ccc2c(c1)CCN2C 2166984403 ZUQHUZXHYJRXJM-LSDHHAIUSA-N 277.364 2.158 10 10 CECE CC(=O)C(=O)COC(=O)[C@H](C)CSCc1ccccc1 808529841 VVFNEMAOJMJCMF-LLVKDONJSA-N 294.372 2.257 10 10 CECE [N-]=[N+]=NCCN1CC2(C1)CN(Cc1ccccc1)C2 706816742 SKTMSCYOBIQNBW-UHFFFAOYSA-N 257.341 2.115 10 10 CECE COCC[C@@H]1CNCCN1c1ccc2c(c1)CCCC2 2162854244 ITNHKTHJVUVXSW-QGZVFWFLSA-N 274.408 2.380 10 10 CECE NCc1ccc(N2C[C@H](F)[C@H](F)C2)cc1Br 714667844 YTRAGSKOAHSMRG-PHIMTYICSA-N 291.139 2.404 10 10 CECE CN(C[C@H](O)COc1ccc(N)cc1)C1(C)CCCC1 720330715 IPEGAOLYAAYQJR-AWEZNQCLSA-N 278.396 2.273 10 10 CECE CNC(=O)[C@@H]1CCCCN1c1ccc([C@@H](C)N)cc1Cl 723160302 UZMLRDXQBHNORT-YGRLFVJLSA-N 295.814 2.465 10 10 CECE CC[C@@H](NC)c1ccc(N(C)[C@H]2CCN(C)C2=O)cc1 723198505 KSBMXCULMDIFLA-CABCVRRESA-N 275.396 2.024 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@@H](N)[C@H](C(F)(F)F)C1 720874809 PVADJTJJRSQOQA-WHGOUJPWSA-N 292.276 2.414 10 10 CECE COc1cc(O)c(CNC[C@@H]2CCC[C@@H](C)O2)cc1OC 827251918 QYWKKUVMUUTVKU-YPMHNXCESA-N 295.379 2.457 10 10 CECE CCN(C)c1ccc(CN2CC[C@@H]3[C@H](C(=O)O)[C@@H]3C2)cc1 903628010 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CECE CN(Cc1cc(N)ccc1O)C[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134500405 JLKSLXAQNWGFGO-ZPVWCCJJSA-N 258.365 2.308 10 10 CECE CC(C)NCc1cc(F)c(N2CC[C@@H](O)[C@@H]2C)c(F)c1 1914254209 FBGWPSRHVZGBTJ-IINYFYTJSA-N 284.350 2.422 10 10 CECE CO[C@H]1CCN(Cc2cccc(Cl)c2O)C[C@@H]1OC 2134858814 DMVGXZIMMQZTJW-STQMWFEESA-N 285.771 2.281 10 10 CECE CO[C@@H](C(=O)N1CC[C@@H](N=[N+]=[N-])C1)C1CCCC1 1912144877 YDXUQMWOXQKCDQ-GHMZBOCLSA-N 252.318 2.103 10 10 CECE CC(=O)Nc1ccc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)s1 1912144731 XLHVADZRWNKZNB-VIFPVBQESA-N 293.352 2.479 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@H]2Cc3ccccc3O2)CC1 1912196719 MSDMYQJBRQGNQJ-CYBMUJFWSA-N 272.308 2.291 10 10 CECE CCCSC[C@](C)(NCCCN=[N+]=[N-])C(=O)O 1912187085 FHXLCOGMPLFXDB-JTQLQIEISA-N 260.363 2.263 10 10 CECE C[C@@H]1CCO[C@@H]1C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 1912187259 GELGZTYHFCIUFV-UTUOFQBUSA-N 266.345 2.350 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CC(=O)NCCc2cccs2)C1 1912153156 DVQKDVJYBKKVBC-NSHDSACASA-N 293.396 2.182 10 10 CECE CNCc1ccc(OC)c(CN2CC[C@@H](OC)[C@@H]2C)c1 1914319919 AXHCJSPSJCRYAW-SWLSCSKDSA-N 278.396 2.024 10 10 CECE CN1CCc2cc(CN[C@@]3(C)CCCOC3)ccc21 221360429 VUTMUOKLAOXDJR-INIZCTEOSA-N 260.381 2.338 10 10 CECE CC(C)N(C(=O)Cc1ccc(O)c(O)c1)C1CCC1 1444534000 QNUPRJCLBFZPAO-UHFFFAOYSA-N 263.337 2.430 10 10 CECE CO[C@@H]1CCC[C@H](CC(=O)NCc2cc(O)ccc2O)C1 1455350229 BFDFGIXNESDTAG-SMDDNHRTSA-N 293.363 2.309 10 10 CECE C[C@H](NC(=O)c1cnc(C2CC2)nc1N)c1ccccc1O 1454820570 SCYKNJSKQMXKFA-VIFPVBQESA-N 298.346 2.133 10 10 CECE CCN(CC)c1ccc([C@H](C(N)=S)N(C)C)cc1 213189480 YMABXCSCCZNHRW-CYBMUJFWSA-N 265.426 2.422 10 10 CECE COCCCCNC(=O)c1ccc(N=NC(N)=O)cc1 1464213152 LPUDHWLMDWWCTL-UHFFFAOYSA-N 278.312 2.005 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@H](O)C23CCC3)cc1 2136739394 OQFPYGRLCDFVQO-GJZGRUSLSA-N 260.381 2.461 10 10 CECE CC[C@]1(F)CCN(c2ccc3c(c2)NC(=O)[C@@H]3O)C1 1925572770 HDPHLJAUZRTMDX-OCCSQVGLSA-N 264.300 2.001 10 10 CECE CC1(C)CCCO[C@H]1CNC(=O)c1ccc(O)c(O)c1 1923780099 OENJQWYQKIOBRJ-ZDUSSCGKSA-N 279.336 2.033 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](O)CC3(CC3)C2)c(F)c1 1926413240 DOQIGTFHFUPXGW-CMPLNLGQSA-N 264.344 2.197 10 10 CECE CCc1ocnc1CN[C@@H](C)c1c(O)cccc1O 1926420991 NWJJTDGNTHSWJH-VIFPVBQESA-N 262.309 2.499 10 10 CECE CCc1nc(C)c(C(=O)NCc2cc(O)ccc2O)s1 1637126034 KINYEJFIBSITGS-UHFFFAOYSA-N 292.360 2.355 10 10 CECE C[C@]12C[C@](C(=O)N3CCC(CN=[N+]=[N-])CC3)(CO1)C2 2137875570 RFRSGOLAWTWZLW-JOCQHMNTSA-N 264.329 2.104 10 10 CECE CCOC(=O)C(F)(F)CSc1nccs1 1927811832 BDSFUUCHOJPHGD-UHFFFAOYSA-N 253.295 2.434 10 10 CECE C[C@@H](NOCCNC(=O)OC(C)(C)C)c1ccccc1O 1928525436 WKGMMMKZKHQHSE-LLVKDONJSA-N 296.367 2.499 10 10 CECE CCc1ncc(C(=O)NCc2c(O)cccc2O)s1 1639289777 VUXWHGPOZMTDHC-UHFFFAOYSA-N 278.333 2.047 10 10 CECE CSc1ncc(CNC[C@H]2CC[C@@H](CO)C2)s1 2248743422 JJUXCPNCAPTMMP-VHSXEESVSA-N 272.439 2.363 10 10 CECE CC(C)(C)NCc1nc(-c2ccc(O)c(O)c2)no1 232504192 FDQUQTUEYPEYFP-UHFFFAOYSA-N 263.297 2.036 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@@H]3[C@@H]3C[C@H]32)cc1OC 2139685989 AEDYOXCHXICBHT-CYUUQNCZSA-N 258.365 2.259 10 10 CECE C[C@H]1CN(Cc2ccc(F)cc2O)C[C@@]1(C)C(=O)O 2139769866 ZRWPBRBSWISDDH-LKFCYVNXSA-N 267.300 2.074 10 10 CECE Oc1cc(F)ccc1CN[C@H]1C[C@H](c2ncc[nH]2)C1 2139876275 PVGOQWDBVQIFLM-UMSPYCQHSA-N 261.300 2.290 10 10 CECE CCNCc1ccc(N(CC(N)=O)CC(C)C)cc1Cl 233513166 LMYIFVZMGFHTBG-UHFFFAOYSA-N 297.830 2.397 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(F)c2F)CC(C)(C)O1 235350401 NQVMPLZFXRZQKP-SECBINFHSA-N 270.323 2.427 10 10 CECE C[C@H](NCc1ccc(N(C)C)cc1)[C@@H](O)C(F)(F)F 865710589 CBZYKNXSRQOMEQ-JOYOIKCWSA-N 276.302 2.154 10 10 CECE CCN1CCc2cc([C@H](NN)[C@@H]3C[C@@H]3CF)ccc21 1875727470 FMCXWZDRJNHXFK-NFAWXSAZSA-N 263.360 2.179 10 10 CECE COc1ccc(N(CCN)C2CCCCC2)c(N)c1 1875967461 YBTUDXPDOXQVRC-UHFFFAOYSA-N 263.385 2.375 10 10 CECE C[C@@]12CC[C@H]1CN(c1ccc(CO)cc1[N+](=O)[O-])C2 2143202449 MRPHCBZUAZFFQC-FZMZJTMJSA-N 262.309 2.323 10 10 CECE CN(Cc1ccccc1O)[C@@H]1CC[C@H]2CNC[C@H]2C1 1877533175 PKEYHWSIYWPLDY-NWANDNLSSA-N 260.381 2.212 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ncc(C(=O)O)o1 1877522874 BRQLLWOAERHIPC-QMMMGPOBSA-N 262.265 2.276 10 10 CECE C[C@H]1[C@@H](C)[C@H](N(C)c2ccc(CO)cc2)CCN1C 1879228156 UESGQTTWAOAHNC-DVOMOZLQSA-N 262.397 2.344 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)C1(C)CCC1 1879786143 YKNBEGFAQFYUGM-UHFFFAOYSA-N 261.369 2.472 10 10 CECE Oc1ccc(F)cc1CNCc1ccnn1C1CC1 1879757158 SRRVDECPVPPAMT-UHFFFAOYSA-N 261.300 2.353 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)CCCC(=O)N(C)C 2143696413 ATZYWZTXZQIFKP-NSHDSACASA-N 282.359 2.393 10 10 CECE C[C@H](O)CCN(C)c1ccc(CNC2CC2)cc1F 135584120 JQTIIVFJUAJDCF-NSHDSACASA-N 266.360 2.285 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC(C)(C)[C@H]2CO)c(F)c1 1880481144 BXILDYDQMVIBEY-PRHODGIISA-N 271.307 2.225 10 10 CECE C[C@H](C(=O)NCCN=[N+]=[N-])N(C(=O)OC(C)(C)C)C1CC1 1963816444 HKFBCNHQVVNPJT-SECBINFHSA-N 297.359 2.201 10 10 CECE CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(N=[N+]=[N-])C1 1885562762 KKGUFMILFYVKNV-JTQLQIEISA-N 297.359 2.201 10 10 CECE CN(C)C1(CNCc2c(O)cccc2F)CCCC1 1964019764 QDADXVMRNXUQKV-UHFFFAOYSA-N 266.360 2.495 10 10 CECE C[C@H](N[C@H](C)[C@H](O)C(F)(F)F)c1cc(O)ccc1O 1889505443 OYQFNKYUQKSSOK-CVJICSNFSA-N 279.258 2.060 10 10 CECE CCN[C@H](c1ccccc1O)[C@](C)(O)C1CCOCC1 2148155390 VEWRHGDGFRLOJB-HZPDHXFCSA-N 279.380 2.220 10 10 CECE CN[C@@H](c1ccc[nH]1)[C@H](O)c1ccc2c(c1)CCN2C 2148187017 SOGZMTOLCXNTTJ-JKSUJKDBSA-N 271.364 2.001 10 10 CECE CC[C@H](C)[C@H](NC)C(=O)NCc1ccc(N(C)C)cc1 1968439381 YZQZTYKQNAJKFM-WFASDCNBSA-N 277.412 2.003 10 10 CECE NCc1ccc(N2CCOC[C@@H]2[C@@H]2CCOC2)cc1Cl 2144939884 YUOXZPUXNJMNBW-IUODEOHRSA-N 296.798 2.040 10 10 CECE COc1cccc(CN[C@@H]2C[C@H]3CCCCN3C2)c1O 1969660733 LDYFKTRRFNUXNF-ZIAGYGMSSA-N 276.380 2.117 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2C[C@H]1CCOC1 252914586 AADCYFPRNIIXMB-CHWSQXEVSA-N 260.381 2.366 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CCN(C)[C@H]3C[C@@H]32)c1O 1972898304 YHKKZGWQDGVHSB-KBPBESRZSA-N 294.782 2.137 10 10 CECE CC(C)CNCc1ccc(N2CC[C@H]2C(N)=O)cc1Cl 2145599438 MQXSBVXRBWUUCL-AWEZNQCLSA-N 295.814 2.150 10 10 CECE CN(C[C@@H]1[C@H]2CCC[C@H]21)c1ccc2c(c1)NC(=O)[C@@H]2N 2150188382 PZOWNWHRCNFRSO-REJLFOLJSA-N 271.364 2.121 10 10 CECE O=[N+]([O-])c1cnc(S[C@@H]2CCC[C@@H](O)C2)s1 1988548055 GPTNOZPPTDELTB-RNFRBKRXSA-N 260.340 2.447 10 10 CECE Nc1ccc(NC(=O)c2c[nH]nc2Br)cc1 1988871668 NUKUGGQXKMKALL-UHFFFAOYSA-N 281.113 2.007 10 10 CECE Cc1ccc(C)c(Cn2ccc3c(c2=O)CNCC3)c1 2150796583 ZYQKCEZBUNDTOM-UHFFFAOYSA-N 268.360 2.159 10 10 CECE C[C@@H](CN[C@H](C)c1c(O)cccc1O)c1ccn(C)n1 2147078866 GEIJFKCLQCRDNL-WDEREUQCSA-N 275.352 2.286 10 10 CECE COc1ccccc1N1CCN(CCN=[N+]=[N-])CC1 36450320 LNCYJZXPKMJGGB-UHFFFAOYSA-N 261.329 2.128 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@@H]2[C@@H](C(=O)O)[C@@H]21 2151004879 BLPUEWRUVXMJAZ-KNJXUWEQSA-N 279.311 2.387 10 10 CECE C[C@H](N(C)C(=O)CCOc1ccc(N)cc1)C(F)(F)F 2151705219 DOFFRQVIEKNEKF-VIFPVBQESA-N 290.285 2.447 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@@](COC)(OC)C2)cc1 2151844138 RUXIBIZMZDYBIZ-HZPDHXFCSA-N 279.380 2.372 10 10 CECE C[C@@H]1[C@@H](COc2ccc(N3CCNCC3)cc2)C1(F)F 2151823033 OAOLOMITEWRPJL-BXUZGUMPSA-N 282.334 2.376 10 10 CECE Nc1ccc(NC(=O)C[S@](=O)c2ccccc2F)cc1 40963037 SEAZZVJAUAOSML-HXUWFJFHSA-N 292.335 2.154 10 10 CECE CC[C@]1(C)CN(c2cc(OC)c(OC)cc2N)CCO1 2152721668 BYCUNPARRXXLLT-OAHLLOKOSA-N 280.368 2.291 10 10 CECE CN(C)[C@H]1CCCCN(c2ccc(CN)c(F)c2F)C1 2154972923 AXAQVKQUXIRLDP-LBPRGKRZSA-N 283.366 2.344 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1C[C@H]2CC[C@H]1NC2 2016927864 UDCQQFJROGVFSQ-GGZOMVNGSA-N 251.761 2.475 10 10 CECE COC1(OC)CC[C@@H]1Nc1c(N)cccc1Cl 2016952430 BOIMBGRTVPEGBS-JTQLQIEISA-N 256.733 2.486 10 10 CECE C[C@@H]1CN(CCN2CCC[C@H](N=[N+]=[N-])CC2)C[C@@H](C)O1 2155557004 UDDXACVNWYOUQH-MCIONIFRSA-N 281.404 2.260 10 10 CECE CN=c1nc(Sc2nccs2)cc(C(F)F)[nH]1 2021058167 UBHXHRMFVSPILN-UHFFFAOYSA-N 274.321 2.486 10 10 CECE COc1ccc(O)c(CNC2(CCO)CCCC2)c1 289573512 SRWJXPDXMNWXAT-UHFFFAOYSA-N 265.353 2.186 10 10 CECE C[C@H](NCc1ccc(F)cc1O)c1nncs1 2024892230 HMTVTOKBTZCPRV-ZETCQYMHSA-N 253.302 2.234 10 10 CECE N[C@H]1CN(Cc2c(O)cccc2Cl)[C@]2(CCCOC2)C1 2156299219 DFGPITAHFQOOCK-IAQYHMDHSA-N 296.798 2.128 10 10 CECE Oc1ccc(CN[C@H]2CCC[C@@H](F)C2)c(O)c1O 2034890014 BRHZYOOMORZLKF-ZJUUUORDSA-N 255.289 2.174 10 10 CECE C[C@H]1CCO[C@@H]1CN(C)c1ccc(CN)c(F)c1 2034990797 OJHLXCFEKPJJIJ-IINYFYTJSA-N 252.333 2.146 10 10 CECE CN(C)[C@@H]1CCN(c2ccc(CN)c(C(F)(F)F)c2)C1 62963679 IVGMEXHKPNVRNI-GFCCVEGCSA-N 287.329 2.304 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1CC[C@@H](C)OC1 401502690 IJEBEVKOQJRHOC-GHMZBOCLSA-N 278.352 2.425 10 10 CECE CC[C@H]1COC(C)(C)CN1Cc1cc(N)ccc1O 403999164 ZTPXZGDEGAYQQA-ZDUSSCGKSA-N 264.369 2.364 10 10 CECE CSC[C@](C)(O)CN[C@@H]1CCc2cccc(O)c21 311163680 NDJBVBKNPDTFHY-BXUZGUMPSA-N 267.394 2.083 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1cnc(OC)s1 312636454 WSBSNVHRCPHISO-VIFPVBQESA-N 299.356 2.046 10 10 CECE CC(=O)c1csc(NC(=O)Cc2ccc(N)cc2)n1 80847029 FGNVNCQHGLCZQY-UHFFFAOYSA-N 275.333 2.109 10 10 CECE CC(C)O[C@H]1CCN(C(=O)CCc2ccc(N)cc2)C1 701808868 ZLRGJCMIVHIHOS-HNNXBMFYSA-N 276.380 2.227 10 10 CECE CN1CC[C@@H]2[C@H](CCN2[C@@H]2CCc3cccc(O)c32)C1 2170945194 UQXRTRUGECGZOP-RBSFLKMASA-N 272.392 2.406 10 10 CECE CC1(C)CN(C(=O)C2=CC[C@@H](N)C2)c2ccccc21 638027698 ZWEFTOIWXVJGEB-GFCCVEGCSA-N 256.349 2.358 10 10 CECE Cc1ccc([C@@H](C)N(C)[C@@H]2CCCCNC2=O)c(O)c1 2171241435 KYOGGTIGUFVSOS-TZMCWYRMSA-N 276.380 2.362 10 10 CECE C[C@H]1CN(C)CCN(c2ccc([C@H](C)N)cc2F)C1 707089783 BJPUYFKLDUXVEE-RYUDHWBXSA-N 265.376 2.233 10 10 CECE CN(CCC(C)(F)F)c1cc2c(cc1N)OCC(=O)N2 2171891144 IZXRPQCLFQJKHK-UHFFFAOYSA-N 285.294 2.081 10 10 CECE CCN(CCN(C)C)c1ccc([C@H](C)NC)cc1F 688285847 ZGHIHYKSZFCELP-LBPRGKRZSA-N 267.392 2.494 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2CCC[C@@H]2O)c(F)c1 689259806 BMWQVOIWPOZUQJ-GMXABZIVSA-N 267.344 2.476 10 10 CECE Cc1ccc(O)c(CN2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)c1 378344115 YJARZLGFJGUETE-WMHQRMGPSA-N 259.349 2.310 10 10 CECE CCN(C[C@H](O)COc1ccc(N)cc1)CC(C)(C)C 380557157 QLCIERHVSMOGBI-AWEZNQCLSA-N 280.412 2.377 10 10 CECE CN1CCC(C)(NCc2cc(F)ccc2O)CC1 714855949 CEGUVOPOHNYSDJ-UHFFFAOYSA-N 252.333 2.105 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1N(C)CCOc1ccc(N)cc1 384915191 OWRYHZBXPJLQOT-TYNCELHUSA-N 264.369 2.145 10 10 CECE C[C@@H](CO)[C@@H]1CCCCN1c1ccc(CN)cc1F 696714723 QATAGNZMNBIXME-FZMZJTMJSA-N 266.360 2.272 10 10 CECE CC[C@H]1[C@@H](CO)CCN1Cc1cc(C(C)=O)ccc1O 386348651 YARQPVDQUDZSRP-HIFRSBDPSA-N 277.364 2.188 10 10 CECE CCC[C@@H](OC)[C@@H](NCCCN=[N+]=[N-])C(=O)OCC 386450880 NYFBMXJNNGSZQB-GHMZBOCLSA-N 272.349 2.023 10 10 CECE CCN(CC)c1ccc(CN[C@H](C)[C@H](C)O)cc1 387040620 RPPRNDISVDOUGQ-OLZOCXBDSA-N 250.386 2.392 10 10 CECE Oc1c(Br)cccc1CNCc1cnccn1 698093659 VOYOKEKYPBLJNU-UHFFFAOYSA-N 294.152 2.235 10 10 CECE CN(Cc1cc(F)ccc1O)[C@@H]1CN2CCC1CC2 388632788 VZZHQQKJEWBZBH-CQSZACIVSA-N 264.344 2.057 10 10 CECE CN(CC1(C)CCC1)c1ccc2c(c1)NC(=O)[C@H]2O 720519145 CTZMHJMFRLBENH-ZDUSSCGKSA-N 260.337 2.299 10 10 CECE C[C@H](O)CC(C)(C)CNCc1cccc(F)c1O 393593150 RZRLBCLRNSSRKS-JTQLQIEISA-N 255.333 2.418 10 10 CECE C[C@H](O)C[C@@H](C)CN[C@@H](C)c1ccc(O)cc1O 398609660 YFQOEERDQKGAOL-VWYCJHECSA-N 253.342 2.155 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H](C)C[S@@](C)=O)cc1 398883281 JDQNBGNJGSHNAJ-VNBZBWLYSA-N 268.426 2.170 10 10 CECE C[C@@H](N)c1ccc(N(C)CCN(C)C2COC2)c(Cl)c1 2173116017 QHGWRBNRHFAFTB-LLVKDONJSA-N 297.830 2.127 10 10 CECE CSCCc1noc(-c2ccc(O)c(O)c2)n1 829209749 DYZVIUCMDHIACY-UHFFFAOYSA-N 252.295 2.053 10 10 CECE Cc1nc([C@H](O)CCc2ccc(N)cc2)n2c1CCC2 2178030955 VGGMTUFKHUTULU-OAHLLOKOSA-N 271.364 2.386 10 10 CECE CCCOc1cc(N(C)CC2(N)CC2)ccc1[N+](=O)[O-] 2178134785 CKFIJFBOFHHIPO-UHFFFAOYSA-N 279.340 2.311 10 10 CECE CCCNC(=O)C1CN(c2ccc([C@H](C)O)c(Cl)c2)C1 2168055189 UXYHRGFQAASDFX-JTQLQIEISA-N 296.798 2.356 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@]3(CCOC3)C2)cc1Cl 2168212058 MMFXHGDMTVXREO-XHDPSFHLSA-N 297.782 2.389 10 10 CECE CC[C@](O)(C(F)F)[C@@H](NC)c1ccc2c(c1)CCN2C 2178795359 VIAYOSKQUFSVAN-DZGCQCFKSA-N 284.350 2.346 10 10 CECE COc1cccnc1N1Cc2ccccc2[C@H](CN)C1 2176216166 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264.369 2.156 10 10 CECE CCNCc1cc(OC)ccc1N(CC)CCCO 2227683053 SYZOAMKHXQPWLS-UHFFFAOYSA-N 266.385 2.013 10 10 CECE COc1ccc(N2CC[C@H](P(C)(C)=O)C2)c(CO)c1 2227711592 QTWCQURHUMXBCD-ZDUSSCGKSA-N 283.308 2.389 10 10 CECE CCc1nccnc1CNCc1cccc(C)c1O 2228424390 QPWSEJJCNWPYRY-UHFFFAOYSA-N 257.337 2.343 10 10 CECE Cc1cc(N2C[C@H]3CCCC[C@]3(CO)C2)ccc1CO 2238824034 PNNAFDDSAKLZNE-NVXWUHKLSA-N 275.392 2.476 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](O)CC23CCCC3)cc1O 2241041550 VUSCFHSTHNFEQM-WCQYABFASA-N 276.380 2.296 10 10 CECE CCN(CC)c1ccc(CNC2(C(=O)OC)CC2)cc1 2283629159 FEDRRPPIPTXXFQ-UHFFFAOYSA-N 276.380 2.328 10 10 CECE COC[C@]1(C)C[C@@H]1COC(=O)CCc1ccc(N)cc1 2284661011 UMGMRFUZABARNE-CJNGLKHVSA-N 277.364 2.417 10 10 CECE CCC1(C)CN(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2255960022 KJMQABFDDCPWLT-JTQLQIEISA-N 251.334 2.471 10 10 CECE CSc1ncc(CNCc2[nH]ccc2C(=O)O)s1 2257103082 KNSPYQFGTWIAEP-UHFFFAOYSA-N 283.378 2.181 10 10 CECE Cc1cc([C@@H](O)c2ccc(N3CCNCC3)cc2)co1 2286070663 CCXCDYZEDUUOQZ-INIZCTEOSA-N 272.348 2.079 10 10 CECE COC1(CF)CN(c2ccc([C@@H](C)O)c(C)c2)C1 2257462106 FYIXFNPXSSWKNZ-LLVKDONJSA-N 253.317 2.223 10 10 CECE Cc1cc(O)c([C@@H](C)N(C)[C@@H](C)C(N)=O)cc1Cl 2258551410 VGKFUESFCIPYOO-BDAKNGLRSA-N 270.760 2.221 10 10 CECE CSc1ncc(CNC[C@H]2CCNC2(C)C)s1 2248698726 CLAVNBDJJDSUHT-SECBINFHSA-N 271.455 2.343 10 10 CECE CSc1ncc(CNCC2=C(F)CNCC2)s1 2248746887 WSJNDJMFRIKWFC-UHFFFAOYSA-N 273.402 2.172 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)[C@H](C)CF)c(Cl)cc21 2270219397 DWPDULDNWLXVJN-JMCQJSRRSA-N 285.750 2.347 10 10 CECE Cc1nsc(CN(C)c2ccc(CO)cc2F)n1 2260325692 YXESTLITPIPRNL-UHFFFAOYSA-N 267.329 2.114 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1C[C@@H](F)CC[C@@H]1O 2271862925 IUJMWHUPPFUKDK-YDHLFZDLSA-N 267.344 2.323 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2ccnnc2)cc1 2274308556 XKMQGZDEOCSZMV-LBPRGKRZSA-N 256.353 2.393 10 10 CECE CC[C@H](N[C@@H]1C[C@]12C[C@@H]2C(=O)O)c1ccccc1O 2268053040 JCNAONLHQRYNSA-OICBVUGWSA-N 261.321 2.296 10 10 CECE OCC(F)(F)[C@@H]1CCN(c2ccc(OCF)cc2)C1 2278402679 WZUPHQZQKXSZIZ-SNVBAGLBSA-N 275.270 2.446 10 10 CECE COc1ccc(O)c(CNCCC23COCC(C2)C3)c1 2290341995 AQMHEIXELSLWKE-UHFFFAOYSA-N 277.364 2.307 10 10 CECE CN1C(=O)C(=Cc2ccc3nccnc3c2)SC1=S 2296604992 SPGFWQDCKCWKRM-UHFFFAOYSA-N 287.369 2.461 10 10 CECE COc1ccc(N2C[C@H](N)C[C@]23CCOC3)c(C)c1C 2284600376 VWCULCIZRKNRQV-CJNGLKHVSA-N 276.380 2.009 10 10 CECE COc1cccc(O)c1CNCc1nc(C2CC2)ns1 2287907396 QJTUQCBGMCATPG-UHFFFAOYSA-N 291.376 2.420 10 10 CECE Cc1ccc(CN2C[C@H](C)[C@@H](N)C2)c(O)c1Br 2307567499 RYLZTHZBSBWPGS-ONGXEEELSA-N 299.212 2.242 10 10 CECE C[C@H](NC(=O)C[C@H]1CCCNCC1)c1ccccc1O 870987702 APCAWIVXNGXCFN-STQMWFEESA-N 276.380 2.349 10 10 CECE COc1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@H]3O)cc1C 2330915969 NVJKVVDWWXTBKR-AJNGGQMLSA-N 261.365 2.253 10 10 CECE CN(C)c1ccc([C@@](C)(N)[C@@H]2C[C@@H]3CCO[C@H]23)cc1 2333169393 ULCWGJGJTJVDJZ-BJKJVOPESA-N 260.381 2.352 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H]2[C@@H]2C[C@H]32)c(C(=O)O)c1 2333715150 FJQLULYSHHXMKS-AGSIJNCFSA-N 259.305 2.238 10 10 CECE C[C@H](NC[C@@H]1COCC1(C)C)c1c(O)cccc1O 2336158105 CKWDNGRCCRXHJN-WDEREUQCSA-N 265.353 2.421 10 10 CECE Cc1cc(N2C[C@@]3(CO)CC[C@H]2C3)ccc1[C@H](C)N 2336498245 PYEWFHWFDTXJCC-DUVNUKRYSA-N 260.381 2.366 10 10 CECE OCc1ccc(N2C[C@H]3C[C@H](O)[C@H]2C3)cc1C1CC1 2339158359 UZYYTCCRCOPLDO-GTTSAUCSSA-N 259.349 2.016 10 10 CECE COc1ccc(CNC[C@@]2(C)CC=CCO2)c(O)c1 2340198015 ILHFAZUBDTUWCU-OAHLLOKOSA-N 263.337 2.226 10 10 CECE CC(C)[C@@H](O)C(C)(C)CNCc1cccc(O)c1O 2340442587 GBEWWOFAMJFERN-CQSZACIVSA-N 267.369 2.231 10 10 CECE CN[C@H](C)c1ccc(N2CC=C[C@H](O)C2)c(C)c1C 2340849596 XPSDVMDWMXQPKT-KGLIPLIRSA-N 260.381 2.321 10 10 CECE Cc1c([C@H](C)O)ccc(N2CCN(C)[C@H](C)C2)c1C 2340851641 ANORQBDWKIDECY-RISCZKNCSA-N 262.397 2.497 10 10 CECE CC(C)=CCC(=O)N1CCc2cc(O)c(O)cc2C1 2341194073 MYOQCUZGXPZGGO-UHFFFAOYSA-N 261.321 2.339 10 10 CECE CN[C@H]1CCCc2cc(N3C[C@@H](C)[C@@H](O)C3)ccc21 2341299852 LTFYCDCQBURODV-RLCCDNCMSA-N 260.381 2.100 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@H]1[C@H]2C(=O)O 2354634137 AFICZZYSRLDIBE-COPCRZHJSA-N 279.311 2.387 10 10 CECE CCNC[C@H](C)CN1CCN(c2ccc(OC)cc2)CC1 52418130 MFVPEVYDIZAPAG-HNNXBMFYSA-N 291.439 2.063 10 10 CECE Cn1cc(CCNCc2cc(Cl)ccc2O)cn1 112017359 DDXSAJNDMJTXOY-UHFFFAOYSA-N 265.744 2.111 10 10 CECE C[C@H](N[C@@H]1CCOC[C@H]1C)c1ccc(O)cc1O 305987518 NPWREQQLEFZNNH-GBIKHYSHSA-N 251.326 2.173 10 10 CECE Nc1ccc(CN(c2nccn3nccc23)C2CC2)cc1 129967434 JIZOJLDSQQAYPZ-UHFFFAOYSA-N 279.347 2.481 10 10 CECE O=C(O)c1cscc1C(=O)NCc1ccccc1O 312124533 YICDPWHZCBOCBR-UHFFFAOYSA-N 277.301 2.082 10 10 CECE CCN[C@@H](C)c1ccc(N2CCNC(=O)[C@@H]2CC)c(F)c1 216423670 RELLTGYWQCKRSU-FZMZJTMJSA-N 293.386 2.211 10 10 CECE O=C(O)CN1C(=O)/C(=C/[C@@H]2CC=CCC2)SC1=S 39613275 NAEDSAXIBWILRE-WSQKDGNHSA-N 283.374 2.172 10 10 CECE COc1ccc(N2CC[C@H]2C(F)(F)F)c(CO)c1 2220428999 NFNQXELFTKGBNE-NSHDSACASA-N 261.243 2.329 10 10 CECE CC(C)[C@@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 123824273 DEMNDPXRTMELBA-YOEHRIQHSA-N 292.423 2.191 10 10 CECE Oc1cccc(Br)c1[C@H]1CCOCCN1 1952613569 COCYKXFUJSOQBA-SECBINFHSA-N 272.142 2.206 10 10 CECE CO[C@@H]1CC[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)C1 191018132 CMSKDBKMDIVOJB-UKRRQHHQSA-N 291.395 2.119 10 10 CECE Cc1cc(Br)c(O)c(CNCC[C@@H](C)O)c1 134750072 ROKXTRAWXZJPMQ-SECBINFHSA-N 288.185 2.324 10 10 CECE Cc1ccc([C@@]2(N)C[C@H]2C(=O)OC(C)(C)C)c(O)c1 1952766524 XYADGSQQQVFJCJ-NHYWBVRUSA-N 263.337 2.216 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3NC(=O)CC[C@@H]3C2)cc1 226919015 KRYVOCNLFUCKPE-XPKDYRNWSA-N 287.407 2.072 10 10 CECE CCNCc1cc(F)c(N(C)CC(C)(C)O)c(F)c1 92971072 SOVVVNLRFCDIPG-UHFFFAOYSA-N 272.339 2.281 10 10 CECE Cc1cc(Br)cc([C@H](N)[C@H](O)C(C)C)c1O 95804376 CREFTONLAFFZSR-WDEREUQCSA-N 288.185 2.480 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CCCN2C)cc1C 92633132 IBVFXHPPGKHMQU-INIZCTEOSA-N 261.413 2.245 10 10 CECE CCNCc1ccc(OC)c(CN2C[C@H](C)OC[C@H]2C)c1 250199922 QWJOTXQKFRCEQU-KGLIPLIRSA-N 292.423 2.414 10 10 CECE CC(C)C[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1 184879924 KVKXDJZXVWFRLF-LLVKDONJSA-N 265.353 2.439 10 10 CECE Oc1ccc(CNC[C@@H]2C[C@@]23CCCOC3)c(O)c1 1894129709 WCYNTAMKARFROX-SWLSCSKDSA-N 263.337 2.004 10 10 CECE C[C@H]1CCSCCN1CC(=O)c1ccc(O)c(O)c1 385733236 YSKAKDIUTTUGFC-JTQLQIEISA-N 281.377 2.108 10 10 CECE Cc1cc(O)c(CN2C[C@H]3COC[C@@H](C2)O3)cc1C(C)C 800861799 FVUWBUSGMGIUPH-GASCZTMLSA-N 291.391 2.424 10 10 CECE COc1ccc(O)c(CN2CC[C@H](OC(F)F)C2)c1 802658651 LHVCMTQYVPWENY-NSHDSACASA-N 273.279 2.214 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@@H]2C[C@H]3CC[C@H]2O3)cc1 2168148786 RCRDZLCVTYCSLL-FXUDXRNXSA-N 276.380 2.026 10 10 CECE COc1ccc(N2C[C@@H](CN)C3(CCC3)C2)cc1OC 2162670152 IMCGJFWXZJQIMS-GFCCVEGCSA-N 276.380 2.269 10 10 CECE CCCOc1ccc(N2CCNC[C@@H]2CCOC)cc1 2162853905 FAAVPSIGXHOBTH-HNNXBMFYSA-N 278.396 2.290 10 10 CECE CCN1CCc2cc([C@H](N)c3cnc(C)cn3)ccc21 2163072704 ZBNUFNKMLICSAK-INIZCTEOSA-N 268.364 2.216 10 10 CECE CN1CCCc2cc([C@H](COC3CCC3)NN)ccc21 2163099729 KPXHEZRWTUHDDX-HNNXBMFYSA-N 275.396 2.143 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)[C@@H]1CC[C@@H]2C[C@H]21 2165544682 STNPEJLUCRZRSW-KCPJHIHWSA-N 273.380 2.328 10 10 CECE COc1ccc(N2CC[C@H](CN)C2(C)C)c([N+](=O)[O-])c1 2163183571 YDNWAAUJGOEFAB-SNVBAGLBSA-N 279.340 2.167 10 10 CECE COC1(CN(C)Cc2cc(C)ccc2O)CCOCC1 2166135812 KXWZRJKMGCIHLB-UHFFFAOYSA-N 279.380 2.328 10 10 CECE COC1(CN(C)C(=O)CCc2ccc(N)cc2)CCC1 2167883111 CSWFVAVXLQQDOU-UHFFFAOYSA-N 276.380 2.229 10 10 CECE CCOc1ccc(CN[C@](C)(CCF)C(=O)OC)c(O)c1 827352935 UGFZMXHRXCSWAO-OAHLLOKOSA-N 299.342 2.172 10 10 CECE CNCc1ccc(N2CC[C@@H]3OCC[C@H]3C2)c(F)c1 724836605 SYUGPNGUNZRWCE-WFASDCNBSA-N 264.344 2.160 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)c1ccc(N)cc1 722231026 DZGSZLKGBKZREJ-UHFFFAOYSA-N 278.333 2.084 10 10 CECE C[C@H]1CCCC[C@H]1NC(=O)c1cc(O)c(O)c(O)c1 1865875988 LIVZVVFLYSGBES-WCBMZHEXSA-N 265.309 2.112 10 10 CECE C[C@@H](NCC[C@H]1CC(=O)N(C)C1)c1c(O)cccc1F 903210710 MNWAIQFEWWKDFZ-MNOVXSKESA-N 280.343 2.050 10 10 CECE CNC(=O)[C@H](C)CN(C)C/C=C\c1ccc(N(C)C)cc1 835027943 FJVGKZOXCUJNRZ-LMVHVUTASA-N 289.423 2.080 10 10 CECE CCc1cccc(CN[C@H](C)C2(S(C)(=O)=O)CC2)c1O 848911168 QUQSZIUFFRKRCJ-LLVKDONJSA-N 297.420 2.010 10 10 CECE COC[C@H](N[C@H]1CCc2cccc(O)c21)C1CCOCC1 850493878 KWKQGCLWDQAQRZ-GJZGRUSLSA-N 291.391 2.411 10 10 CECE C[C@H](CCN(C)C)N[C@H](C)c1ccc(O)cc1O 49553156 PLFLWTCQCYXURI-GHMZBOCLSA-N 252.358 2.089 10 10 CECE CS[C@@H](C)C(=O)NCc1ccc2cccnc2c1O 862029570 ZAVIJURQZCPHRO-VIFPVBQESA-N 276.361 2.308 10 10 CECE CCCN1CCC[C@H]1C(=O)N(C)Cc1ccccc1O 769281386 YXSAMGHXRRTZSO-AWEZNQCLSA-N 276.380 2.225 10 10 CECE C[C@H]1C[C@H]1NC(=N)NCc1cc(Cl)ccc1O 864470517 ZWHFVUORCSGADH-OIBJUYFYSA-N 253.733 2.068 10 10 CECE CN1C(=O)C2(CCCC2)N[C@@H]1c1ccc(F)c(F)c1O 864386219 WAEJAAHWZYDNMN-LBPRGKRZSA-N 282.290 2.043 10 10 CECE C[C@H](NC(=O)NCCOC1CCC1)c1ccccc1O 868323519 NDKKIRIAOVJRAN-NSHDSACASA-N 278.352 2.322 10 10 CECE Cc1ccc(O)c([C@H](C)N(C)CC(=O)N2CCCC2)c1 132707130 XXEURPIKSFSTMF-ZDUSSCGKSA-N 276.380 2.316 10 10 CECE CCOc1ccc(CN[C@@H]2CCN[C@H]2CC)c(O)c1 863484474 ZXMQHFVBMOPLKN-UONOGXRCSA-N 264.369 2.021 10 10 CECE O=C(NC[C@@H]1CCC12CCOCC2)c1cccc(O)c1O 871585593 PYAQCYIBYKVEOY-NSHDSACASA-N 291.347 2.034 10 10 CECE COC(C)(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773018759 XFIPRRDJFCELKO-LLVKDONJSA-N 264.369 2.355 10 10 CECE Nc1ccc(Cn2c(CO)nc3ccc(F)cc32)cc1 76079308 DHQVEXBWSCHFKM-UHFFFAOYSA-N 271.295 2.298 10 10 CECE Cc1cccc(CNC[C@H](O)C(F)(F)C(F)(F)F)c1O 895678313 SVZLDJYNUNLNIT-VIFPVBQESA-N 299.239 2.349 10 10 CECE O=C(NC1CCOCC1)c1cc2cc(O)c(O)cc2s1 895794176 FKBUZRUJBITKAH-UHFFFAOYSA-N 293.344 2.221 10 10 CECE C[C@]1(NC(=O)c2cc3cc(O)c(O)cc3s2)CCOC1 897226901 UUIPAVOBRJEJOD-AWEZNQCLSA-N 293.344 2.221 10 10 CECE CCN(Cc1cccc(OC)c1O)C(C)(C)C(=O)O 86759496 INJFDWSWOXEHRA-UHFFFAOYSA-N 267.325 2.086 10 10 CECE C[C@@](NCCN=[N+]=[N-])(C(N)=O)c1ccc(F)c(Cl)c1 90257801 NYNMAUFGNCQPIU-NSHDSACASA-N 285.710 2.080 10 10 CECE COc1ccc([C@@H](C)N[C@@H](C)C(OC)OC)c(O)c1 79639508 WICPEMFWYXPYKK-ZJUUUORDSA-N 269.341 2.059 10 10 CECE CCC[C@H](COC)NCc1cc2c(cc1O)OCO2 79739113 NIXYEFSZZIZZGT-LLVKDONJSA-N 267.325 2.026 10 10 CECE CC[C@@H]1C[C@@H](N[C@H](C)c2cc(O)ccc2O)CO1 688487846 OYQNEPHQLGONAY-CKYFFXLPSA-N 251.326 2.316 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1nnc(C2CC2)s1 1144100811 HMBLVCIDEOAZGW-UHFFFAOYSA-N 291.332 2.008 10 10 CECE C[C@@]1(CNC(=O)Nc2ccc(N)cc2)CC1(F)F 689230748 CHHLQERHMJMFLZ-NSHDSACASA-N 255.268 2.436 10 10 CECE CC(C)(C)[C@H]1CN(c2ccc3c(c2)OCO3)CCN1 86126621 QRBDXVVVMKPPMB-CQSZACIVSA-N 262.353 2.240 10 10 CECE C[C@@H]1CCO[C@@H]1CCNC(=O)Nc1ccc(N)cc1 1918102199 WZGLJNBOIRNXDM-ZWNOBZJWSA-N 263.341 2.205 10 10 CECE O=c1ccc2c([nH]1)CCC[C@@H]2NCc1ccccc1O 134230635 PCZCMSNAILIZFJ-ZDUSSCGKSA-N 270.332 2.248 10 10 CECE CCNCc1ccc(N2CC[S@@](=O)C[C@H]2C)c(C)c1 2115327106 YBNVPYDPVRTELC-BFUOFWGJSA-N 280.437 2.062 10 10 CECE CNCc1ccc(N(C)CC2[C@@H]3COC[C@@H]23)c(Cl)c1 2118008514 DFTGANGZCNAAIX-STQMWFEESA-N 280.799 2.388 10 10 CECE COc1ccc(N2CCNC[C@@H]2CC(F)F)c(F)c1 2127064566 VXWYWDZIYHABAG-VIFPVBQESA-N 274.286 2.268 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCC[C@@H]1CC[C@H]2C[C@@H]12 1177999024 WQBZJLWAXRFDSM-AVGNSLFASA-N 275.348 2.193 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc2c(c1)CCC[C@@H]2N 2128271408 NNZAJJQPSKIKLX-OZVIIMIRSA-N 260.381 2.230 10 10 CECE Nc1ccc(CCOCCN2C[C@H]3CC[C@H]2C3)cc1 2119734519 VJUNZYXRJAADIA-HOCLYGCPSA-N 260.381 2.312 10 10 CECE CN(c1ccc(CN)cc1F)[C@H]1C[C@@H]2CC[C@H](C1)O2 2124958659 TZGURMHGWFXCQF-XYYAHUGASA-N 264.344 2.431 10 10 CECE CN[C@@H]1CCc2cc(N(C)[C@@H]3CCN(C)C3)ccc21 2128315601 UQBZRXBSSHTJNS-GDBMZVCRSA-N 259.397 2.034 10 10 CECE CC[C@@H]1COC[C@H]1N(C)c1ccc2c(c1)CC[C@@H]2N 2128316914 AJBFLJCVTMBHPJ-XFBWCDHKSA-N 260.381 2.494 10 10 CECE C[C@@H](O)[C@H]1CCCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128315607 UQWKTPLLKUDHNC-FFSVYQOJSA-N 261.365 2.263 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc2c(c1)CC[C@H]2O 2128316989 APFFCBREIOSCKM-APHBMKBZSA-N 261.365 2.263 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)C[C@]1(C)CO 2128323629 VTKQVFQSJFOYEG-HFBAOOFYSA-N 261.365 2.121 10 10 CECE CO[C@@H]1CCC[C@@H](CNCc2cccc(O)c2O)C1 2126434828 ZSJWTYBGEFXYAN-DGCLKSJQSA-N 265.353 2.393 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2COC3CC2C3)c(F)c1 2126708628 VFRLRHUCTILJMG-HGOJYGERSA-N 264.344 2.459 10 10 CECE CC[C@@H](N)C(C)(C)C(=O)N(C)Cc1ccccc1O 2131844458 ZCJQQSIPKBNEOO-CYBMUJFWSA-N 264.369 2.114 10 10 CECE FC(F)(F)Oc1ccc(N2CC[C@H]3CNC[C@H]32)cc1 2132371588 RZLPPGAGTSMCGN-JOYOIKCWSA-N 272.270 2.383 10 10 CECE CN1CCC(C)(c2noc(-c3sccc3O)n2)CC1 1902664175 FXUXGQWGVZVKPJ-UHFFFAOYSA-N 279.365 2.487 10 10 CECE Cc1cc(CNCc2ccc(F)c(F)c2O)ncn1 2130069072 CZDHFYTVDPXSGX-UHFFFAOYSA-N 265.263 2.059 10 10 CECE C[C@H]1O[C@@]2(C(=O)N3CCC[C@H]3CN=[N+]=[N-])CC[C@H]1C2 1908147089 UJAUWQALLGJSMG-BLFANLJRSA-N 264.329 2.245 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NN1CCOCC1 214560546 XFLCJVDXNXYZQO-RYUDHWBXSA-N 262.353 2.086 10 10 CECE OC[C@@H]1CCCC[C@@H]1NCc1ccc2c(c1)CCO2 219017905 AWFWABBLLIRBSS-GJZGRUSLSA-N 261.365 2.262 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)n1ccnc1 106033211 GOWNQDDRPMBPBA-UHFFFAOYSA-N 272.352 2.439 10 10 CECE CC[C@H](C)NC(=O)[C@@H](C)N1CCC[C@H](N=[N+]=[N-])C1 1912163948 PYPQEAIBYGUXCO-AXFHLTTASA-N 253.350 2.064 10 10 CECE CSc1ccc([C@@H](NCCCN=[N+]=[N-])C(N)=O)s1 1912192552 HIOPIWGWVTUOTL-SECBINFHSA-N 285.398 2.286 10 10 CECE Cn1nc(C(=O)N2CCC[C@H]2CN=[N+]=[N-])cc1C(F)F 1912155119 FYMKJDWDASZBGY-ZETCQYMHSA-N 284.270 2.273 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)COC2CCC2)C1 1912155703 JJYHXLOHWSUHBD-JTQLQIEISA-N 252.318 2.104 10 10 CECE [N-]=[N+]=NC1CCN(Cc2ccccc2C(N)=O)CC1 1912170750 BFSBLAZGUDWPOB-UHFFFAOYSA-N 259.313 2.060 10 10 CECE CCOC(=O)C(C)(C)CN1CC[C@H](CN=[N+]=[N-])C1 1912187200 IRCQSGUFZTYUHU-SNVBAGLBSA-N 254.334 2.208 10 10 CECE Cc1c([N+](=O)[O-])ccnc1CN1CC[C@@H](CN=[N+]=[N-])C1 1912204467 JXDPHXXONRYPFR-JTQLQIEISA-N 276.300 2.430 10 10 CECE CNC(=O)[C@H](C)N(C)c1ccc([C@@H](C)NC)cc1Cl 1916817456 BQUZXZNZLDAKDK-ZJUUUORDSA-N 283.803 2.191 10 10 CECE C[C@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1CN=[N+]=[N-] 1535960002 BDUPSZUPFFJKOH-BDAKNGLRSA-N 256.306 2.321 10 10 CECE Cc1cccnc1/C=C/C(=O)NCc1ccc(O)cc1O 1469159551 KRFZULXMZDUOBD-VOTSOKGWSA-N 284.315 2.131 10 10 CECE CC(C)N(C)CCCN[C@H](C)c1cc(O)ccc1O 226337063 VJMXIZXTRWHVQD-GFCCVEGCSA-N 266.385 2.479 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)[C@H]1CCC=CO1 1920949021 HAAORPSOGHBVBK-OAGGEKHMSA-N 277.364 2.487 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](O)CC(C)(C)C2)cc1O 1923164500 WYXCJRZHEQGNID-AAEUAGOBSA-N 278.396 2.270 10 10 CECE Cc1cccc(O)c1CN1C[C@H](C)CC[C@H]1C(=O)O 2136364421 NWCSHMIGKPWXDJ-MFKMUULPSA-N 263.337 2.386 10 10 CECE CC(C)(C(=O)NCc1c(O)cccc1O)[C@H]1CCCCO1 1558534997 AUDLBGWCGSPYRT-CQSZACIVSA-N 293.363 2.309 10 10 CECE CSCCCCC(=O)NCc1c(O)cccc1O 1558534177 OXAFKXGACDDBPH-UHFFFAOYSA-N 269.366 2.247 10 10 CECE CN[C@@H](C)c1ccc(N2CC(=O)N(C)[C@H](C)C2)cc1Cl 1925984028 LXLLTQLUMXQFQH-MNOVXSKESA-N 295.814 2.287 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@@H](O)C1(C)C 2136632273 XFHLJKBDMOVADB-OAHLLOKOSA-N 262.397 2.453 10 10 CECE COc1cc(Cl)cc(CN2C[C@H](C)[C@H](N(C)C)C2)c1O 229119717 RCIJVOHANSQNEX-GXFFZTMASA-N 298.814 2.436 10 10 CECE Cc1noc(C2CC2)c1C(=O)NCc1c(O)cccc1O 1639292898 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O=C1NN(c2ccccc2)C(=O)/C1=C/C=C/c1ccco1 6475487 PTDRFTNUSKZRCZ-QXAPVUDZSA-N 280.283 2.297 10 10 CECE C[C@H]1[C@H](C)C[C@H](N)CN1Cc1ccc(N(C)C)cc1 252197539 VSTDRBGPPABBNB-IPYPFGDCSA-N 261.413 2.310 10 10 CECE CCOC(=O)C(C)(C)NCc1ccc2c(c1)CCO2 258733592 HDZDNEWDIUWQFU-UHFFFAOYSA-N 263.337 2.053 10 10 CECE Oc1cc(Cl)ccc1CN[C@H]1CC[C@H](O)CC1 1942491011 DZVFLEIPNPXAHV-HAQNSBGRSA-N 255.745 2.439 10 10 CECE COc1cccc(CNCCC2CC(OC)C2)c1O 850341364 IDEZWNGUGVFCAR-UHFFFAOYSA-N 265.353 2.306 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)[C@@H]2CC[C@]2(C)C1=O 2142221111 RALOKJNDHPLDIJ-VPJDZLOFSA-N 259.305 2.238 10 10 CECE Nc1ccc(N2CCC(C3CCNCC3)CC2)cc1 1876351257 JMTPKVBNXPRYNM-UHFFFAOYSA-N 259.397 2.485 10 10 CECE CN(Cc1ccccc1O)[C@H]1C[C@H](CN)C12CCC2 1877544559 FKGRDOCHFOWMKU-HIFRSBDPSA-N 260.381 2.342 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCCC[C@@H]2CO)c(F)c1 1880486317 NQEOXWQJJFMFQX-MWLCHTKSSA-N 271.307 2.369 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](N(C)C)C2)c(F)c1 1880925625 DQRWCQVHBYVHRV-ONGXEEELSA-N 269.339 2.125 10 10 CECE CN1CC[C@@H](CCNCc2c(O)cccc2Cl)C1=O 1880926863 HKWYPRPSVBXDNX-SNVBAGLBSA-N 282.771 2.004 10 10 CECE CCN[C@H](C)c1cc(F)c(N(CC)CCO)c(F)c1 1880962887 PAGYKJICPRKFHH-SNVBAGLBSA-N 272.339 2.454 10 10 CECE CN(C)CC(C)(C)CNCc1c(O)cccc1F 1964020340 WLAWWHGVWGSAIO-UHFFFAOYSA-N 254.349 2.209 10 10 CECE CN(CC(=O)N1CCC[C@@H](N=[N+]=[N-])C1)C(=O)OC(C)(C)C 1885562619 IHHFPIKONNXQSF-SNVBAGLBSA-N 297.359 2.155 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@H](O)C(F)(F)F)CC1 1949762979 VQWLRWIQZPMLPW-YUMQZZPRSA-N 252.240 2.074 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC2(CCNC2)CC1 2143831431 PYARSIFAWGXQTJ-GFCCVEGCSA-N 276.380 2.234 10 10 CECE CN(CC[C@H]1CCCO1)C(=O)Nc1ccc(N)cc1 1968636272 WVEARKZNLBVBOQ-CYBMUJFWSA-N 263.341 2.302 10 10 CECE Nc1ccc(CN2CCC[C@H](OC(F)F)C2)cc1 1969011430 IFCPBBWHVOCPAA-LBPRGKRZSA-N 256.296 2.472 10 10 CECE CCCNCc1ccc(N2CC[C@@H](O)[C@H](F)C2)c(F)c1 2144566193 IRJNJUKUIZNHTR-UKRRQHHQSA-N 284.350 2.234 10 10 CECE CC[C@H](O)CN(C)c1ccc(CN)c(Br)c1 1977858970 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Nc1ccc(NC(=O)N[C@@H]2CC[C@H]3OCC[C@@H]3C2)cc1 2150468900 YQNLKVXBIRPGGM-LERXQTSPSA-N 275.352 2.348 10 10 CECE Cc1cccc(CNCc2nnc3ccccn23)c1O 164939772 BDPLSZACKMYNOV-UHFFFAOYSA-N 268.320 2.033 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1cc(F)n(C)n1 2150729322 SYKRRFNVRRLJJB-HNNXBMFYSA-N 276.359 2.324 10 10 CECE C[C@H]1[C@H](C)C[C@@H](C)CN1S(=O)(=O)Cc1ccc(N)cc1 166112934 RGTLSYWQWGOZNC-UPJWGTAASA-N 296.436 2.465 10 10 CECE C[C@H](c1cc(O)ccc1O)N1[C@H]2CC[C@@H]1C[C@H](CN)C2 2159210456 HTARAMHTPAXCJO-FVCCEPFGSA-N 276.380 2.361 10 10 CECE CP(C)(=O)CCC(=O)N1CCC[C@H]1CN=[N+]=[N-] 2008522462 SPOFAGPIAIIGBA-VIFPVBQESA-N 258.262 2.301 10 10 CECE COC[C@@]1(OC)CCCN(c2ccc(CO)cc2Cl)C1 2151854209 MHSKEFQRZPDGPD-OAHLLOKOSA-N 299.798 2.464 10 10 CECE CC[C@H](C)OC(=O)N1CCN(c2ccc(N)cc2)CC1 2152101707 AJFKFNWKRSWMLN-LBPRGKRZSA-N 277.368 2.326 10 10 CECE CN(Cc1cncn1C1CC1)c1ccc(CN)cc1F 2152993793 DGLDROJXEGMPFZ-UHFFFAOYSA-N 274.343 2.452 10 10 CECE CP1(=O)CCN(Cc2ccc(F)cc2O)CC1 2024828033 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CO[C@@H](COC(=O)Cc1ccc(N)cc1)C(C)C 311046913 HNMJFIPJIQHBAD-ZDUSSCGKSA-N 251.326 2.026 10 10 CECE CO[C@@H]1COCC[C@H]1N[C@H](C)c1ccc(C)cc1O 311607539 DVCSMJFWZLYWQB-UXIGCNINSA-N 265.353 2.155 10 10 CECE CNCc1ccc(N2CCC[C@]23CC[S@](=O)C3)cc1C 2158454803 QEIPNDSPBYCACZ-UZLBHIALSA-N 292.448 2.206 10 10 CECE CN(C[C@@H]1C[C@]12CCOC2)c1ccc(CN)c(F)c1F 2156754820 PJGOFNRBOYAQLZ-NHYWBVRUSA-N 282.334 2.286 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)[C@H]1CCN(C)C1 312987734 LVYKSOMKOSMZGV-INIZCTEOSA-N 273.424 2.387 10 10 CECE C[C@H](O)c1ccc(N2CC3(C2)OCCC[C@H]3O)cc1Cl 2159662509 JPLCLEKXMDSTKQ-IINYFYTJSA-N 297.782 2.123 10 10 CECE CN1CCc2cc([C@H](O)[C@H](N)[C@H]3CCC[C@H]3F)ccc21 2175525371 GAYQRCTWFJWYQM-XNISGKROSA-N 278.371 2.178 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)CC2[C@H]3CC[C@H]23)cc1 2160074661 WUHMXEBPTJJFFU-ZOBUZTSGSA-N 273.424 2.340 10 10 CECE COc1ccc(N2CCN[C@](C)(C3CC3)C2)c(OC)c1 86123890 NWNYCKXOGHUAJV-INIZCTEOSA-N 276.380 2.282 10 10 CECE c1cc2c(cc1CNC1C[C@@H]3CNC[C@H]3C1)CCCO2 2160557220 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2.199 10 10 CECE CN[C@H]1CCCN([C@H](C)c2cc(O)ccc2O)CC1 2340126825 VABFPVCDSMFPTP-NEPJUHHUSA-N 264.369 2.233 10 10 CECE Cc1c([C@@H](C)O)ccc(N(C)C[C@H]2CCN2C)c1C 2340852633 YZAGHCSWTHTFOF-ZIAGYGMSSA-N 262.397 2.497 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC3(C=CCO3)C2)c1C 2340862156 SAVYGWVLIHBDTR-ZDUSSCGKSA-N 258.365 2.468 10 10 CECE Oc1cc(Cl)ccc1CNC[C@]1(O)C[C@H]1C(F)(F)F 2344267649 KDLAMPOVEFZUIB-GHMZBOCLSA-N 295.688 2.449 10 10 CECE CSc1cc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)ccc1CN 2353855680 OVAZFAMWNFGOQP-ZSOGYDGISA-N 278.421 2.196 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])C[C@@H]2C[C@H]1[C@H]1C[C@@H]21 2355326522 SKQINWWXOZCEBZ-JNLQPACOSA-N 278.356 2.254 10 10 CECE CCNCCCCN1CCN(c2ccc(OC)cc2)CC1 52418112 GEAIPEDRNRESLA-UHFFFAOYSA-N 291.439 2.207 10 10 CECE [N-]=[N+]=NCCNC(=O)Nc1cccc([N+](=O)[O-])c1 42012718 FXOJFOAACYRBOM-UHFFFAOYSA-N 250.218 2.027 10 10 CECE C[C@@H](NC[C@@H]1CCN(C)C1)c1ccc(F)cc1O 62747645 OJQAXJYVUKXNHD-MNOVXSKESA-N 252.333 2.134 10 10 CECE C[C@H]1C([C@H](O)[C@@H](N)c2ccc3c(c2)CCCN3C)[C@@H]1C 2357107626 ABRDLSZBACIFKA-BBHZHJQOSA-N 274.408 2.332 10 10 CECE Cc1ccc(C(=O)NC[C@@H]2CCC(C)(C)O2)c(O)c1O 187336016 CYZJCXYOGYDJOQ-JTQLQIEISA-N 279.336 2.094 10 10 CECE C[C@@H]1CCC[C@@H](C)N1NCc1cccc(O)c1O 213894552 YQYYIKGZJUKHBH-GHMZBOCLSA-N 250.342 2.365 10 10 CECE C[C@H]1CCCCCN1CC(=O)N(C)c1ccc(N)cc1 70408016 KFGFEUOHCBUEKN-ZDUSSCGKSA-N 275.396 2.496 10 10 CECE COc1ccc([C@@H](N[C@@H](C)CO)c2ccccc2)c(O)c1 35602912 GSHYOHOOTFECMH-SJCJKPOMSA-N 287.359 2.461 10 10 CECE C[C@@H](Nc1ccc(CC(N)=O)cc1)c1cc(O)ccc1O 37074902 WVYJSQMHJPUSKU-SNVBAGLBSA-N 286.331 2.299 10 10 CECE CCCN(Cc1ccc(N)cc1)S(=O)(=O)C(C)C 37657257 KCNQQCGYGGHSJC-UHFFFAOYSA-N 270.398 2.219 10 10 CECE COC(=O)[C@@H]1CCN[C@H]1c1c(C)n(C)c2ccccc12 1952856740 BRXGKARCVCKCIT-IUODEOHRSA-N 272.348 2.310 10 10 CECE CC(C)CCNC(=O)[C@@H](C)NCc1ccccc1O 228415176 KHHYHQGUTAVECP-GFCCVEGCSA-N 264.369 2.033 10 10 CECE C[C@@H]1CN(C(=O)c2ccc(O)c(O)c2)C[C@@H](C)S1 226998166 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N[C@@H](c1ccc(Br)cc1O)[C@@H](O)C1CCC1 396701736 YVJAWAAKNNIDPN-RYUDHWBXSA-N 286.169 2.316 10 10 CECE N[C@@H](c1cc(Br)ccc1O)[C@H](O)C1CCC1 396458448 RDRIZIYTMDAFAK-NWDGAFQWSA-N 286.169 2.316 10 10 CECE Cc1cn(C)nc1CNCc1cc(F)cc(F)c1O 723513371 YHWQSFBBOZYYPW-UHFFFAOYSA-N 267.279 2.002 10 10 CECE CNCc1cc(F)c(N2C3CCC2(CO)CC3)c(F)c1 722974472 XWXUXUGEAOSEOA-UHFFFAOYSA-N 282.334 2.178 10 10 CECE C[C@](NCc1ccc2c(c1)CCO2)(C(=O)O)C(F)(F)F 720759095 BAGXXGQJKOVLRH-LBPRGKRZSA-N 289.253 2.117 10 10 CECE Cc1c(CN2CCNC[C@@H]2C)n(C)c2ccccc12 722384158 CALIBWZERLKGLO-LBPRGKRZSA-N 257.381 2.280 10 10 CECE Cc1ccc(O)c(CNC(=O)[C@H](C)[C@H]2CCCO2)c1 913000659 QRVWICWPPPGWHF-BXUZGUMPSA-N 263.337 2.132 10 10 CECE CC(C)(CN[C@H]1CCc2cccc(O)c21)[C@@]1(O)CCOC1 842920953 UKQTUCQXFLRAEZ-SUMWQHHRSA-N 291.391 2.147 10 10 CECE COc1cccc(O)c1CN[C@H]1CC[C@H](N(C)C)CC1 2177928833 IOWVNESAEAFBFV-JOCQHMNTSA-N 278.396 2.363 10 10 CECE CN(C)c1ccc(OCc2cn(CC3CC3)nn2)cc1 842044943 ZPDKWOVOOWZYNM-UHFFFAOYSA-N 272.352 2.333 10 10 CECE Cc1cc(O)c(CNCCN2CCOC[C@H]2C)c(Cl)c1 840888672 BXNJFIMCYZUOGP-GFCCVEGCSA-N 298.814 2.164 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2CCC[C@H](F)C2)cc1 1345642064 OKJMJRDXCWHVCA-NEPJUHHUSA-N 250.317 2.413 10 10 CECE Cc1cc(CC(=O)N2CCOCC2)c(C)n1-c1ccccc1 854131571 WKYDSYYMWCAQDL-UHFFFAOYSA-N 298.386 2.495 10 10 CECE CCNC[C@H]1CCN(c2ccc(OC)cc2OC)C1 53011733 FAKLAPDERWUJKM-GFCCVEGCSA-N 264.369 2.140 10 10 CECE Cc1cccc(O)c1CN[C@H]1C[C@H]1NC(=O)OC(C)(C)C 1955542741 DWOZKDDCCFUURZ-QWHCGFSZSA-N 292.379 2.456 10 10 CECE Cc1ccc(C(=O)NC[C@H]2CCN2C(C)(C)C)c(O)c1O 855163590 DLIVDERNGYSFEX-LLVKDONJSA-N 292.379 2.009 10 10 CECE CN(C)c1ccc(/C=C\CNCC[C@@H](O)C(F)F)cc1 865688219 VQLAWFKOZNRHJL-VQTKUKTRSA-N 284.350 2.372 10 10 CECE Nc1ccc(OCCOc2cccn3ccnc23)cc1 57839517 HOLGMLUQYUKTJZ-UHFFFAOYSA-N 269.304 2.374 10 10 CECE CC[C@@H](CNC(=O)N[C@@H](C)c1ccccc1O)OC 868630112 QNFAWZSPENNMBV-QWRGUYRKSA-N 266.341 2.177 10 10 CECE CCCN1C(=O)CC[C@@H](N)[C@H]1c1ccc(N(C)C)cc1 62212183 VDGALWXDTCAHIN-GDBMZVCRSA-N 275.396 2.153 10 10 CECE Nc1ccc(-n2c([C@@H]3CCCNC3)nc3cccnc32)cc1 76006733 DSAMBQNIJMKDFT-GFCCVEGCSA-N 293.374 2.470 10 10 CECE C[C@H](CCNCc1cccc(Cl)c1O)[S@@](C)=O 165398936 RCAGFZMYYCJWME-XLFHBGCDSA-N 275.801 2.292 10 10 CECE COc1ccc(N2CCC[C@H](C(=O)O)C2)cc1OC 82719697 ZWPKIPHBJVSRDR-JTQLQIEISA-N 265.309 2.005 10 10 CECE COc1cc(Cl)c(O)c([C@@]2(C)CO[C@@H](C)CN2)c1 83534860 IIFVXGBBDUIWQQ-ISVAXAHUSA-N 271.744 2.278 10 10 CECE [N-]=[N+]=NCCNC(=O)c1csc(-c2ccco2)n1 701319014 LLGSWXQFZOPLHO-UHFFFAOYSA-N 263.282 2.443 10 10 CECE CCN(CCN(C)C)[C@H](C)c1ccc(F)cc1O 688947940 KITRPYUUUWGNHX-LLVKDONJSA-N 254.349 2.476 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H]3C)c(Cl)cc21 706732011 QZCOTMNGWSYDBH-JVXZTZIISA-N 265.744 2.151 10 10 CECE C[C@H](N[C@H](C)c1ccc(O)cc1O)C(=O)OC(C)(C)C 707249477 XBMXDQAUUQMKOI-ZJUUUORDSA-N 281.352 2.479 10 10 CECE C[C@H](NC[C@@]12COC[C@@H]1C2)c1cc(F)ccc1O 689194231 NEQHKFDNDYGYTG-BHDSKKPTSA-N 251.301 2.218 10 10 CECE CN(C[C@]1(C)CC1(F)F)c1ccc2c(c1)NC(=O)[C@H]2O 689359497 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CC1(C)CCN(C(=O)Nc2ccc(N)cc2)C[C@H]1CO 1968120546 DAYFLUFRXCQIRQ-NSHDSACASA-N 277.368 2.141 10 10 CECE COc1cc(Cl)cc(CN2CCC3(CC2)CNC3)c1O 2145083043 OHXCXBZXJKLRJL-UHFFFAOYSA-N 296.798 2.240 10 10 CECE Cc1cccc(O)c1CN1CCCC[C@@H](C(=O)O)C1 1972909557 PTYVFBFGXDUWMH-GFCCVEGCSA-N 263.337 2.387 10 10 CECE C[C@]1(c2c(O)c(F)cc3c2OCCCO3)CCCN1 258635970 RGYXEZHVJFEKTB-CQSZACIVSA-N 267.300 2.291 10 10 CECE Cc1cc(N(C)C[C@@H]2[C@@H]3CCOC[C@H]32)ccc1CCN 2150178864 MIFANGUQCUUIOV-GVDBMIGSSA-N 274.408 2.215 10 10 CECE COC(=O)CC[C@H](N)c1c(O)cccc1C(F)(F)F 260430082 ZAGKUSGVVPGDAK-QMMMGPOBSA-N 277.242 2.364 10 10 CECE C[C@H]1N(c2ccc3c(c2)N(C)C(=O)[C@@H]3O)CCC1(C)C 2146666225 IAPRZUYWNGUREO-QMTHXVAHSA-N 274.364 2.321 10 10 CECE CC(=O)C(=O)[C@@H](O)C(c1ccccc1)c1ccccc1 2147018644 AEVRGOPMRRZDFA-KRWDZBQOSA-N 268.312 2.338 10 10 CECE CN[C@@H](CC1CC1)[C@@H](O)c1ccc2c(c1)CCCN2C 2147416992 RDYTTZLNRYOFCD-RDJZCZTQSA-N 274.408 2.491 10 10 CECE C[C@H](CNCc1c(O)cccc1Br)N1CCC1 1997044576 AFWJGHKPVVGULP-SNVBAGLBSA-N 299.212 2.339 10 10 CECE Nc1ccc(N2C(=O)CC3(CC3)C2=O)cc1C(F)(F)F 2151107674 FWIILDNMTGMOPL-UHFFFAOYSA-N 284.237 2.331 10 10 CECE CN(C(=O)C[S@](=O)c1cccs1)c1ccc(N)cc1 40967972 JKNHMIHLLWRBLI-LJQANCHMSA-N 294.401 2.101 10 10 CECE C[S@@](=O)CCCCNCc1c(O)cccc1Cl 2001783688 ISBYHFXKRNQLJB-QGZVFWFLSA-N 275.801 2.294 10 10 CECE CCCC(=O)NCCCN[C@@H]1CCc2cccc(O)c21 2158723090 BNDCMHWBMYFFHT-CYBMUJFWSA-N 276.380 2.276 10 10 CECE NCc1ccc(N(CCn2cccn2)C2CC2)cc1 49313926 GHTTZLHOVVFPSP-UHFFFAOYSA-N 256.353 2.011 10 10 CECE CCCC[C@@H](O)CN(CCCN)c1ccc(OC)cc1 2155589918 CDNMEPJTPRQVAU-OAHLLOKOSA-N 280.412 2.402 10 10 CECE COCCOC[C@@H]1CCCN1c1ccc(CO)c(C)c1 2158952695 QKIGUGRKLZRBKW-INIZCTEOSA-N 279.380 2.119 10 10 CECE CC(=O)C(=O)[C@H](O)c1ccc(SC(F)(F)F)cc1 2030412411 IREZZPLPYSNBNL-SNVBAGLBSA-N 278.251 2.490 10 10 CECE CCN[C@H](c1ccccc1O)C1(O)CC(SC)C1 2031155725 YRTBJXWPFSEFNM-IWXRYERYSA-N 267.394 2.299 10 10 CECE C[C@H]1CCOCCN1[C@H](C)c1c(O)cccc1O 2031608481 UEHFLLDIKWDYSW-WDEREUQCSA-N 251.326 2.270 10 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CECE Nc1ccc(CCNC(=O)[C@@H]2CCC[C@@H]3C[C@H]32)cc1 710615714 QFDPHDYODFBHTC-BPLDGKMQSA-N 258.365 2.364 10 10 CECE CCCN(CC(C)(C)O)c1ccc([C@H](C)N)c(O)c1 690081532 HSEIQCPIPXZXIO-NSHDSACASA-N 266.385 2.399 10 10 CECE CCN1CCc2cc([C@]3(O)CCNC34CCC4)ccc21 2177297832 LQWPRSHHSHIUGT-QGZVFWFLSA-N 272.392 2.173 10 10 CECE CCc1cc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])n(CC)n1 692852040 DIYRMGAPWNYHIN-LLVKDONJSA-N 276.344 2.380 10 10 CECE C[C@H](N[C@H]1CCCC12OCCO2)c1ccc(O)cc1O 715601056 XYFYJBMWVYADLL-HZMBPMFUSA-N 279.336 2.044 10 10 CECE CN1CC[C@H]2CCN(c3cc(Cl)c(CN)cc3F)C[C@@H]21 2177388949 OXKOXGOCBJOWNH-BONVTDFDSA-N 297.805 2.468 10 10 CECE CCCN(c1ccc(N)cc1)S(=O)(=O)C1(C)CC1 696372223 GKBWLFRGTGTBCH-UHFFFAOYSA-N 268.382 2.368 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@H]2CC[C@H]1O2 386839933 UASWRLDCTWQWBV-QLFBSQMISA-N 274.364 2.185 10 10 CECE C[C@H](NCC1=CCN(C)CC1)c1cc(O)ccc1O 392254593 IBNPFVKEASMDBZ-NSHDSACASA-N 262.353 2.010 10 10 CECE OCc1ccc(N2CC[C@H]3OCC[C@@H]3C2)cc1Cl 724692694 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CN(Cc1ccccc1O)c1ccc(F)cc1C(=N)N 2192588749 CCQMEQNDYBQJRH-UHFFFAOYSA-N 273.311 2.452 10 10 CECE Cc1nscc1C(=O)[C@@H](O)c1ccc2c(c1)CCN2C 2192641527 IKIOTPFQESWOKL-AWEZNQCLSA-N 288.372 2.360 10 10 CECE CC(C)c1cc(=N[C@H](C)c2ccccc2O)[nH]c(=N)[nH]1 2192625215 GRJTWGWBAOMCEG-SNVBAGLBSA-N 272.352 2.313 10 10 CECE N[C@@H]1CCc2cc(N3CC(O)(c4cccs4)C3)ccc21 2193362395 HRELJVXWLNBZGS-CQSZACIVSA-N 286.400 2.402 10 10 CECE CCN1CCc2cc([C@]3(O)CN[C@H]3C(C)(C)C)ccc21 2196878673 LTLRKQBKPIMPSX-DOTOQJQBSA-N 274.408 2.275 10 10 CECE CN[C@H]1CCc2cc(N3CCCC[C@H](CO)C3)ccc21 2184729515 KEFIBOKDCIUUOR-GUYCJALGSA-N 274.408 2.492 10 10 CECE O[C@@H]1CCc2cc(N3CCOC[C@@H]3C(F)(F)F)ccc21 2184739298 FBUCKWNRCLTYRJ-CHWSQXEVSA-N 287.281 2.434 10 10 CECE Cc1cnn(C2CN(c3ccc4c(c3)CC[C@H]4N)C2)c1 2184728007 YYJFBWLNQLZZHN-MRXNPFEDSA-N 268.364 2.199 10 10 CECE N[C@@H]1CCc2cc(N3CCOC[C@@H]3C(F)(F)F)ccc21 2184740980 CKQTYYJZSWDPFP-CHWSQXEVSA-N 286.297 2.400 10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2CSCCS2)cc1 2044755482 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Cc1cc([C@H](NN)c2ccc3c(c2)CCN3C)co1 2106862099 PZXWRRASYQJKCC-OAHLLOKOSA-N 257.337 2.133 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)C2CC(F)(F)C2)cc1 2106851777 XVTGGUKCMFHNJU-STQMWFEESA-N 270.323 2.159 10 10 CECE CCN(CC)c1ccc([C@@](C)(O)CNC2CC2)cc1 2106832526 AWLDILDHRPLBMV-INIZCTEOSA-N 262.397 2.492 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@]1(O)C[C@@H]2C[C@@H]2C1 2106850562 JYRLFXNCCMYIGL-XRGAULLZSA-N 260.381 2.174 10 10 CECE CCSC[C@H](N)[C@@H](O)c1ccc2c(c1)CCCN2C 2106823176 MUPDZBCTMAOFKK-ZFWWWQNUSA-N 280.437 2.183 10 10 CECE O=C(O)C12CCC(CC1)N2Cc1cc(F)ccc1O 2087285165 SWPWDEHOJZJFLI-UHFFFAOYSA-N 265.284 2.113 10 10 CECE c1cc2c(cc1N1CCNCCC13CC3)CCCO2 2107501946 CBCPQCVRTCTNST-UHFFFAOYSA-N 258.365 2.344 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1c(C)n[nH]c1C 2107787333 KUIWFZCABMDKGJ-OAHLLOKOSA-N 258.369 2.401 10 10 CECE Oc1cccc(CN[C@H]2CCOC23CCCC3)c1O 2088220405 CZMJAHKZRMOWIJ-ZDUSSCGKSA-N 263.337 2.289 10 10 CECE CC[C@H](CS(C)(=O)=O)N[C@H](C)c1ccc(C)cc1O 2090094962 QQQSRWDRXXCKTE-VXGBXAGGSA-N 285.409 2.174 10 10 CECE NN[C@@H](Cc1ccc(F)cc1F)c1ccccc1O 2090036368 BQUPPYYXBIPFAC-ZDUSSCGKSA-N 264.275 2.418 10 10 CECE CN1CCc2cc([C@@H](O)C(=O)c3ccsn3)ccc21 2090968185 KMMNXKOHZWYTGX-CYBMUJFWSA-N 274.345 2.052 10 10 CECE C[C@](O)(c1ccccc1F)[C@@H](N)c1ccccc1O 2091865302 YTKSWPCNCJFHSX-GJZGRUSLSA-N 261.296 2.439 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](C)[C@H](O)C[C@H]2C)cc1O 2093108063 KFHWVUSNPRUPRS-BBGACYKPSA-N 265.353 2.041 10 10 CECE Cc1cnc([C@H](O)c2ccc3c(c2)CCCN3C)[nH]1 2093522675 ICBVFKPLPAMLDR-CQSZACIVSA-N 257.337 2.182 10 10 CECE Cc1cc(N2CC[C@@H]([C@@H]3CCOC3)C2)ccc1CO 2096732096 LMEWKDREZUIZPW-UKRRQHHQSA-N 261.365 2.350 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H]3CC[C@@]3(CN)C2)c1O 2201354580 DEIOQNUMFBWFHH-XHDPSFHLSA-N 296.798 2.225 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@@]12CC2(F)F 2115291604 JZEZKEVJORXEPZ-WCQYABFASA-N 266.291 2.273 10 10 CECE COc1cc(N(C)C[C@H]2CCO[C@H](C)C2)ccc1CO 2204553679 LWPLUJPAKLBUOT-OLZOCXBDSA-N 279.380 2.439 10 10 CECE Cc1ccc(CN(C)[C@H]2CCCC(=O)N(C)C2)c(O)c1 2204655283 HWLNEJKFSWOQAH-AWEZNQCLSA-N 276.380 2.143 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@]1(F)C[C@H]1C 2206337441 KVAHIQRZCUDOCX-UEKVPHQBSA-N 279.359 2.276 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@H]2C2CC2)c(F)c1 2219608501 IWVRAXHCTXVODY-ZIAGYGMSSA-N 251.301 2.184 10 10 CECE CNCc1ccc(OC)c(COCC2(F)CC2)c1 2219946842 QKCPEVUMRYGFRS-UHFFFAOYSA-N 253.317 2.433 10 10 CECE CCn1cc(NCc2ccc(O)c(O)c2O)c(Cl)n1 2230789880 AJZIHOQEHJPOKE-UHFFFAOYSA-N 283.715 2.285 10 10 CECE CN[C@@H](C)c1ccc(N(C)CC2CN(C)C2)c(C)c1 2232022634 OTVGHBZPEAMJLJ-ZDUSSCGKSA-N 261.413 2.273 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@H]2C[C@H]1CN(C)C2 2232098645 QCGXQMYXHLIMFR-IPYPFGDCSA-N 260.381 2.189 10 10 CECE C[C@H](C(=O)O)[C@H](C)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2234173426 XVYNFABHVYOGEW-DCAQKATOSA-N 282.344 2.282 10 10 CECE O[C@H]1C[C@H]2CC[C@@H]([C@H]1F)N2c1ccc2c(c1)CCCO2 2235042886 PVPZSTZLBIAYCX-ORIJERBGSA-N 277.339 2.452 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CCCCC[C@H]1C(=O)O 2225791105 AVULCOCBIZAACF-NXEZZACHSA-N 268.317 2.036 10 10 CECE CC12CC(C(=O)N[C@H]3CCC[C@H]3N=[N+]=[N-])(CCO1)C2 2225795721 PWAQLZWSMAACQU-YSARLGLZSA-N 264.329 2.293 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1cc(O)cc(O)c1 2225801270 UMUPUDJOFOMVAP-WDEREUQCSA-N 262.269 2.059 10 10 CECE COc1ccc(N(C)CCOC(F)F)c(C[C@@H](C)N)c1 2235976617 HXQCOIDJBFZDTE-SNVBAGLBSA-N 288.338 2.260 10 10 CECE COc1ccc(N2C[C@@H]3CSC[C@@]3(C)C2)c(CCN)c1 2235975846 YUGQAXCGSLGWFC-CZUORRHYSA-N 292.448 2.386 10 10 CECE C[C@@H]1CC[C@@H]1CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 2236130455 CYZBWLXUPWWZFE-UEKVPHQBSA-N 274.364 2.179 10 10 CECE COc1cc(N(C)C[C@]23COC[C@H](C2)C3)ccc1CO 2236366762 SXXSLEDJDPOMQW-DRQUAOQDSA-N 277.364 2.050 10 10 CECE CCNCc1ccc(OCc2nc(C)n(C)n2)c(C)c1 2236497290 UTGPUIUEAUTKNH-UHFFFAOYSA-N 274.368 2.120 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@H](CO)C2)c(OC)c1 2226810869 WHZJPJMVSUZKLT-NEPJUHHUSA-N 265.353 2.159 10 10 CECE CC[C@H](CN(C)c1ccc(OC)cc1CCN)OC 2227683100 LBNNVZJQCDDGLV-CYBMUJFWSA-N 266.385 2.058 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H]3[C@H]3C[C@H]32)c(CCN)c1 2227688453 QPGHSWXGAUCGCA-YYWXWVFPSA-N 258.365 2.041 10 10 CECE CN1CCc2cc(CNC[C@H](F)[C@H]3CCOC3)ccc21 2238312970 XLEIWQGMEYKZGB-GJZGRUSLSA-N 278.371 2.143 10 10 CECE CN(C)c1ccc(OCc2ccnc(CN)c2)cc1 2229380946 IVVQIAXVKSRWPB-UHFFFAOYSA-N 257.337 2.185 10 10 CECE CCn1cnc(S(=O)(=O)Nc2c(C)cc(O)cc2C)c1 2239740855 HJIFJLCLLKXBNW-UHFFFAOYSA-N 295.364 2.026 10 10 CECE Nc1ccc(OCC(=O)OC[C@H]2C[C@H]3C[C@@H]2C3)cc1 2229882660 VSTDDYPULIKSFV-GRYCIOLGSA-N 261.321 2.237 10 10 CECE CC[C@@H](C)NCc1ccc(N(C)CCC(N)=O)cc1C 2240063717 MCABGISMVZZLRO-CYBMUJFWSA-N 277.412 2.195 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC([S@](C)=O)C2)c(C)c1 2240077428 XGRZJCXGCNGWNG-XCLFUZPHSA-N 294.464 2.450 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)CCCC(=O)N(C)C 2240741875 VJRCNAMQDRFBTG-CYBMUJFWSA-N 277.412 2.319 10 10 CECE CO[C@@]1(CN(C)c2ccc([C@@H](C)O)cc2C)CCOC1 2240832352 BNSVONQXPGTTDN-CZUORRHYSA-N 279.380 2.290 10 10 CECE COC[C@]1(C)[C@H]2C[C@H]2CN1c1ccc(OC)cc1C=O 2284719140 GFTHQSBYDLVQOM-HZUKXOBISA-N 275.348 2.369 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@@H](COC)OC)cc1C 2285141289 TXYXLQOSMBYBLA-ZFWWWQNUSA-N 280.412 2.373 10 10 CECE CCCN(c1ccc([C@H](C)O)c(C)c1)[C@@H]1CCNC1=O 2285177026 YFLBJYGYDCVQQF-SWLSCSKDSA-N 276.380 2.153 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@@H](CO)[C@@H]3C2)cc1Cl 2285872081 KJTRUIGQHXRRKM-GARJFASQSA-N 297.782 2.422 10 10 CECE CSc1ncc(CN[C@@H]2CC[C@@H]3CNC[C@H]3C2)s1 2257099200 ZQESJGDQOIXHLG-GMTAPVOTSA-N 283.466 2.343 10 10 CECE CSc1ncc(CNc2cc(NN)ncc2C)s1 2257134645 KTSOIYHWJCEZPJ-UHFFFAOYSA-N 281.410 2.466 10 10 CECE CSc1ncc(CNC[C@]2(N)CC[C@H]3C[C@H]32)s1 2248746381 SUOHYDYBBZNNAD-MKPLZMMCSA-N 269.439 2.082 10 10 CECE CSc1ncc(CNCC2CC(C3CNC3)C2)s1 2259636321 PAYZXEIPZNLWDQ-UHFFFAOYSA-N 283.466 2.200 10 10 CECE O=C(O)[C@@H]1C[C@H]2[C@@H]1CCN2Cc1ccc(Cl)cc1O 2270845753 YUWBZNPXCYHCEO-UTUOFQBUSA-N 281.739 2.341 10 10 CECE CCOC(=O)C1(N)CC(C)(CSc2nccs2)C1 2261069828 PCLOOJPZMGNYQM-UHFFFAOYSA-N 286.422 2.296 10 10 CECE OCc1ccc(N2CCC3(CC[C@@H](O)C3)CC2)cc1 2272383252 DFEWRGAWTWNMMP-OAHLLOKOSA-N 261.365 2.310 10 10 CECE [N-]=[N+]=NCC1CCN(CCCCCC(N)=O)CC1 2263823615 MFEXJURGCNJQRC-UHFFFAOYSA-N 253.350 2.054 10 10 CECE OC[C@@]12CC[C@@H](CN1c1ccc(OCF)cc1)C2 2263935787 RKKMPAKYLORDRS-RISCZKNCSA-N 251.301 2.344 10 10 CECE O=C(O)COc1ccc(N2CC3(CC(F)C3)C2)cc1 2265644125 YQZVUIIPOZBCLM-UHFFFAOYSA-N 265.284 2.088 10 10 CECE COc1ccc(N(C)C2(CCO)CC2)c(OC)c1C 2278064749 OASJEGHXILCJNK-UHFFFAOYSA-N 265.353 2.363 10 10 CECE C[C@@H](NC(=O)c1ccc(O)c(O)c1)[C@H]1CC12CCC2 2268384464 CXQPFCOIQRHZND-MWLCHTKSSA-N 261.321 2.406 10 10 CECE CN(C)c1ccc2c(c1)OCCN2CC[C@H]1CCO1 2278549775 KPJMEIHRLRHGGT-ZDUSSCGKSA-N 262.353 2.130 10 10 CECE C[C@@H](N)c1ccc(N2CC(C)(C)OC[C@H]2C)cc1O 2268774138 DJPBMWDLOQZNFH-GHMZBOCLSA-N 264.369 2.416 10 10 CECE CSc1ncc(CNC(=O)C[C@@H]2C[C@@H](N)C2(C)C)s1 2269096195 RCGONJBAKJVDEU-WCBMZHEXSA-N 299.465 2.245 10 10 CECE CSc1ncc(CNC(=O)[C@@H]2CN[C@@H](C)C[C@@H]2C)s1 2269092991 ALOCCLLDKBYKCD-ATZCPNFKSA-N 299.465 2.115 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]3CNC(=O)[C@H]32)cc1Cl 2279271069 MYZWJBCVHQCXLD-RBZYPMLTSA-N 294.782 2.108 10 10 CECE Cc1cc(N2C[C@H]3C[C@H](O)C[C@H]3C2)ccc1[C@H](C)N 2269665100 DYJDLFLEWQPRTF-RMRHIDDWSA-N 260.381 2.222 10 10 CECE Cc1cc(N(C)C[C@H]2CCN(C)C2)ccc1[C@@H](C)N 2269657986 CTNKXWWGMOVAEU-KGLIPLIRSA-N 261.413 2.403 10 10 CECE Cc1cccc(CN=c2ccc3c([nH]2)CCOC3)c1O 2294921189 SGQRTDYXEVCIQS-UHFFFAOYSA-N 270.332 2.202 10 10 CECE Cc1cc(N2[C@H]3CC[C@H]2[C@H](F)[C@H](O)C3)ccc1[C@@H](C)N 2285124759 SOKBWRLKKYSBSZ-CEVLKMKRSA-N 278.371 2.455 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2CC[C@@H](C(=O)O)S2)CC1 2286180830 PJWDYEDIABJEHS-BBBLOLIVSA-N 298.368 2.027 10 10 CECE CC1(O)[C@H]2C[C@H]1CN(c1ccc3c(c1)OC(F)(F)O3)C2 2286203684 NYLHYSWRMRDORN-IUCAKERBSA-N 283.274 2.215 10 10 CECE NC(=O)[C@H]1CC[C@@H](N[C@H]2CCc3cccc(O)c32)CC1 2287906556 LINAODUNXCGSOV-XQQFMLRXSA-N 274.364 2.013 10 10 CECE CCOc1cccc(CN2CC[C@@H]3CCO[C@H]3C2)c1O 1203604019 YYNKKVBLRXGYTP-DOMZBBRYSA-N 277.364 2.402 10 10 CECE CC=CC(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 2320478984 NJKCAHTUEASBEN-INIZCTEOSA-N 298.390 2.268 10 10 CECE Cc1ccc(CN[C@@H]2CC[C@@H]2CN)c(O)c1Br 2307479493 IVHOKXQRFKYHPS-MWLCHTKSSA-N 299.212 2.290 10 10 CECE CCN(CCN=[N+]=[N-])CCOC[C@@H]1CCCCO1 2315991868 DNSFITGBIMZZBT-LBPRGKRZSA-N 256.350 2.204 10 10 CECE CCO[C@@H]1CCN(c2ccc(CN)c(SC)c2)C1 2328544374 FXEKNQKWDKUKBE-CYBMUJFWSA-N 266.410 2.482 10 10 CECE CCN(C(=O)[C@H]1C[C@@H]2C[C@@H]2CO1)c1ccc(N)cc1 2331058740 SUADQVLBFNEICQ-MISXGVKJSA-N 260.337 2.047 10 10 CECE CS[C@H]1C[C@@H]([C@@H](NN)c2ccc3c(c2)CCN3C)C1 2335881504 KQTHXIAHRZVRLA-GUTXKFCHSA-N 277.437 2.325 10 10 CECE CCN(C[C@H](C)O)c1ccc(CNC)c(C2CC2)c1 2339142976 FNPNZUBOOZHXOU-LBPRGKRZSA-N 262.397 2.491 10 10 CECE CC(C)[C@H](O)C(C)(C)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2340242015 KISNFSKJZILHIG-VWYCJHECSA-N 268.361 2.377 10 10 CECE C[C@H]1Cc2cc(N3CC[C@H]4C[C@]3(CN)C4)ccc2O1 2340784343 IXWITDPPAGJNSZ-MQIPJXDCSA-N 258.365 2.328 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCCN(C)CC2)c1C 2341068791 DJMFGDTXUBKOKM-CQSZACIVSA-N 262.397 2.499 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@]12C[C@H]1CCCN2 2353889503 ZPTCMSLKDOQQMG-OZVIIMIRSA-N 274.364 2.054 10 10 CECE CC(C)Cn1ccnc(N(C)Cc2ccc(N)cc2)c1=O 61768681 HSWUHKFFRJKPGI-UHFFFAOYSA-N 286.379 2.118 10 10 CECE C[C@H](c1cc(O)ccc1O)N(C)C1C[C@@H]2CC[C@@H](C1)N2 103984642 DDFKADHHLCVWHI-WOPDTQHZSA-N 276.380 2.374 10 10 CECE C[C@@H](N)c1ccc(N(C)CCCO)cc1Br 300813219 LKXRTEQFGDQFAE-SECBINFHSA-N 287.201 2.287 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)C(=O)Nc1nccs1 170018361 MTPJQYSIWDZSBS-QMMMGPOBSA-N 278.333 2.372 10 10 CECE CCN(CC(=O)NC)c1ccc(CNC(C)(C)C)cc1F 62737294 BXSGFMABCVWGDR-UHFFFAOYSA-N 295.402 2.286 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H](O)[C@@H]3C[C@H]3C3CC3)ccc21 2357646326 JOHJEECDGYFMPB-ABFRBSLYSA-N 272.392 2.086 10 10 CECE COc1ccc(CNCCN2CCCCCC2=O)cc1C 66878628 HPPQYBXFHLWYLM-UHFFFAOYSA-N 290.407 2.496 10 10 CECE COc1cc(C2(N)CC2)c(O)cc1Br 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10 10 CECE CN1[C@H]2CCC[C@H]1CN(Cc1c(O)cccc1F)C2 2131087553 USVBFFNVUAYEKV-RYUDHWBXSA-N 264.344 2.200 10 10 CECE CN1CCCc2cc([C@]3(N)CCN4CCC[C@@H]43)ccc21 2163099324 HRURMMUGDGGLFA-IAGOWNOFSA-N 271.408 2.091 10 10 CECE CCc1cccc(CN2C[C@H]3C[C@H]2CN3CC)c1O 2131025847 PHNIOIKSYCMDHS-CABCVRRESA-N 260.381 2.233 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@]1(O)CCC1(C)C 2163141052 QDLCARBDNMXRQN-WBVHZDCISA-N 274.408 2.491 10 10 CECE CC[C@@H](C)[C@@H](c1ccc(OC)cc1O)N1CCNCC1 575290195 XATOIFGIWFEFRU-WBMJQRKESA-N 278.396 2.393 10 10 CECE CC1(C)CNCCCN1Cc1cc(F)cc(F)c1O 1879317415 FDAJWCDDIICEEP-UHFFFAOYSA-N 270.323 2.244 10 10 CECE CNCc1cc(F)c(N2CC=C(COC)CC2)c(F)c1 723149271 PIUPPMIMWOXXDD-UHFFFAOYSA-N 282.334 2.467 10 10 CECE CSC[C@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)O 904041582 TWMMTXMHFNCJOF-WSNITJDQSA-N 294.420 2.172 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]([C@@H](O)C(F)(F)F)C2)c1 825124825 ZCNKOGIDLOYJRL-GXFFZTMASA-N 289.297 2.446 10 10 CECE CC(C)CN(C/C=C\c1ccc(N(C)C)cc1)CC(N)=O 835025443 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COc1ccc(N2C[C@H](C)[C@@H](N)[C@H](C)C2)cc1OC 2106358642 UPLKUIYUNJGOFZ-HBYGRHMLSA-N 264.369 2.123 10 10 CECE CN[C@@H]1CCC[C@@](O)(c2ccc(N(C)C)cc2)CC1 2106789861 CCSVFYTYQHXTKA-ZBFHGGJFSA-N 262.397 2.492 10 10 CECE CN(C)c1ccc([C@@](C)(O)C[C@@H]2CCCCN2)cc1 2106791153 PJUGIYCLOUAAOG-HOCLYGCPSA-N 262.397 2.492 10 10 CECE CCN1CCc2cc([C@]3(O)CCCN[C@@H]3C)ccc21 2106795149 DLDUJHKHSPVKFI-WBMJQRKESA-N 260.381 2.029 10 10 CECE CN1CCCc2cc([C@@](C)(N)[C@@H]3CCOC3)ccc21 2106820077 GTOCVVVJHGTULS-GDBMZVCRSA-N 260.381 2.279 10 10 CECE N[C@@H]1CC=C([C@@H](O)c2ccc(N3CCCC3)cc2)C1 2106822834 JFLRMIZAPJNWHG-ZBFHGGJFSA-N 258.365 2.368 10 10 CECE C[C@H](CN)[C@@H](F)[C@H](O)c1ccc(N2CCCC2)cc1 2106827241 AWPHTXZGZXPABX-KCPJHIHWSA-N 266.360 2.253 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@@H]2NCC[C@@H]21 2087390256 RZJIFKTZPUQSGS-SWHYSGLUSA-N 264.344 2.419 10 10 CECE C[C@@H](N)c1ccc(N2[C@H](CO)C[C@H]3CCC[C@H]32)cc1 2108591790 ODBZYDCBDGTZNL-XABYNWHXSA-N 260.381 2.446 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3C[C@H]2CC[C@@H]3O)c(F)c1 2088643347 GPNXEISJJSAHJV-NFOTXUCKSA-N 264.344 2.195 10 10 CECE NCc1ccc(N2CC[C@H]3COCC[C@@H]32)c(F)c1F 2088747820 PIIWSNZXQSHWJS-QWRGUYRKSA-N 268.307 2.039 10 10 CECE COc1ccc(CN[C@@H]2CCOCC[C@H]2C)c(O)c1 2109095113 KYENMMNQHWAHST-BXUZGUMPSA-N 265.353 2.306 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](CO)C(F)(F)C2)cc1 2090187276 DZGHTQJFXOWWHD-PWSUYJOCSA-N 271.307 2.194 10 10 CECE C[C@@](O)(c1cccc(F)c1)[C@H](N)c1ccccc1O 2091856837 YFTUZNMYWIIRGS-HUUCEWRRSA-N 261.296 2.439 10 10 CECE C[C@H]1COCC[C@H]1N(C)c1ccc(CN)c(F)c1F 2092815738 DAVPESRBGKDQOK-GXSJLCMTSA-N 270.323 2.285 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)cc1 2093156740 WDBBQWLXWZGFHM-YHUYYLMFSA-N 261.365 2.195 10 10 CECE COC[C@H]1[C@H]2CN(c3ccc(CN)c(C)c3)CC[C@H]21 2093139485 DKMXKKBEOUCERR-OWCLPIDISA-N 260.381 2.172 10 10 CECE CO[C@H]1CN(CCCc2ccc(N)cc2)CC12CC2 2093325127 UDLPWHGZLSXYCS-HNNXBMFYSA-N 260.381 2.312 10 10 CECE COCC[C@H]1CCCN(Cc2cc(N)ccc2O)C1 2094399849 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COc1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)c(F)c1 2219620558 WTLHWHUIVDJVGY-ISTVAULSSA-N 251.301 2.041 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@H]2C[C@]2(F)C1 2230334962 OUSWSGONCKIGJE-DOMZBBRYSA-N 264.344 2.353 10 10 CECE COc1ccc(N2CCS[C@@H](C)CC2)c(CN)c1 2220415323 SBZOIWBDJWZZFB-NSHDSACASA-N 266.410 2.486 10 10 CECE CN(Cc1cc(N)ccc1O)[C@@H]1CC[C@@H]2[C@@H]1C2(F)F 2230450878 UJISKNMRMWETCL-WZRBSPASSA-N 268.307 2.450 10 10 CECE CO[C@@]12CC[C@H]1CN(c1ccc([C@H](C)N)cc1F)C2 2230504318 LZSWRYFLDZZFBK-ITDIGPHOSA-N 264.344 2.461 10 10 CECE CN[C@H](C)c1ccc(N2CCN3CC[C@H]2C3)c(C)c1 2232036622 YINJZFUZZPHZNT-HIFRSBDPSA-N 259.397 2.170 10 10 CECE NCc1ccc(N2C[C@H](O)CC23CCCCC3)cc1 2232323169 LAMIGXHBFMYFQS-OAHLLOKOSA-N 260.381 2.419 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2OC[C@@H]3CCC[C@H]32)c1O 2233163433 ALPFVSQDTHILOX-GZBFAFLISA-N 275.348 2.132 10 10 CECE COc1ccc(N2CCO[C@@H]([C@@H](C)N)C2)cc1C(C)C 2233169286 MMHHELHFXHZYSX-MLGOLLRUSA-N 278.396 2.371 10 10 CECE CC[C@@H](C)NCc1ccc(N(CC)CCO)cc1 2223528773 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263.337 2.053 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(S(=O)(=O)c2c(F)cccc2F)C1 2227582272 VPJXWFKSZYXKPY-SSDOTTSWSA-N 288.279 2.038 10 10 CECE COc1ccc(N2CC[C@@H]3[C@@H](C2)C3(F)F)c(CO)c1 2227711087 LWBHIVQUVMGVHZ-VXGBXAGGSA-N 269.291 2.279 10 10 CECE CCCN(C(=O)[C@@H]1CC[C@H]1OC)c1ccc(N)cc1 2227822680 XPWAWNNPXNGJKU-ZIAGYGMSSA-N 262.353 2.437 10 10 CECE CN(C[C@H](F)[C@H]1CCOC1)c1ccc2c(c1)CC[C@H]2O 2238350228 PRQDKIGHYPDCPO-VBNZEHGJSA-N 279.355 2.477 10 10 CECE Nc1ccc(O)c(CN2CCC[C@H](OC(F)(F)F)C2)c1 2239158496 SHIUHJMGIWZWOJ-NSHDSACASA-N 290.285 2.475 10 10 CECE CO[C@@H]1CC[C@H]1C[S@](=O)CCCOc1ccc(N)cc1 2239131282 RYPOJTRKIPTUAW-PGICJIBASA-N 297.420 2.211 10 10 CECE COc1ccc([C@H](C)NCc2ncccc2O)c(O)c1 2239402242 VWSGDVOTHRZDMI-JTQLQIEISA-N 274.320 2.352 10 10 CECE CN(CCC(N)=O)c1ccc(CNC2CCC2)cc1Cl 2239999444 LLVLXOYWTKBIOM-UHFFFAOYSA-N 295.814 2.294 10 10 CECE CC(C)[C@H]1COCCN1C(=O)CCc1ccc(N)cc1 2240324440 AHDUQQPMMJKEDH-OAHLLOKOSA-N 276.380 2.085 10 10 CECE COCC(COC)CN(C)c1ccc([C@@H](C)N)cc1C 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[N-]=[N+]=N[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)F)C1 1912150485 UJEKTJXJBHOWPB-SCSAIBSYSA-N 258.150 2.095 10 10 CECE [N-]=[N+]=N[C@H]1CCN(Cc2nc(-c3ccccn3)no2)C1 1912168634 FLWVKWKSOPMEHC-VIFPVBQESA-N 271.284 2.016 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(CC(=O)NCCC2=CCCCC2)C1 1912156692 UTWKCROELPWUFR-CYBMUJFWSA-N 277.372 2.378 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(Cc2nccn2C(F)F)C1 1912210249 HCDWHIKODMPJHW-MRVPVSSYSA-N 256.260 2.410 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912207973 NVGJNBUNCZXOFM-USZNOCQGSA-N 265.361 2.159 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1S(=O)(=O)C[C@@H]1CC[C@@H](F)C1 1912204527 KFDLDHBGKIRWRU-MXWKQRLJSA-N 290.364 2.229 10 10 CECE Nc1ccc(CS(=O)(=O)N2CCCCC23CC3)cc1 1915565082 PUCUQQLGFAYYHV-UHFFFAOYSA-N 280.393 2.117 10 10 CECE C[C@H](CCO)N(C)c1ccc(CN)c(C(F)(F)F)c1 1917033410 SLPVGHORPAMVTR-SECBINFHSA-N 276.302 2.371 10 10 CECE CCOC(=O)CCC[C@H](N)c1c(O)cccc1F 1951602415 PIODSRZAKTUGHD-JTQLQIEISA-N 255.289 2.265 10 10 CECE C[C@@H](CC1CC1)OC[C@@H](O)COc1ccc(N)cc1 1917475233 JBYAAQBFKJWMMU-SMDDNHRTSA-N 265.353 2.214 10 10 CECE COc1cccc(N(C)C(=O)c2cc(O)c(O)c(O)c2)c1 1866303170 PDUKYYVTCOKOOO-UHFFFAOYSA-N 289.287 2.089 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)OCCCO3)[C@@H](C)CN1 225575292 BQZQVVHBCSZPGO-STQMWFEESA-N 276.380 2.425 10 10 CECE CNc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)nc1 1628859619 DAWMNSBZPTUFJF-UHFFFAOYSA-N 298.390 2.428 10 10 CECE O=C(NCc1ccccc1O)N[C@@H]1COCc2ccccc21 1636287605 HYZIUFSGHJDGDY-OAHLLOKOSA-N 298.342 2.463 10 10 CECE COCC(C)(C)CNC(=O)c1ccc(N=NC(N)=O)cc1 1569976902 WOFGXAKDSXISFF-UHFFFAOYSA-N 292.339 2.251 10 10 CECE O=C(Cc1cccnc1Cl)NCc1cc(O)ccc1O 1651225571 PGIJSGBFWPVRER-UHFFFAOYSA-N 292.722 2.005 10 10 CECE NN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S 16905002 JIELSOYMYOVYAH-YHYXMXQVSA-N 275.358 2.243 10 10 CECE O=C(C1CCC1)N1CCc2cc(N3CCOCC3)ccc21 1857968874 ARIRCFPESFBEFR-UHFFFAOYSA-N 286.375 2.212 10 10 CECE COCCCN=NNc1ccc(OC)c([N+](=O)[O-])c1 1860491462 QGSBYYQVJVLMBW-UHFFFAOYSA-N 268.273 2.419 10 10 CECE COc1ccc(N(C)CC[C@@H](C)CN)c(OC)c1C 258956386 RYIUDEJTABSBPJ-LLVKDONJSA-N 266.385 2.433 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2CC[C@H]3C[C@H]2CO3)cc1 904499664 HGWGOAWPIKNSEF-MJVIPROJSA-N 275.352 2.205 10 10 CECE C[C@H](NCc1ccc(O)c(O)c1)[C@@H]1CCSC1 1942252986 CYLMYVPPAMFTMX-GXSJLCMTSA-N 253.367 2.329 10 10 CECE Cc1noc(CNCc2ccc(Cl)cc2O)n1 1942492287 WYWVYFUJQHVSGF-UHFFFAOYSA-N 253.689 2.027 10 10 CECE CCC(C)(C)NC(=O)CN(C)c1ccc(OC)cc1 844353070 FRUDKUILWKREOO-UHFFFAOYSA-N 264.369 2.436 10 10 CECE CC[C@@H](C)OC(=O)CNCc1cc(C)ccc1O 1857872906 HKMSXRPOVOFTTD-LLVKDONJSA-N 251.326 2.132 10 10 CECE COC[C@](C)(CN(C)Cc1cc(C)ccc1O)OC 1894310017 ZVMMONBLRCTCLH-HNNXBMFYSA-N 267.369 2.184 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@H](O)C2(C)C)c(O)c1 128140692 HHWOTSZTYLWVEY-HERUPUMHSA-N 265.353 2.211 10 10 CECE CN(C)c1ccc([C@H](O)[C@H](N)C[C@@H]2C[C@H]2CF)cc1 1875900466 ASVWGXVHFKSLNE-VIRABCJISA-N 266.360 2.109 10 10 CECE COc1ccc(N2CCC[C@@H](C)[C@@H]2CCN)c(N)c1 1876396154 CBOBBQWARLGMPW-RISCZKNCSA-N 263.385 2.231 10 10 CECE C[C@H](N)c1cc(N(C)Cc2ccccc2O)ccn1 1877528689 IJQXFSVHCGSNNB-NSHDSACASA-N 257.337 2.443 10 10 CECE COc1cc2c(cc1OC)N(CCN1CCCC1)CC2 2143417104 BMBVGBXIPLITTP-UHFFFAOYSA-N 276.380 2.162 10 10 CECE COC[C@@H](C)N(Cc1ccccc1O)C[C@H]1CCCO1 2143424779 ALWCFJRKHYUJMQ-UKRRQHHQSA-N 279.380 2.408 10 10 CECE Cc1ccc(CN2CC[C@H](C(=O)O)C(F)(F)C2)c(O)c1 1964732086 GTJWNQMYCSQJSR-LLVKDONJSA-N 285.290 2.242 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@H](C)[C@@H](O)C2)c(F)c1 1880932400 UFTAQDJUFYAMOT-RWEMILLDSA-N 270.323 2.062 10 10 CECE Nc1ccc(CS(=O)(=O)Nc2ccc(F)cc2F)cc1 20005586 LDBSKQYYGIFXIC-UHFFFAOYSA-N 298.314 2.489 10 10 CECE Oc1cc(F)ccc1CNC[C@@H](O)c1ccsc1 1964567825 CDASFXXYLGAGDH-CYBMUJFWSA-N 267.325 2.416 10 10 CECE CC[C@@H](O)c1ccc(N2CCO[C@@H]3COCC[C@@H]32)cc1 2143789527 JCRHMIVEMLRXMW-ARFHVFGLSA-N 277.364 2.124 10 10 CECE CO[C@@H]1CC[C@@H]2CN(c3ccc([C@H](C)O)c(O)c3)C[C@@H]21 2144204431 HBUQJKVSWUKRSQ-FJXFWJLJSA-N 277.364 2.307 10 10 CECE C[C@@H]1C[C@@H](C(=O)NCCc2ccc(O)c(O)c2)CCS1 1964864954 YJLXOYVDSQBVTD-PWSUYJOCSA-N 295.404 2.288 10 10 CECE CC(C)CCC(=O)NCCOc1ccc(N)cc1 38079578 BSZYNEHUCDQNOW-UHFFFAOYSA-N 250.342 2.200 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@]1(C)CCN1C(=O)OC(C)(C)C 1885563264 RQSYBGGAGSRKMT-ZDUSSCGKSA-N 297.359 2.155 10 10 CECE CCNCc1ccc(N(C)[C@H]2COCC2(F)F)cc1 1888256151 FONKGDDPCBPLIE-ZDUSSCGKSA-N 270.323 2.266 10 10 CECE C[C@@H](N1CCOc2cc(N(C)C)ccc21)C(C)(C)O 1888969399 TWQJPLFFMCATPY-LLVKDONJSA-N 264.369 2.111 10 10 CECE COc1ccc(CNCC2(n3cccn3)CC2)cc1C 2144651890 UBOZZVSVKWFSCE-UHFFFAOYSA-N 271.364 2.479 10 10 CECE CN(C(=O)[C@H]1C(F)(F)C12CC2)c1ccc(N)cc1 1967071132 BPCBCLBIJFGRMY-SNVBAGLBSA-N 252.264 2.277 10 10 CECE C[C@]1(C(=O)O)CCCN(Cc2ccc(F)cc2O)C1 1968128243 JGLCJZPGJRWRBY-AWEZNQCLSA-N 267.300 2.218 10 10 CECE O=C(O)[C@@H]1C=CCN(Cc2c(O)cccc2Cl)C1 1968223881 PKMRFYQWTNDJLD-SECBINFHSA-N 267.712 2.118 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC[C@@H]1C1CCC1 2144899697 VMLFLABEKWENAU-XHDPSFHLSA-N 273.380 2.470 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]3C3CCC3)ccc21 2144900689 FTUPBMQMEREPGX-GJZGRUSLSA-N 271.364 2.278 10 10 CECE Cc1nc(CCNCc2c(O)cccc2F)co1 1970390961 CDYGCHZJIZNTBN-UHFFFAOYSA-N 250.273 2.160 10 10 CECE Nc1ccc(CC(=O)N2CCC(OC(F)F)CC2)cc1 1970756519 TUPBHWMBNSRSHH-UHFFFAOYSA-N 284.306 2.042 10 10 CECE CN(C)c1ccc(CNCC2CC3(CC(O)C3)C2)cc1 1972733056 FAQJHYQREDSMFW-UHFFFAOYSA-N 274.408 2.393 10 10 CECE O=C(NCC[C@@H]1CCCOCC1)c1cccc(O)c1O 2145472213 LMLZOWUAKJHBIM-NSHDSACASA-N 279.336 2.034 10 10 CECE CO[C@H]1C[C@@H](CCNCc2cccc(F)c2O)C1 1974339542 XKGSFJHXNYONHS-KLPPZKSPSA-N 253.317 2.436 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)C[C@@H]2CCS(=O)(=O)C2)c1 2148787338 MSZYLPYJGPVGON-OLZOCXBDSA-N 297.420 2.128 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)C1(Br)CC1 1980148550 WNVSRYZLRZFUPN-UHFFFAOYSA-N 283.169 2.155 10 10 CECE CCN(C[C@@H]1C[C@H]2COCC[C@H]2O1)c1ccc(N)cc1 2148975156 YQCQDIXEJQSEBC-VBNZEHGJSA-N 276.380 2.289 10 10 CECE C[C@H](O)c1ccc(N2CCC23COC3)cc1Br 2004449767 XVMHDLFQNUIDSV-VIFPVBQESA-N 298.180 2.482 10 10 CECE CN(C)C1(CNC(=O)Nc2ccc(N)cc2)CCCC1 160935810 IBXMQTPCPAGNAH-UHFFFAOYSA-N 276.384 2.265 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)CC3(CCC3)C2)cc1O 2151343871 BJCUHQYKDJQPOA-DGCLKSJQSA-N 277.364 2.187 10 10 CECE CN1CCC[C@H](CCOC(=O)Cc2ccc(N)cc2)C1 2151365787 AFIMOWTWKCJECG-CQSZACIVSA-N 276.380 2.086 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](CO)C2(C)C)cc1O 2151538301 ZMSBHFURFDOEPA-RYUDHWBXSA-N 278.396 2.270 10 10 CECE Cc1cccc(CN=c2[nH]ccnc2Br)c1O 2008706393 CNHXPMVRXIFGRY-UHFFFAOYSA-N 294.152 2.287 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1cnc(Cl)cn1 2009443224 OOFMFPGNKOPKTR-VIFPVBQESA-N 252.709 2.405 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)c1cc(Cl)n(C)n1 2153839542 QHEVTWBOQHLXBC-ZIAGYGMSSA-N 295.770 2.163 10 10 CECE C[C@@]1(O)CC[C@@H](NCc2ccc(Cl)cc2O)C1 2013794033 TYHGGYFHSAJAMZ-DGCLKSJQSA-N 255.745 2.439 10 10 CECE CNCc1ccc(OC[C@H]2COCC(C)(C)O2)c(C)c1 2155019077 MVNWXHPSFTXCCH-CQSZACIVSA-N 279.380 2.287 10 10 CECE Cc1noc(CCC(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)n1 2155563841 NIOQVHBFXGMPDV-SNVBAGLBSA-N 278.316 2.002 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1ccnc(Cl)c1F 2024147741 ODGLBKIWYUXMLO-UHFFFAOYSA-N 257.656 2.256 10 10 CECE COc1cc(N2CCSC[C@H]2C)ccc1CN 2024763611 WQPVCABHAYVGRD-SNVBAGLBSA-N 252.383 2.096 10 10 CECE CSc1ccc(C=C2SC(=O)N(CCN)C2=O)cc1 2040414894 HHSHCXSUBOMWIV-UHFFFAOYSA-N 294.401 2.404 10 10 CECE CNCCCCN(C)[C@@H](C)c1cc(O)ccc1O 2033152852 OQHUTNVMZBTGFC-NSHDSACASA-N 252.358 2.090 10 10 CECE Nc1ccc(NS(=O)(=O)[C@@H]2[C@H]3CCCC[C@H]32)cc1 2033541142 NABZGGOKIGQZKS-ITGUQSILSA-N 266.366 2.199 10 10 CECE CCCN(C(=O)[C@@H]1C[C@]12CCOC2)c1ccc(N)cc1 2156724830 SXIDGWJMSCGPAH-HOCLYGCPSA-N 274.364 2.438 10 10 CECE CCN(C[C@H]1CCCO1)c1c(F)cc(CN)cc1F 62712382 FAPLICJACAPQDE-LLVKDONJSA-N 270.323 2.429 10 10 CECE Oc1ccccc1CNCC(F)(F)Br 308507584 GPOSBUNUJWHDFQ-UHFFFAOYSA-N 266.085 2.470 10 10 CECE Cc1cc(CNCc2cc3c(cc2O)OCO3)sn1 404377959 LGGAGWKSSULVNR-UHFFFAOYSA-N 278.333 2.176 10 10 CECE Cc1nc(C)c(CNCc2ccc(O)c(O)c2O)s1 311841420 HNMWDANKNQCRPV-UHFFFAOYSA-N 280.349 2.167 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@@H](C(=O)O)C1(C)C 2160047511 WTXZEINNOPFGPP-SKDRFNHKSA-N 279.336 2.344 10 10 CECE Cc1ccc([C@H](C)N2CCC[S@](=O)CC2)c(O)c1 321938585 UDTPJXNYRBOGOM-SGTLLEGYSA-N 267.394 2.216 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC[S@@](=O)CC1 321957999 XDMRKIDTYQQQOU-XTZNXHDOSA-N 271.357 2.047 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CC(CSC)C3)ccc21 2161137504 HFDJZJPRVCHMQV-CQSZACIVSA-N 291.420 2.089 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](SC)[C@H](N(C)C)C2)cc1 2170717188 NDWLBHDUMLWSSN-DAXOMENPSA-N 293.480 2.449 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)CC1[C@H](C)[C@H]1C 2161549522 FWVFIELBWMXMSF-UTUOFQBUSA-N 275.396 2.430 10 10 CECE CN(C[C@@H]1[C@@H]2CCCO[C@H]21)c1ccc(CN)c(F)c1F 2176451002 SBAIGJVGQQSXHJ-FIXISWKDSA-N 282.334 2.285 10 10 CECE Cc1cc2nc(N)cc(Sc3nccs3)n2n1 701858673 DULAKDHDZYCQKY-UHFFFAOYSA-N 263.351 2.228 10 10 CECE Oc1ccc(-c2nc(C[C@@H]3CC3(F)F)no2)cc1O 701932406 SEUKDQXCTFVYGU-SSDOTTSWSA-N 268.219 2.346 10 10 CECE CN1C[C@H]2CN(Cc3cc(Cl)ccc3O)C[C@]2(C)C1 702415057 NNVUSNKKVFXKDC-WFASDCNBSA-N 280.799 2.429 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Br)C[C@@H]1CN 708825996 RZAOKLLCSRZLRR-ZJUUUORDSA-N 299.212 2.181 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC[C@H](C(F)F)C1 687841142 MTFZFJXDDBMSPM-UWVGGRQHSA-N 283.322 2.183 10 10 CECE CC[C@@H]1CN(c2ccc(OC)cc2N)C[C@H](C)O1 689066006 GXMBHZQCZKHKQG-WDEREUQCSA-N 250.342 2.281 10 10 CECE CNCc1ccc(N(C)Cc2cnc(C)n2C)cc1 689569813 LUDDBJXZHXMDHW-UHFFFAOYSA-N 258.369 2.084 10 10 CECE Cc1cc(N(C)[C@@H](C)C(N)=O)ccc1CNC(C)(C)C 711086496 AXGYKYGWEJQMHW-LBPRGKRZSA-N 277.412 2.193 10 10 CECE COc1ccc(O)c([C@H](C)N2CCN[C@H](C)[C@@H]2C)c1 379431722 IXNDXLQXTVUOOV-WOPDTQHZSA-N 264.369 2.144 10 10 CECE C[C@@H]1CCC[C@H]1N(C)c1ccc2c(c1)NC(=O)[C@H]2N 690924694 SCUJKUQURFYZEL-FZQKWOKYSA-N 259.353 2.263 10 10 CECE C[C@H]1CN(CC(=O)c2ccc(O)c(O)c2)C(C)(C)C1 380384692 WBCNKSWGSSQVAW-SNVBAGLBSA-N 263.337 2.401 10 10 CECE C[C@H]1[C@H](C)CCN1[C@@H](CN)c1ccc2c(c1)CCN2C 380765902 QZUQMMOIOYMBOV-IGCXYCKISA-N 273.424 2.409 10 10 CECE CCN1CCc2cc([C@H](O)C[C@H](N)C(F)(F)F)ccc21 2163065511 AWBPLONVHKZPRC-OLZOCXBDSA-N 288.313 2.382 10 10 CECE CCCS[C@@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 382963532 PIEDJOSJVDUFHB-CQSZACIVSA-N 293.436 2.425 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1CCN2CCC[C@H]1C2 383111173 ZTOBJVOEBPXOFU-SMDDNHRTSA-N 264.344 2.105 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1C[C@H]2CC[C@H]1O2 395365553 RVQTZAXVOGAVNZ-NLRBGTRBSA-N 275.348 2.479 10 10 CECE CN(Cc1cnns1)c1ccc(CN)c(Cl)c1 400029322 DOSPKBJICQACCZ-UHFFFAOYSA-N 268.773 2.287 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@]1(O)CCC=C1C 2179169937 CVWPDUIMPSOROI-DLBZAZTESA-N 272.392 2.411 10 10 CECE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)CC3(C)C)c2n1 2062256740 HHVHEYAYUAZHNL-SECBINFHSA-N 288.351 2.004 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@@H]2CCO[C@H]2C)c1 2177610849 IAXGHNXFZCGZBC-JSGCOSHPSA-N 277.364 2.452 10 10 CECE C[C@]1(O)C[C@H]2C[C@H]1C[C@H]2NCc1cc(F)cc(F)c1O 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CECE Nc1ccc(NS(=O)(=O)Cc2ccccc2F)cc1 244025823 SRPJPACSTMHOPG-UHFFFAOYSA-N 280.324 2.350 10 10 CECE COc1ccc(N(C)CCN(C)C(=O)C23CC(C2)C3)cc1 862129528 RGAURLNEMAJAAZ-UHFFFAOYSA-N 288.391 2.390 10 10 CECE CN(c1c(F)cc(CN)cc1F)C1CCOCC1 62711204 ONLMMLYNRWZDHB-UHFFFAOYSA-N 256.296 2.039 10 10 CECE Cc1ccc(C(=O)CCC(=O)NCCN=[N+]=[N-])cc1 74320433 GQXIZDRQDISGHF-UHFFFAOYSA-N 260.297 2.384 10 10 CECE COc1cccc(CN[C@H]2CCNCC(C)(C)C2)c1O 872253011 YHOWWHNGLLJLPI-ZDUSSCGKSA-N 278.396 2.269 10 10 CECE CCC[C@H](COC)NC(=O)Nc1ccc(N)cc1 79769069 CMUCGCUSFBZVLP-GFCCVEGCSA-N 251.330 2.205 10 10 CECE COC(=O)CCCCCNCc1ccccc1O 83385025 AWXKQXCXCXVYAY-UHFFFAOYSA-N 251.326 2.215 10 10 CECE COc1ccc(N2CCNC[C@H]2C(C)C)cc1OC 83479493 DKXOADAUHBRJTR-ZDUSSCGKSA-N 264.369 2.138 10 10 CECE CCN1C[C@@H](C(C)C)NC[C@@H]1c1ccc(O)cc1O 83479596 IUECEYJLMIXGLO-UONOGXRCSA-N 264.369 2.089 10 10 CECE COc1cccc([C@H](N)c2nnc(CC(C)C)o2)c1O 83580646 GTFNYKGWRDHJHN-LBPRGKRZSA-N 277.324 2.030 10 10 CECE 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281.249 2.495 10 10 CECE CN1CCCc2cc(CN[C@H](CO)CC(F)F)ccc21 717769960 YCSMFJREYURNAR-ZDUSSCGKSA-N 284.350 2.175 10 10 CECE NCc1ccc(N2CCO[C@H](C3CC3)C2)c(F)c1F 694846741 PWZYCWQAXLZQJJ-LBPRGKRZSA-N 268.307 2.039 10 10 CECE CCOc1cccc(CN(C)[C@H]2CCC[C@@H]2CN)c1O 89109792 WENKXNLZZOQNMX-OCCSQVGLSA-N 278.396 2.350 10 10 CECE COCc1ccc([C@H](NCCCN=[N+]=[N-])C(=O)O)cc1 90258975 HWWQIEAGAPRAHH-LBPRGKRZSA-N 278.312 2.249 10 10 CECE COC[C@H]1CN(Cc2cc(OC)ccc2O)C[C@@H]1C 2118639171 GRFOEJASEGSKHQ-WCQYABFASA-N 265.353 2.115 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2[C@H]3OCC[C@H]23)c(F)c1 2119904057 PPINVPPYFXCKQI-NFOTXUCKSA-N 265.328 2.350 10 10 CECE Nc1ccc(OCCCN2C[C@@H](F)C[C@@H](F)C2)cc1 2126204408 YSBQJHPHCCHCSR-TXEJJXNPSA-N 270.323 2.420 10 10 CECE COC(=O)c1cnc(N(C)Cc2ccc(N)cc2)s1 2126240967 ULSRBGMJLZATAO-UHFFFAOYSA-N 277.349 2.148 10 10 CECE COc1cc(Cl)cc(CNCc2cncnc2)c1O 2122297100 PIEVMAFMOKNELV-UHFFFAOYSA-N 279.727 2.134 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H](O)[C@H]1C(C)(C)C 2128760709 KFLPGHXKYCSOJH-GJZGRUSLSA-N 263.381 2.473 10 10 CECE COc1nsc(OC)c1CN1CCC[C@@H]1CN=[N+]=[N-] 2123021619 WJCQIYTVUISTJZ-MRVPVSSYSA-N 283.357 2.435 10 10 CECE COc1nsc(OC)c1CN1CCC[C@H]1CN=[N+]=[N-] 2123021620 WJCQIYTVUISTJZ-QMMMGPOBSA-N 283.357 2.435 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc2c(c1)CCC[C@@H]2O 2128272205 QTBQMKJMFJMEQQ-OZVIIMIRSA-N 261.365 2.263 10 10 CECE OCCCN(c1ccc2c(c1)CCC[C@@H]2O)C1CC1 2128274479 PCAWNBIHSMWONT-INIZCTEOSA-N 261.365 2.408 10 10 CECE CC(C)OCCSC[C@H](O)COc1ccc(N)cc1 2128312928 NHMQRNSZRBKHFF-CYBMUJFWSA-N 285.409 2.167 10 10 CECE N[C@@H]1CCc2cc(N3CCC4(CCO4)CC3)ccc21 2128313296 RKQQNHOCLKWKFT-OAHLLOKOSA-N 258.365 2.392 10 10 CECE C[C@H](O)C1CCN(c2ccc3c(c2)CC[C@@H]3O)CC1 2128323241 SVZKLVKRFDITTE-ZBEGNZNMSA-N 261.365 2.263 10 10 CECE CN[C@H]1CCc2cc(N(CCO)C3CCC3)ccc21 2128315812 WRVANCFZHDKEEP-INIZCTEOSA-N 260.381 2.245 10 10 CECE CC[C@@H](c1ccccc1O)N1C[C@H]2C[C@]2(C(=O)O)C1 1902395861 WCRZSEZBDRORJZ-GMXABZIVSA-N 261.321 2.250 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@H]2CC[C@H]1C21CC1 1907314114 XPIIEILLKAQKBT-NRUUGDAUSA-N 264.329 2.008 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3COC[C@@H](C3)C2)c(F)c1 2132519425 JNDVIXKGTHLNSJ-WOPDTQHZSA-N 265.328 2.352 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2[C@@H](F)[C@H](O)C3)cc1Cl 2134105625 SSWYRCAMAQYRKW-SCUASFONSA-N 284.762 2.239 10 10 CECE Cc1cc(CN)ccc1N(CC(F)(F)F)C1COC1 1886841496 RCZKFLKVMQMJFI-UHFFFAOYSA-N 274.286 2.221 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cc(O)ccc2F)C1 1912160127 QRPWWQASNBQOIM-ZETCQYMHSA-N 250.233 2.056 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(S(=O)(=O)c2ccccc2F)C1 1912163387 JBJMUBTXMSCLFO-SECBINFHSA-N 284.316 2.147 10 10 CECE [N-]=[N+]=N[C@H]1CCN(S(=O)(=O)C2CC3(CCC3)C2)C1 1912152679 AFUNLAUBPIUZMP-VIFPVBQESA-N 270.358 2.034 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cc(-c2ccco2)on1 1912209625 BFKGALKKBDFCBC-UHFFFAOYSA-N 261.241 2.317 10 10 CECE COC1CC(N(C)c2c(F)cc(CN)cc2F)C1 1914788341 WGQZJLSYGJEDNI-UHFFFAOYSA-N 256.296 2.037 10 10 CECE CC[C@H](C)N(C)CCNC(=O)CCc1ccc(N)cc1 218049019 UZEUZPDYCGHEPM-ZDUSSCGKSA-N 277.412 2.048 10 10 CECE CC1(C)OCC[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1449789328 QHNMMEUISFPHFN-LLVKDONJSA-N 290.323 2.146 10 10 CECE O=C(CC1CCSCC1)NCc1cc(O)ccc1O 1455356038 GOHVTWJRPZBECM-UHFFFAOYSA-N 281.377 2.247 10 10 CECE C[C@@H]1CC[C@@](O)(CNCc2ccc(N(C)C)cc2)C1 2136916556 XIIOTFXOQCVWFH-CJNGLKHVSA-N 262.397 2.393 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@H]3CCCC[C@H]32)cc1 227952014 GBIFJPXXZPNBLB-IUODEOHRSA-N 273.380 2.472 10 10 CECE C[C@H](N[C@H]1CCN(C)C1(C)C)c1ccc(O)cc1O 1924315062 RJUJPEPIEIPTPW-HZMBPMFUSA-N 264.369 2.231 10 10 CECE CN1CCc2cc(CN[C@@H]3CCN(C)C3(C)C)ccc21 1924331896 ZHWYPBRPXRQLLU-MRXNPFEDSA-N 273.424 2.251 10 10 CECE COc1ccc(CNC[C@@]23CCC[C@@H](C2)OC3)c(O)c1 1925058290 QMIXTZFHLOIEJF-GOEBONIOSA-N 277.364 2.450 10 10 CECE Cc1cc(CN(C)C2CCS(=O)CC2)ccc1N(C)C 1644794268 JBAXWTYUWVREOX-UHFFFAOYSA-N 294.464 2.404 10 10 CECE C[C@H](CC(=O)NCc1cc(O)ccc1O)n1cccc1 1644752437 FNFOSPVCUCAUTM-LLVKDONJSA-N 274.320 2.167 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CC=C[C@H]3CF)c(Cl)cc21 2138258985 WHYSZRYDBKUMRC-JVXZTZIISA-N 281.718 2.006 10 10 CECE Cc1ccc(CN2CCC[C@@H]2[C@@H]2CCCN2)c(O)c1 2139771498 AHHUORDIELYHQO-LSDHHAIUSA-N 260.381 2.417 10 10 CECE Oc1ccc(F)cc1CN[C@H]1C[C@H]2CC[C@H]1[C@@H](O)C2 2139754784 WIIACBNZGMXZET-JWFUOXDNSA-N 265.328 2.170 10 10 CECE Nc1ccc(N2CCN(c3nccs3)CC2)cc1 19268409 UZTZSRFUPYILNK-UHFFFAOYSA-N 260.366 2.052 10 10 CECE Cc1cc(OC[C@@H]2CCCO2)ccc1N1CCC(N)CC1 161695222 AZXHQQKZPYHZRQ-INIZCTEOSA-N 290.407 2.480 10 10 CECE CSCCN(C)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 167642353 RKBXRCDBBFQRBV-LLVKDONJSA-N 285.800 2.091 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H](O)C(F)(F)F)c1 230659198 QRJSPHPXBIVDQR-KWQFWETISA-N 263.259 2.274 10 10 CECE CC(=O)N[C@H](C)CN=NNc1ccc(C(C)=O)cc1 1860489542 ROGLGFSCKCRIET-SECBINFHSA-N 262.313 2.193 10 10 CECE Nc1ccc(CNc2ccc3c(c2)CC(=O)N3)cc1 258901908 DNXGNWCJFMIWJO-UHFFFAOYSA-N 253.305 2.376 10 10 CECE CNc1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 1219957168 FOVCGVMWUIBQLG-UHFFFAOYSA-N 269.348 2.169 10 10 CECE COc1ccc(N2CCN[C@H](C(F)(F)F)C2)cc1C 2141635270 OTIWEBCDQPVYRI-LBPRGKRZSA-N 274.286 2.344 10 10 CECE O=C(NCC1(C(F)(F)F)CC1)c1cccc(O)c1O 804605054 AWVJTVLQUBKLOL-UHFFFAOYSA-N 275.226 2.170 10 10 CECE C[C@@H]1CC[C@H](N)CN1Cc1ccc(Cl)cc1O 1942495358 SLIHNIXFMXZPQB-SKDRFNHKSA-N 254.761 2.357 10 10 CECE Oc1ccc(CCNc2nsnc2Cl)cc1O 1943644079 QSTWYMHQYCOOFN-UHFFFAOYSA-N 271.729 2.257 10 10 CECE O=C(NCc1ccccc1O)[C@]12CCCC[C@@H]1OCC2 934936671 WCQQOQLOOZHORR-HOCLYGCPSA-N 275.348 2.358 10 10 CECE C[C@H]1CN(C)CCN1c1ccc(CN)c(C(F)(F)F)c1 235669047 KWWXTEDWBGGXOA-JTQLQIEISA-N 287.329 2.304 10 10 CECE CN(CCS[C@@H]1CCOC1)c1ccc(N)cc1 1944176171 MPZHHWFPQPCHFC-CYBMUJFWSA-N 252.383 2.227 10 10 CECE C[C@@](F)(CNC(=O)Cc1ccc(N)cc1)C(F)(F)F 1876645800 OXHDWEKLJDCHPY-LLVKDONJSA-N 278.249 2.218 10 10 CECE C[C@H](OC(C)(C)C)[C@@H](NN)c1ccc(N(C)C)cc1 1876963334 PIEJKBFIZMRXCQ-SMDDNHRTSA-N 265.401 2.461 10 10 CECE C[C@H](NC(=O)CC1(CN)CCC1)c1ccccc1O 1877595466 JQTQOALDFUJECX-NSHDSACASA-N 262.353 2.089 10 10 CECE CCCN(CCC)CC(=O)c1ccc(O)c(O)c1 34989426 QCCMQTBWPYIQGY-UHFFFAOYSA-N 251.326 2.403 10 10 CECE COc1ccc([C@H](NN)c2ccccc2O)s1 1946715602 OLHOKIOEJOPWRK-GFCCVEGCSA-N 250.323 2.015 10 10 CECE Oc1c(CNC2(C(F)(F)F)COC2)ccc(F)c1F 1882804761 ZGQXZKYWLSMVOY-UHFFFAOYSA-N 283.196 2.091 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](C(=O)N(C)C)C2)cc1 2143706151 MMIAXBITIKYJOR-GXTWGEPZSA-N 275.396 2.011 10 10 CECE CC(C)C[C@@H](CO)CNCc1c(O)cccc1F 1964055921 NYBFMCDVMXDLTO-LLVKDONJSA-N 255.333 2.276 10 10 CECE C[C@H](CC(=O)N(C)CCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1885557586 RDAQJHQEAQYDGP-SNVBAGLBSA-N 299.375 2.449 10 10 CECE CC(=O)C(=O)CC1CCN(C(=O)OC(C)(C)C)CC1 1951498021 OMMNAKSWLHOVQX-UHFFFAOYSA-N 269.341 2.182 10 10 CECE CCOc1ccc(N2CCC[C@H](N)C2)cc1OCC 43470568 ZZQNSTHVJQIZBG-LBPRGKRZSA-N 264.369 2.412 10 10 CECE OC[C@H](CNCc1c(O)cccc1Cl)C(F)(F)F 1965949950 HRZNCCGLKTVJIL-ZETCQYMHSA-N 283.677 2.306 10 10 CECE COc1ccc([C@H](O)[C@H](N)c2ccccc2O)c(F)c1 2148160899 DVWSQMSDHGJAEO-CABCVRRESA-N 277.295 2.273 10 10 CECE COc1ccc(O)c([C@H](C)NCCCc2ncc[nH]2)c1 139366199 GSRYVLJXOBXFEB-NSHDSACASA-N 275.352 2.407 10 10 CECE NCc1ccc(N2CCOC[C@H]2[C@H]2CCOC2)cc1Cl 2144939886 YUOXZPUXNJMNBW-WFASDCNBSA-N 296.798 2.040 10 10 CECE CCCN[C@@H](C)c1ccc2c(c1)CCN2C[C@H](C)O 252938925 YVVATQKAWJOCNP-STQMWFEESA-N 262.397 2.491 10 10 CECE Oc1cccc2c1[C@H](NC[C@H]1CN3CCC1CC3)CC2 2150797805 NBACGWHNBHNUFT-LSDHHAIUSA-N 272.392 2.311 10 10 CECE CN(C)Cc1cc(F)cc(CC2CCNCC2)c1O 258652478 SEQXRFVJXNQKKO-UHFFFAOYSA-N 266.360 2.135 10 10 CECE CN(C)Cc1cc(F)cc(C2CCNCC2)c1O 258774852 WYOZPSSLBFXZGU-UHFFFAOYSA-N 252.333 2.060 10 10 CECE NN[C@@H](c1ccccc1O)c1cccc2ncccc12 2146238922 AGHYZSLNRSQOIT-MRXNPFEDSA-N 265.316 2.493 10 10 CECE Nc1ccc(CC(=O)NCC/C=C/Br)cc1 1980886182 WUODXAPIKUZJKA-LREOWRDNSA-N 283.169 2.226 10 10 CECE C[C@@H]1CCS[C@H]1CN(C)c1ccc2c(c1)NC(=O)[C@H]2O 2150879176 WQPKFIAXBOZAKE-IIMNLJJBSA-N 292.404 2.250 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@H](C2CNC2)C1 2149002397 CHRLTONHFCYXLE-NEPJUHHUSA-N 276.380 2.090 10 10 CECE Oc1cc(Br)ccc1CN[C@@H]1CC[C@H](O)C1 1983967752 KEDHIQGHJGKLDT-MNOVXSKESA-N 286.169 2.158 10 10 CECE CCCN(c1cc2c(cc1N)OCC(=O)N2)C(C)C 35453235 DNHBRKJOKZEGGY-UHFFFAOYSA-N 263.341 2.225 10 10 CECE CN(C)c1ccc([C@@H](O)C(=O)c2cccc(O)c2)cc1 2147006730 UJZVTMWHBVFZHP-OAHLLOKOSA-N 271.316 2.375 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCc2ccc(C)cc21 160864496 DUDPTIHPFUIOGR-CQSZACIVSA-N 274.324 2.209 10 10 CECE COc1ccc([C@H](C)N[C@H](C)Cn2cccn2)c(O)c1 37154535 NLWBNZGPFUTCBU-NEPJUHHUSA-N 275.352 2.337 10 10 CECE COc1ccc(NC(=O)CCc2ccc(N)cc2)cn1 37222594 JGGLWPVLTHTNCJ-UHFFFAOYSA-N 271.320 2.244 10 10 CECE CCC(CC)N(CCO)C(=O)CCc1ccc(N)cc1 42482630 PSFADVGVQCJUGE-UHFFFAOYSA-N 278.396 2.211 10 10 CECE Oc1cc(Br)ccc1CNC[C@@H]1CC[C@@H]1O 1994692255 WJPVPTCUGWJIQF-KWQFWETISA-N 286.169 2.015 10 10 CECE CC1(C)C[C@H]2CC(=O)N(c3ccc(N)cc3)C(=O)N2C1 2150635340 LDUDNBHDENXRCM-GFCCVEGCSA-N 273.336 2.226 10 10 CECE Oc1cccc(Br)c1CNC[C@H]1[C@H]2OCC[C@H]12 2007580124 OMZPTSNFXHPWKC-KKFJDGPESA-N 298.180 2.279 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C[C@@H]1CCCCN1C(=O)NCc1cc(N)ccc1O 2142193420 XPBATYOEDHZSTK-SNVBAGLBSA-N 263.341 2.058 10 10 CECE C[C@@H]1[C@@H](NCc2ccc3c(c2)CCO3)C[C@H]2CC[C@H]1N2 925557232 MTZBHWUKSLIZBQ-SRMUXQRQSA-N 272.392 2.240 10 10 CECE OC[C@@H](NCc1cc(Cl)ccc1O)C(F)(F)F 1942831022 IIMVCMQGCHRUKR-SECBINFHSA-N 269.650 2.058 10 10 CECE O=C(NCc1ccccc1O)[C@@]12CCCC[C@@H]1OCC2 934936670 WCQQOQLOOZHORR-GOEBONIOSA-N 275.348 2.358 10 10 CECE NC(=O)[C@](CSc1nccs1)(NC1CC1)C1CCC1 2142879707 KDOHKYMAQRJFTC-CYBMUJFWSA-N 297.449 2.011 10 10 CECE C[C@@]1(CNCc2cccc(F)c2O)CCCOC1 1962986583 HMMCILWJEJBEGC-AWEZNQCLSA-N 253.317 2.438 10 10 CECE NCc1ccc(N(CCO)Cc2ccccc2)c(F)c1F 236204441 AHVIQZCTKLZODO-UHFFFAOYSA-N 292.329 2.422 10 10 CECE NCc1ccc(N2CCC[C@@H]2CO)c2ccccc12 236218195 OSJPJRCKOUPTDM-CYBMUJFWSA-N 256.349 2.260 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N(C)C1(C)COC1 2143213222 IKGFIEQOKBSJJI-UHFFFAOYSA-N 261.321 2.318 10 10 CECE CN1CCC(N2CCOc3cc(N(C)C)ccc32)CC1 2143489989 MISYSNAVKKLRNZ-UHFFFAOYSA-N 275.396 2.046 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ccc(CN)nc1 1877533068 OABJOYYFFFMUSC-NSHDSACASA-N 257.337 2.443 10 10 CECE CC[C@H](C)NC(=O)CN(C)[C@@H](C)c1ccccc1O 1877539610 XLKZBRFBBJQHBB-RYUDHWBXSA-N 264.369 2.300 10 10 CECE CCC(=CCN(C)Cc1ccccc1O)C(=O)OC 1877526077 WKVMHVGJUSZHJB-UHFFFAOYSA-N 263.337 2.333 10 10 CECE C[C@@H]1C[C@H](CC(=O)N[C@H](C)c2ccccc2O)CO1 1877573755 OJIAGTRTICBGFF-IJLUTSLNSA-N 263.337 2.385 10 10 CECE CCCc1nnc(CN(C)Cc2ccccc2O)o1 1877526306 ZBXUYLLXCGPBCL-UHFFFAOYSA-N 261.325 2.360 10 10 CECE Oc1cc(F)ccc1CN1CC[C@H](N2CCCC2)C1 1964557012 UETQTTMGQWLCME-AWEZNQCLSA-N 264.344 2.201 10 10 CECE CC1(C)C[C@@H](NC(=O)COc2ccc(N)cc2)CCS1 2143742912 ARRVEFITOBFJSV-LBPRGKRZSA-N 294.420 2.438 10 10 CECE C[C@H](N)c1cc(F)c(N2CCOC[C@H](C)C2)c(F)c1 1880930023 ZSHOKWDLJZBFJZ-ZJUUUORDSA-N 270.323 2.457 10 10 CECE COc1ccc(O)c(CN(C)[C@H]2CCCC[C@H]2CN)c1 250021800 YNMFOZBMAGAGLA-WFASDCNBSA-N 278.396 2.350 10 10 CECE CO[C@@H]1C[C@H](NCc2c(O)cccc2F)C1(C)C 1964079197 JIYZPNJTMGQSJY-QWHCGFSZSA-N 253.317 2.434 10 10 CECE COC(CNCc1c(O)ccc2ccccc12)OC 37566457 GJLHVJFWJXJPLS-UHFFFAOYSA-N 261.321 2.254 10 10 CECE C[C@H]1CC[C@@H](CN(C)C(=O)Nc2ccc(N)cc2)O1 1885279840 GZHKMYCIYILJMY-GWCFXTLKSA-N 263.341 2.300 10 10 CECE CN(C)c1ccc(CNC[C@@H]2C[C@H]3O[C@H]2[C@H]2C[C@@H]23)cc1 2144070102 VRRYFQUWYCFNET-ZZTPXLKCSA-N 272.392 2.266 10 10 CECE C[C@@H]1OCC[C@H]1CCOC(=O)Cc1ccc(N)cc1 1886385055 PAESXKGREFOAHC-AAEUAGOBSA-N 263.337 2.170 10 10 CECE CN[C@@H](COC)c1cc(Br)ccc1O 1951858639 CDSCHUVXFLXVAC-VIFPVBQESA-N 260.131 2.062 10 10 CECE Nc1ccc(CCNC(=O)[C@@H]2CC[C@@H]3[C@@H]2C3(F)F)cc1 1966886714 JSUXEHYNJQBTKJ-JHJVBQTASA-N 280.318 2.219 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@]2(C)CCCCO2)cc1 2144881221 YPIBMVHCESKRKL-HOTGVXAUSA-N 278.396 2.418 10 10 CECE COC[C@@H]1CN(Cc2cccc(C)c2O)C[C@@H]1COC 1967845907 LVMRWLSXQIRYKA-GASCZTMLSA-N 279.380 2.041 10 10 CECE Cc1ccc(O)c(CNC[C@H]2CC(F)(F)CO2)c1 1967823447 YIHZYKZYVGHVOM-LLVKDONJSA-N 257.280 2.214 10 10 CECE COC[C@@H]1CN(Cc2ccc(Cl)cc2O)C[C@@H]1COC 1967851168 XRFAYNLOSOSKKE-BETUJISGSA-N 299.798 2.386 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H]3CNC[C@H]3[C@@H]2C)c1 252556577 LQCKSLGCFQDVMI-ASHKBJFXSA-N 276.380 2.002 10 10 CECE C[C@@H](c1ccccc1O)N1CCC2(CCC(=O)N2)CC1 2145399744 ZXEQPZXAEBXWSQ-LBPRGKRZSA-N 274.364 2.198 10 10 CECE Oc1cc(Cl)ccc1CN1CCOC[C@H]1CF 1971806074 XSZDSDRAFJIGMC-LLVKDONJSA-N 259.708 2.216 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1[C@@H]2CCOC[C@H]21 1972264233 YLMDZLWBIRXWRX-QJPTWQEYSA-N 269.291 2.043 10 10 CECE CN(c1ccc(CO)cc1[N+](=O)[O-])[C@@H]1CCCOCC1 2145470954 ZXCQKSUNQRZPQZ-GFCCVEGCSA-N 280.324 2.092 10 10 CECE COc1ccc(CNC[C@@H]2C[C@@H]3OCC[C@H]3O2)cc1C 1974127370 IGJYWFQUFYCXOK-IMJJTQAJSA-N 277.364 2.040 10 10 CECE C[C@H](O)c1ccc(N2CCOCC[C@@H]2C)c([N+](=O)[O-])c1 2148960945 FPORTBBJGVRWIX-QWRGUYRKSA-N 280.324 2.263 10 10 CECE Cc1ccc([C@H](C)N[C@@H]2CCC[C@@H](C(N)=O)C2)c(O)c1 2146212872 YFYSZIYOERKUPI-YNEHKIRRSA-N 276.380 2.395 10 10 CECE NN[C@@H](c1ccccc1O)c1cnccc1C(F)(F)F 2146242140 OJSDTYOMNFGTTJ-LBPRGKRZSA-N 283.253 2.359 10 10 CECE CC(C)CC[C@@H](C)N(CC(N)=O)Cc1ccc(N)cc1 2146486719 HRLNFCMOBSIYFY-CYBMUJFWSA-N 277.412 2.381 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1coc(CN)c1 2150641469 GRVBQUPPMLTWOQ-JTQLQIEISA-N 274.320 2.277 10 10 CECE CO[C@@H]1CCN(C(=O)CCc2ccc(N)cc2)C[C@H]1C 2149314823 CFZUBCDSXMZYRN-IUODEOHRSA-N 276.380 2.085 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@@H]3C[C@H]32)cc1Cl 2004447137 QQYMFOCNECSRQE-BZHVJNSISA-N 253.729 2.371 10 10 CECE Cc1cc(C(=O)NCCOc2ccc(N)cc2)c(C)o1 38079538 IAKCCTMZFXUYSM-UHFFFAOYSA-N 274.320 2.287 10 10 CECE CCCN[C@H](c1ccccc1O)[C@]1(O)COCC1(C)C 2148164610 PYXXLJNFLOZRFX-GDBMZVCRSA-N 279.380 2.220 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@@H]1[C@@H]2CCOC[C@H]21 2150123913 QBFRSKRDOOJTSZ-ARFHVFGLSA-N 272.392 2.180 10 10 CECE CC(C)C[C@@H](C)N(C)S(=O)(=O)Cc1ccc(N)cc1 40317762 HOBKXIFMKKWRFL-GFCCVEGCSA-N 284.425 2.465 10 10 CECE Nc1cc2c(cc1N1CC[C@H]3[C@H](C1)C3(F)F)OCCO2 2152132204 MLGRXNAATNXMBW-IUCAKERBSA-N 282.290 2.131 10 10 CECE C[C@H](N)c1ccc(N2CC=C[C@@H]2CO)c(Cl)c1 2007502026 YSUCGZYSYQDYSS-GXSJLCMTSA-N 252.745 2.097 10 10 CECE C[C@H]1CN(C(=O)c2ccc(O)c(O)c2)C[C@@H](C)C1(F)F 2153803722 MQTJLWWRNJEEMF-DTORHVGOSA-N 285.290 2.461 10 10 CECE CC(C)N(C)CCCCNCc1cccc(O)c1O 45684826 WGOJUHFRMQSCHH-UHFFFAOYSA-N 266.385 2.308 10 10 CECE CC[C@]1(C)OCCC[C@@H]1NC(=O)Cc1ccc(N)cc1 2155090115 CHZFSZXRSVCAQZ-HOCLYGCPSA-N 276.380 2.275 10 10 CECE Cc1cc(CN(C)c2c(F)cc(CN)cc2F)n(C)n1 2155352818 ZIGHSEYSPYQDNA-UHFFFAOYSA-N 280.322 2.102 10 10 CECE Nc1cccc(Cl)c1N[C@H]1CC[C@H]2C[C@H]1CN2 2016930907 XNKYCQBDMKTDQD-AUTRQRHGSA-N 251.761 2.475 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)OCCCO3)[C@H](C)C1 49707520 HMRWJGSCPXOTDF-CHWSQXEVSA-N 276.380 2.425 10 10 CECE C[C@H]1CCC[C@@](CO)(NCc2ccc(O)cc2O)C1 53115765 LWOOTUINQWIGMI-XHDPSFHLSA-N 265.353 2.129 10 10 CECE OCC[C@@H]1CCC[C@H]1NCc1ccc(F)cc1O 294780475 UKVSKMJAMLABGD-GXFFZTMASA-N 253.317 2.172 10 10 CECE C[C@@H]1CN(c2ccc(CO)c(Cl)c2)[C@H](C)C[C@@H]1O 2032206368 ZPGKUBBUKFCPOW-RULNRJAQSA-N 269.772 2.428 10 10 CECE CCc1cccc(CN2CCOC(F)(F)C2)c1O 2034883581 ZHQMLTJHCFRKNJ-UHFFFAOYSA-N 257.280 2.380 10 10 CECE CCN(CC)[C@H]1CCN(c2ccc(CNC)cc2F)C1 62967225 XPOYMZOHOXQPFC-AWEZNQCLSA-N 279.403 2.466 10 10 CECE CN1CCCc2cc(CN[C@@H]3CCC[C@H]3CO)ccc21 300739394 UUWPNXGGLWHHLQ-JKSUJKDBSA-N 274.408 2.320 10 10 CECE CN=c1cc(Sc2nccs2)c2nc(C)cn2[nH]1 2040909238 RMQFAJQJPNRKMK-UHFFFAOYSA-N 277.378 2.109 10 10 CECE CCNCc1ccc(N(C)[C@@H]2CCN(C3CC3)C2)cc1 2160037114 FRIFWWJADVAOIB-QGZVFWFLSA-N 273.424 2.469 10 10 CECE Cc1ncc(CN(C)c2ccc3c(c2)NC(=O)[C@H]3N)s1 400171059 MXQFZMJFVSVYIJ-ZDUSSCGKSA-N 288.376 2.040 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCO[C@@H]1C(C)(C)C 2160267172 VICYYYQEPAQMCK-ZWNOBZJWSA-N 284.360 2.023 10 10 CECE COc1ccc(CN(C)C2(C(=O)O)CCCC2)c(O)c1 312551160 UMBYRADNUSZYCN-UHFFFAOYSA-N 279.336 2.230 10 10 CECE CNC(=O)CSCc1cc(CNC(C)C)ccc1OC 312637247 SPWBOSCAZAYUIW-UHFFFAOYSA-N 296.436 2.172 10 10 CECE CC(C)NCc1ccc(N(C)Cc2ncno2)c(F)c1 2160396917 GOWOATDOOASVQM-UHFFFAOYSA-N 278.331 2.343 10 10 CECE CCc1ocnc1CN(C)C(=O)Nc1ccc(N)cc1 2160355420 SLWYAZRLCISNTR-UHFFFAOYSA-N 274.324 2.483 10 10 CECE CCCc1ocnc1CNCc1ccc(O)c(O)c1O 2160375826 GJEGMAFPJFGWLP-UHFFFAOYSA-N 278.308 2.034 10 10 CECE CCN1CCCN(c2ccc(CN)c(C)c2)[C@H](C)C1 319906958 ZHGSIJRIIZGUNV-CQSZACIVSA-N 261.413 2.374 10 10 CECE C[C@@H]1C[C@@H](NCc2ccc(F)c(F)c2O)CCO1 703271501 AZAOJJKAPGPCKK-SCZZXKLOSA-N 257.280 2.328 10 10 CECE C[C@@H]1CN(c2ccc(CO)cc2Cl)C[C@]1(C)CO 703715547 AKLYWYFTPGBRCT-QMTHXVAHSA-N 269.772 2.287 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](O)C[C@@H]2C)c(F)c1 706002685 SUBMXPMGLGMXOK-JBLDHEPKSA-N 252.333 2.195 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CCCC[C@H]43)c(F)cc2[C@@H]1O 706833906 XVUAVWMMYBKVKB-PELMWDNLSA-N 276.311 2.190 10 10 CECE CSC1CC(N(C)Cc2cc(N)ccc2O)C1 707139649 NFBAWOMRWLCTGR-UHFFFAOYSA-N 252.383 2.300 10 10 CECE CCC1(O)CCN(c2ccc(CN)c(F)c2F)CC1 707219161 BFBSWXPHEPLZMV-UHFFFAOYSA-N 270.323 2.165 10 10 CECE CC[C@@H]1CCN[C@@H]1[C@@H](O)c1ccc2c(c1)CCCN2C 2163107561 OYLKXPURTBDXEX-DQYPLSBCSA-N 274.408 2.491 10 10 CECE C[C@H]1C[C@@](O)([C@H](N)c2ccc(N(C)C)cc2)C[C@@H](C)O1 2163140115 FVQOFJZKNYVPSI-NOXHYTERSA-N 278.396 2.071 10 10 CECE CCN1CCc2cc([C@H](NC)[C@H](O)C3CCC3)ccc21 2163141203 RTUWFRUTJPSJQW-DLBZAZTESA-N 274.408 2.491 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)[C@@H]3CCCSC3)ccc21 2163137775 GVEUNJMYEQTRHL-VNQPRFMTSA-N 292.448 2.183 10 10 CECE CCO[C@@H]1C[C@H]1C(=O)N(C)[C@@H](C)c1ccccc1O 690079529 XLHLIDKBEIOOKP-ZKYQVNSYSA-N 263.337 2.337 10 10 CECE COc1ccc(N(CCCN)CCOCC2CC2)cc1 690382813 HMRFPUUYGHPOBC-UHFFFAOYSA-N 278.396 2.277 10 10 CECE Cc1cnc(COC(=O)CCc2ccc(N)cc2)nc1 692494196 FIRVYNUVSLYNMD-UHFFFAOYSA-N 271.320 2.043 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(O)C2)cc1Br 384069485 SWVABDRKKDBETI-VIFPVBQESA-N 299.212 2.301 10 10 CECE Cc1csc(CNC(=O)c2ccc(O)c(O)c2)c1 385943742 GVJYYVPOIGCNCR-UHFFFAOYSA-N 263.318 2.398 10 10 CECE COCCOCCN(C)[C@H](C)c1cc(C)ccc1O 388342289 XQRFEADCAIONIJ-CYBMUJFWSA-N 267.369 2.356 10 10 CECE Cc1ccc([C@H](C)N[C@@H](C)c2cn(C)nn2)c(O)c1 720540994 ORNOHLRTVRJNLS-QWRGUYRKSA-N 260.341 2.241 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H](CCO)C(C)C 2165033465 LKSRRAUNDDBJPU-CYBMUJFWSA-N 280.368 2.264 10 10 CECE Cc1nnc(CCN[C@H](C)c2c(O)cccc2O)s1 391832891 IAWFFAKMBNGTBZ-MRVPVSSYSA-N 279.365 2.151 10 10 CECE CCCC(=O)NCCN[C@H](C)c1ccc(N(C)C)cc1 393130581 WZZCONZOPLBEHY-CYBMUJFWSA-N 277.412 2.320 10 10 CECE CO[C@@H]1[C@H]2C[C@@H]3CN(c4ccc(CN)cc4F)[C@H]1[C@H]3C2 394325759 LUKKRMFNGPHOFW-WORXLNIRSA-N 276.355 2.144 10 10 CECE c1cc2c(cc1CN[C@@H]1CC13CCOCC3)CCO2 395651588 RUIWOOQOIQEYLJ-OAHLLOKOSA-N 259.349 2.280 10 10 CECE Cc1ccc(CNCc2ccc3c(c2)CCO3)nn1 396613094 KUQBMYWMMPORCZ-UHFFFAOYSA-N 255.321 2.010 10 10 CECE CNC(=O)[C@H]1CCN([C@H](C)c2cc(Cl)ccc2O)C1 398461028 JAOWWONUBWORSC-ZJUUUORDSA-N 282.771 2.175 10 10 CECE C[C@H](N[C@@H]1COC2(CCOCC2)C1)c1ccccc1O 2178982233 KHRFCTOWUPPSEH-STQMWFEESA-N 277.364 2.381 10 10 CECE CCO[C@H]1CC[C@H](C(=O)NCCc2ccc(N)cc2)C1 2174914888 GJDNFSJCYUKATK-ZFWWWQNUSA-N 276.380 2.133 10 10 CECE CC[C@H](O)c1ccc(N2C[C@H](CCO)O[C@H](C)C2)cc1 2179380205 FWJNBHAFVMQATH-KCXAZCMYSA-N 279.380 2.106 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@H]2C[C@H]3CC[C@H]2O3)cc1 2168148788 RCRDZLCVTYCSLL-LVQVYYBASA-N 276.380 2.026 10 10 CECE C[C@H](c1ccc(F)cc1O)n1cc(C(=O)NC2CC2)cn1 2069943410 YRTWWSAJPXTOOD-SECBINFHSA-N 289.310 2.229 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@@H]2CNCC[C@H]2C1 2168803387 UXRJATSDZULILE-KBMXLJTQSA-N 273.424 2.355 10 10 CECE CC(C)CCNC(=O)[C@H](C)OCCc1ccc(N)cc1 2176290974 UJSHGCMRAVAVOE-ZDUSSCGKSA-N 278.396 2.379 10 10 CECE CCNCc1ccc(N2CCCN(C3CC3)CC2)cc1 2170075631 OYPAZNKAPYBFAL-UHFFFAOYSA-N 273.424 2.471 10 10 CECE CCS(=O)(=O)C[C@@H](C)N(C)c1ccc([C@@H](C)NC)cc1 2170562466 QVHORZZGDPDUQK-CHWSQXEVSA-N 298.452 2.226 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](c3nccn3C)C2)cc1 2171702034 MAUITSCPDWHUTA-JSGCOSHPSA-N 270.380 2.434 10 10 CECE CC[C@H]1C[C@@H](NCc2ccc(O)c(O)c2)CCO1 1170178957 RVHLZODEAIWGIS-RYUDHWBXSA-N 251.326 2.145 10 10 CECE CCC[C@@H]1C[C@@H](Nc2c(N)cccc2C(N)=O)CCO1 2182901493 MCFQXNZKDAOJPK-WDEREUQCSA-N 277.368 2.127 10 10 CECE 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2261310365 XFCPUFCVDRXURR-QMMMGPOBSA-N 261.268 2.205 10 10 CECE CNCC(C)(C)N(C)[C@H](C)c1cc(OC)ccc1O 2273285835 JZFLEVNPCVJKEQ-LLVKDONJSA-N 266.385 2.392 10 10 CECE Nc1ccc(CC(=O)c2ccn(CC(F)F)n2)cc1 2278636500 CAPWUIFCNAIKLJ-UHFFFAOYSA-N 265.263 2.156 10 10 CECE COC(=O)c1cnc(NCc2cnc(SC)s2)cn1 2269121072 KGUMIOBISSJYDT-UHFFFAOYSA-N 296.377 2.054 10 10 CECE COC[C@]1(C)[C@@H]2C[C@@H]2CN1c1ccc(OC)cc1N 2269279876 LOKIKJKINAQIIR-IXPVHAAZSA-N 262.353 2.139 10 10 CECE Cc1cc(N2CC[C@@H]3[C@H]2C[C@]3(C)O)ccc1[C@@H](C)O 2269690834 RYHYKNHVBOQPPE-MPESAESLSA-N 261.365 2.398 10 10 CECE Cc1cc(N2C[C@@H]3[C@@H](CO)C[C@H]3C2)ccc1[C@@H](C)N 2269663095 PXAPAGDIKDWCLD-IATRGZMQSA-N 260.381 2.079 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2C[C@]23C[C@H]3C(=O)O)c1O 2283288545 BCOLDCPDZPXGKM-PXWWUCIGSA-N 297.738 2.007 10 10 CECE Cc1cc(N2[C@H]3CC[C@H]2[C@H](F)[C@H](O)C3)ccc1[C@H](C)O 2285153539 KEMGKLJWBPOBPY-QJXWRWMASA-N 279.355 2.488 10 10 CECE COc1ccc(N2C[C@H](C)[C@@H](N)[C@H](C)C2)c(OC)c1C 2295416469 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Cc1cc([C@H](C)N)ccc1N(C)[C@@H](CO)C(C)C 2318852088 IHAVADBDFJRDNP-WFASDCNBSA-N 250.386 2.468 10 10 CECE CSc1cc(N2CCN(C)C[C@H]2C)ccc1CN 2328544173 CFPRWVNBGZRXJP-LLVKDONJSA-N 265.426 2.008 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2[C@@H](N)[C@@H]3CCC[C@@H]23)cc1 2330426995 IKVRFIWTJMVBDW-OWYFMNJBSA-N 260.381 2.159 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(S(=O)(=O)[C@H]2CCCC[C@H]2F)C1 2330641994 LXLMUQGEVZUFCM-MXWKQRLJSA-N 290.364 2.229 10 10 CECE CCN1[C@H]2CC[C@@H]1CN(Cc1c(C)cccc1O)C2 2335537778 MPHCQKKRCFODAF-OKILXGFUSA-N 260.381 2.369 10 10 CECE C[C@H]1Cc2cc(N3CCC4CC3(CO)C4)ccc2O1 2336481940 HQRUMKRKHCVDDB-FZWSLVFFSA-N 259.349 2.361 10 10 CECE CCc1cccc([C@H](O)[C@H](N)c2ccccc2O)n1 2337123129 WWSRJELSALAELD-CABCVRRESA-N 258.321 2.083 10 10 CECE COc1ccc(N2CC[C@H](O)[C@H](C)[C@@H]2C)c(C=O)c1 2344527286 UXIDZMIOIKBOGX-ZETOZRRWSA-N 263.337 2.103 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1OC 2349984770 BLSJEUJNTPAKAE-DRZSPHRISA-N 263.337 2.053 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]3C[C@@H]2CO3)CC1 2354196381 HDCUTTSBKMXLNX-FVCCEPFGSA-N 278.356 2.493 10 10 CECE O[C@H]1CC[C@H]2[C@H](CCN2c2ccc3c(c2)CC[C@@H]3O)C1 2356173053 RGRNCLKCUMCARY-QCPWZWHMSA-N 273.376 2.406 10 10 CECE CO[C@H]1CCC[C@H]1N[C@@H](C)c1ccc(O)cc1O 50369781 ZYCCKRAEXAPDNY-BHYNMZESSA-N 251.326 2.316 10 10 CECE C[C@@]1(C(=O)NCc2ccccc2O)CCCS1 133941724 CNRMPZFMAZHQHR-ZDUSSCGKSA-N 251.351 2.294 10 10 CECE CCOC(=O)[C@H](COc1ccc(N)cc1)C(F)(F)F 1952371288 DTGOXALDDVTGHS-JTQLQIEISA-N 277.242 2.389 10 10 CECE CCOC(=O)[C@](NCCCN=[N+]=[N-])(C(C)C)C(F)F 1893288650 MEYBAKQBSRAROY-NSHDSACASA-N 278.303 2.499 10 10 CECE CCCNCc1ccc(N2CCNC(=O)[C@H]2CC)cc1C 110683029 FFKKSAAIBXVVAE-MRXNPFEDSA-N 289.423 2.209 10 10 CECE COC[C@@](C)(CN(C)Cc1cc(C)ccc1O)OC 1894310018 ZVMMONBLRCTCLH-OAHLLOKOSA-N 267.369 2.184 10 10 CECE Cc1ccc([C@H](C)NC[C@H](C)N2CCOCC2)c(O)c1 184935683 GBBBFYQWBDABFX-KBPBESRZSA-N 278.396 2.072 10 10 CECE CC(=O)N[C@@H]1CCN(c2ccc([C@@H](C)N)cc2Cl)C1 228283439 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KYVNLCYRVSPTNX-JTQLQIEISA-N 268.704 2.454 10 10 CECE Cc1ccc(Br)c([C@@H](N)C(F)(F)CO)c1O 95706340 JQFKJHMNHULINQ-SECBINFHSA-N 296.111 2.091 10 10 CECE CN1N=C(C(F)(F)F)/C(=C/c2cccc([N+](=O)[O-])c2)C1=O 1865676834 MYOIGCMUVQXQCQ-TWGQIWQCSA-N 299.208 2.369 10 10 CECE CCOC(=O)[C@@](C)(NCCCN=[N+]=[N-])C1(C)CC1 94952764 HUOXAONIAFBIMR-GFCCVEGCSA-N 254.334 2.398 10 10 CECE C[C@@]1(c2noc(-c3ccc(O)c(O)c3)n2)CCCO1 235391557 BXAAYDDAWGNPAC-ZDUSSCGKSA-N 262.265 2.173 10 10 CECE CCOCCCC(=O)N(C)Cc1ccc(N)cc1 95033780 QEJSVWBWTRVZLP-UHFFFAOYSA-N 250.342 2.044 10 10 CECE C[C@H]1[C@H](C)CCCN1C(=O)COc1ccc(N)cc1 50563246 VKMVXNMMFPFCQT-NEPJUHHUSA-N 262.353 2.295 10 10 CECE CCOc1cccc(CN2C[C@@H]3CNC[C@H]3[C@@H]2CC)c1O 251472006 BNFDGJVWNYYWSP-ZNMIVQPWSA-N 290.407 2.221 10 10 CECE Oc1c(C[C@@H]2CCCN2)cc(Br)c(F)c1O 258473415 IAYYAAWOLUOSIL-ZETCQYMHSA-N 290.132 2.294 10 10 CECE COc1ccc(N2CCC[C@H]2CCCO)c([N+](=O)[O-])c1 52761609 PMMZIHWRGORFRG-NSHDSACASA-N 280.324 2.345 10 10 CECE Cc1cc(Cl)cc(CN2CC(=O)NCC2(C)C)c1O 282249297 BCAXHAPIQONDDP-UHFFFAOYSA-N 282.771 2.064 10 10 CECE CNCc1ccc(N2C[C@@H]3CN(C)CC[C@H]3C2)c(Cl)c1 383403952 ABZHQXXCZRFXNT-KBPBESRZSA-N 293.842 2.447 10 10 CECE CCOC[C@](C)(O)[C@H](N)c1ccc(N(CC)CC)cc1 2163151830 MVQYMOOEOAZXLV-CVEARBPZSA-N 280.412 2.320 10 10 CECE CC(=O)C(=O)COC(=O)c1cccc2c(C)c(C)[nH]c12 808500337 JRQXJXYMNAAAGM-UHFFFAOYSA-N 273.288 2.100 10 10 CECE CCO[C@H]1C[C@H](OC)CN(c2ccc([C@H](C)O)cc2)C1 2165442467 YJKXLYDBAMJRNX-RCBQFDQVSA-N 279.380 2.370 10 10 CECE CC[C@@H]1CCNC[C@]1(O)c1ccc(N2CCCC2)cc1 2163645144 YBOVCGUWTIZYQQ-RHSMWYFYSA-N 274.408 2.494 10 10 CECE COc1ccc(O)c([C@@H](C)N2CC[C@H]2CCC(=O)O)c1 2165709234 UIWJVPJISAAXOH-GHMZBOCLSA-N 279.336 2.401 10 10 CECE COC[C@H]1CCCCN1CCOc1ccc(N)cc1 396151432 WZGATNUWYABVFL-CQSZACIVSA-N 264.369 2.149 10 10 CECE Nc1cc2c(cc1N1CC[C@@H](CCF)C1)CCC(=O)N2 2165899822 FGHXAGLUSHMOQM-SNVBAGLBSA-N 277.343 2.339 10 10 CECE COc1ccc(N2CCC(N[C@@H](C)[C@@H](C)O)CC2)cc1 806171229 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Cc1cc(N(C)C)ccc1CN1CCC2=C(CCC(=O)N2)C1 826790681 KVHCJLAAMYIAPY-UHFFFAOYSA-N 299.418 2.431 10 10 CECE Cc1cc(C)cc(N(C)C(=O)c2c[nH]nc2[C@@H]2CCNC2)c1 662522913 GSKWIKINRHERGW-CYBMUJFWSA-N 298.390 2.380 10 10 CECE COc1cc(O)c(CN[C@H]2C[C@@H]3C[C@@H]3C2)cc1OC 822539473 JQYWFALIYFVYHC-PEGIJTEDSA-N 263.337 2.298 10 10 CECE CCOc1ccc(O)c(CN2CC[C@@H]3CNC[C@@H]3CC2)c1 843128342 WIDCRMUNAPDCCJ-OKILXGFUSA-N 290.407 2.222 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@@H]1CCCC[C@H]1O 131908631 VWPMXEVSHUXUMJ-CHWSQXEVSA-N 263.341 2.036 10 10 CECE Cc1cc(N(C)C)ccc1CNCCCN1CCCC1=O 840928315 OZTIXDUQPWCPDV-UHFFFAOYSA-N 289.423 2.163 10 10 CECE CCNCc1cc(F)c(N2[C@H]3COC[C@H]2C3)c(F)c1 1899653237 AVOOATYXHDHZIY-GHMZBOCLSA-N 268.307 2.052 10 10 CECE NC[C@H]1c2ccccc2CCN1Cc1ccccc1O 843127550 DWUYPTPWZUIHQE-INIZCTEOSA-N 268.360 2.450 10 10 CECE CN(C)c1ccc(CNC(=O)[C@@]23C[C@H]2COC3(C)C)cc1 854271604 NBHMIWIPMIXUKI-SUMWQHHRSA-N 288.391 2.184 10 10 CECE C[C@H](NC(=O)N[C@@H]1C[C@@H](C)O[C@H]1C)c1ccccc1O 868899683 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CCC[C@@H](C)CNC(=O)[C@@H](N)c1ccc(C)cc1O 83479305 PUDAHBZZCXTQKL-RISCZKNCSA-N 264.369 2.253 10 10 CECE COc1ccc(O)c([C@@H]2CN[C@H](C(C)C)CN2C)c1 83479557 IQROWTVSNNKDPX-KBPBESRZSA-N 264.369 2.002 10 10 CECE Nc1cc(F)ccc1[C@@H]1NCCc2c1ccc(O)c2O 83656196 NGVUJGXXLBJVCJ-CQSZACIVSA-N 274.295 2.054 10 10 CECE Oc1ccc(O)c2c1CCN[C@@H]2c1ccc(Cl)nc1 83657958 RTWGGNVNFKINTP-CQSZACIVSA-N 276.723 2.381 10 10 CECE C[C@H]1COCCN1C(=O)c1cc2cc(O)c(O)cc2s1 895677058 HCNDRNPGMRFNSK-QMMMGPOBSA-N 293.344 2.173 10 10 CECE COc1cc(O)c(CN2C[C@H](OC)CC[C@H]2C)cc1OC 895928768 UZIRJXWAZLVCEM-DGCLKSJQSA-N 295.379 2.409 10 10 CECE CN(C)c1ccc(CNC(=O)N[C@H]2[C@H]3CCC[C@H]32)cc1 783684075 QVUHUJDYPGADSU-QDMKHBRRSA-N 273.380 2.350 10 10 CECE C[C@H](NC[C@@]1(C)CCCO1)c1cc(O)ccc1O 94797147 FYKVKNCSURQGBT-IINYFYTJSA-N 251.326 2.318 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc(Cl)nnc1Cl 706390913 YDOGIECTYQJCKN-UHFFFAOYSA-N 275.099 2.214 10 10 CECE CCN1CC[C@@H]1CNCc1c(O)cccc1Cl 712594702 ODLPVNLGMPGTCK-SNVBAGLBSA-N 254.761 2.229 10 10 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CC[C@@H](O)c1ccc(N2CCCC[C@@H]2CC(N)=O)cc1 2183262150 GOFVSYCRTZSJLA-HUUCEWRRSA-N 276.380 2.364 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)CC12CC2 2184689516 PRGPVNAXCQJCDB-CVEARBPZSA-N 273.376 2.408 10 10 CECE COCCN(CCOC)c1c(F)cc([C@@H](C)O)cc1F 2194508552 DWWBYOXNSLQWPB-SNVBAGLBSA-N 289.322 2.117 10 10 CECE CN(C[C@@]12CCOC[C@@H]1C2)c1c(F)cc(CO)cc1F 2194557541 ZQKYYDDTTAJITQ-NHYWBVRUSA-N 283.318 2.320 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC(CCN(C)C)C2)c(F)c1 2194518215 NUCMVEQSYDWTDC-SNVBAGLBSA-N 284.350 2.406 10 10 CECE CN[C@@H]1CCc2cc(N3CCN(C)[C@@H]4CC[C@H]43)ccc21 2184724206 WPJMKCASKUVYCJ-BRWVUGGUSA-N 271.408 2.176 10 10 CECE CC1(C)[C@@H]2[C@@H](CCN2c2ccc3c(c2)CC[C@@H]3N)[C@H]1O 2184739899 MSDVCCZNMZPBDA-FXUDXRNXSA-N 272.392 2.228 10 10 CECE C[C@@H]1CNCCC[C@]1(O)c1ccc2c(c1)CCCN2C 2190716812 UBXKSJOTWJIXEW-CXAGYDPISA-N 274.408 2.276 10 10 CECE C[C@H]1C[C@H](F)CN1CCCOc1ccc(N)cc1 2042198662 QPZOVZLBBGKLSG-RYUDHWBXSA-N 252.333 2.470 10 10 CECE Cc1nccn1[C@@H](C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2185977195 BSJGBTNFZXOCCV-JTQLQIEISA-N 276.344 2.301 10 10 CECE CN(C[C@H]1CCCc2nccn21)c1ccc(CN)cc1 2186034122 NAWBHERHSRCGSF-OAHLLOKOSA-N 270.380 2.356 10 10 CECE O=C(O)CC[C@@H]1CCN1Cc1c(O)cccc1Cl 2047053159 SWCCITFQPLJNNQ-SECBINFHSA-N 269.728 2.485 10 10 CECE CCCNCc1cc(F)c(N2C[C@H]3COC[C@@H]32)c(F)c1 2186375723 XBTKYDUDXYBMPE-FZMZJTMJSA-N 282.334 2.299 10 10 CECE FC(F)(F)Cn1ccnc1C=C[C@@H]1CCCNC1 2050587286 CSAIRTXATQFLDL-JTQLQIEISA-N 259.275 2.458 10 10 CECE Oc1cccc(CN[C@@H]2[C@H]3CCC(F)(F)[C@H]32)c1O 2051227604 CCJOMVWZMXRYCW-JMJZKYOTSA-N 255.264 2.231 10 10 CECE CCOC1CC(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2054027444 VQZYORGFWOVPPM-UHFFFAOYSA-N 252.318 2.008 10 10 CECE Nc1ccc(N2C(=O)N[C@H]([C@H]3CC=CCC3)C2=O)cc1 2196097802 UKESIRCMWLRJNY-GXFFZTMASA-N 271.320 2.050 10 10 CECE COC[C@@H]1C=CCN1c1ccc([C@@H](C)O)cc1F 2061978537 UDSHJFVDQGXOLY-PWSUYJOCSA-N 251.301 2.270 10 10 CECE C[C@H](NC(=O)C[C@@H]1CC[C@@H](CN)C1)c1ccccc1O 2192628953 QMTFBXAAKXBMMU-YNEHKIRRSA-N 276.380 2.335 10 10 CECE CN(Cc1ccccc1O)c1nc(Cl)nc2n[nH]cc12 2192600094 IGAGILUPHATJSM-UHFFFAOYSA-N 289.726 2.348 10 10 CECE C[C@H](NC(=O)[C@@]12CCC[C@@H](CC1)N2)c1ccccc1O 2192631689 KKYFZALJPLOISW-MQIPJXDCSA-N 274.364 2.244 10 10 CECE CO[C@H]1C[C@@H]1COc1ccc(N2CCC(N)CC2)cc1 2188209993 XNQOUCQKUQZPFF-WBMJQRKESA-N 276.380 2.028 10 10 CECE C[C@@]1(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)CCCOC1 2069762798 WAGKBICQFWNBLA-CMPLNLGQSA-N 252.318 2.104 10 10 CECE C[C@H](C(=O)O)[C@H](C)N(C)[C@H](C)c1ccccc1O 2072461881 PPHJOPHEGQNYTP-GARJFASQSA-N 251.326 2.494 10 10 CECE CCN(c1c(F)cc([C@H](C)N)cc1F)C1COC1 2074208870 QIZSNMQCNSQFAK-QMMMGPOBSA-N 256.296 2.210 10 10 CECE C[C@@]12CCCC[C@@H]1CN2C(=O)c1cc(O)c(O)c(O)c1 2188868269 OEGZWEYUMQZHLR-MEBBXXQBSA-N 277.320 2.208 10 10 CECE CCCS[C@@H]1CCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2188874781 KVQOTIMXGOALRG-SNVBAGLBSA-N 297.376 2.161 10 10 CECE CCNCc1ccc(N2[C@@H]3COC[C@H]2C3)cc1Cl 2077880320 IKESYGRMNHGATR-BETUJISGSA-N 266.772 2.427 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H]2CC[C@@H]2[C@@H]1C(=O)O 2100855158 JJSSPKTZEIMQTC-IUCKATPISA-N 261.321 2.248 10 10 CECE C[C@@H](N)c1cnc(Sc2nnnn2C2CCCC2)s1 2103566632 YUMSXIRBOFFONU-SSDOTTSWSA-N 296.425 2.416 10 10 CECE COc1cc(N2CCC[C@H]2[C@H](C)F)ccc1CN 2084012147 LWECSNIBIBRDQE-GWCFXTLKSA-N 252.333 2.481 10 10 CECE CC1(C)[C@@H](N)C[C@H]1NCc1ccc2c(c1)CCCO2 2104271811 OSXSVAZPGOYECN-LSDHHAIUSA-N 260.381 2.227 10 10 CECE CO[C@H]1CC[C@H]1CCNCc1ccc(F)cc1O 2084176203 LKNIYURKZXTLRR-HZMBPMFUSA-N 253.317 2.436 10 10 CECE CN(C)[C@@H]1CN(Cc2cc(F)ccc2O)C(C)(C)C1 2105427022 AATZWOCNOFKCNU-ZDUSSCGKSA-N 266.360 2.446 10 10 CECE CCCOc1ccc(N2C[C@@H](OC)C[C@H]2CN)cc1 2106378807 WVLBGCJODLKMNZ-ZFWWWQNUSA-N 264.369 2.028 10 10 CECE C[C@@H]1CNC[C@@H](C)N(c2ccc3c(c2)CCCO3)C1 2106349829 FPCCJVWTCKBMSY-CHWSQXEVSA-N 260.381 2.446 10 10 CECE CN1CCc2cc([C@@](C)(O)CNC(C)(C)C)ccc21 2106790099 FHMXKQZCJPWMGV-INIZCTEOSA-N 262.397 2.275 10 10 CECE CCN(CC)c1ccc([C@]2(N)C[C@@H]3OCC[C@@H]32)cc1 2106827543 DSRYPJMTYBMKKR-HRCADAONSA-N 260.381 2.496 10 10 CECE C[C@@]1([C@@H](O)c2ccc(N3CCCC3)cc2)CCNC1 2106832387 ZUOOCORJPAHYDP-JKSUJKDBSA-N 260.381 2.320 10 10 CECE Cc1coc([C@@H](O)[C@H](N)c2ccc(N(C)C)cc2)c1 2106852195 CDVOXUGPLNMUJS-HUUCEWRRSA-N 260.337 2.387 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H](O)CC1CC1 2106940979 KUOHFZALEOEBBS-JKSUJKDBSA-N 260.381 2.448 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)cc1 2107285340 YAXTYZOTKLRURU-WXYCVUISSA-N 261.365 2.337 10 10 CECE CN1CCc2cc([C@@H]3NCC4(CCC4)CO3)ccc21 2088278859 OLNXBXGSQLXTQH-OAHLLOKOSA-N 258.365 2.468 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](CO)[C@H](C)C2)c(F)c1 2109027000 GIYNUHNRSKKTSQ-NTZNESFSSA-N 267.344 2.334 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@]2(C)C[C@]2(C(=O)O)C1 2109192054 RFBHSPYMFORXRH-VCTAVGKDSA-N 261.321 2.250 10 10 CECE CN1CCc2cc([C@H]3N[C@H](CC4CC4)CO3)ccc21 2090430013 JXBGAISUOHCDIY-ZBFHGGJFSA-N 258.365 2.466 10 10 CECE Cc1cc(CO)ccc1N1CC[C@@H](O)C(F)(F)CC1 2093624636 OYKULGJYKJDZMK-CYBMUJFWSA-N 271.307 2.084 10 10 CECE CC1(C)[C@@H](CO)CCN1CCCc1ccc(N)cc1 2095204120 GCEHRBFXYAPDPG-CQSZACIVSA-N 262.397 2.294 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H](F)C[C@@H]1C(=O)O 2095597233 SCCQYRFCTIUMRI-BCMRRPTOSA-N 271.263 2.089 10 10 CECE CC(C)(C)SC1CN(C(=O)c2ccc(O)c(O)c2)C1 2097624105 OKLMAVFAJBSUHV-UHFFFAOYSA-N 281.377 2.454 10 10 CECE C[C@@H](NC[C@@]1(C)CCCN1C)c1ccc(O)cc1O 2098720705 FVENKUNNHRPSQS-IAQYHMDHSA-N 264.369 2.233 10 10 CECE CN(C[C@@]1(C)CCCN1C)c1ccc(CN)c(F)c1 2098745890 VKFXQXCYVJZYFX-OAHLLOKOSA-N 265.376 2.205 10 10 CECE CCN[C@H](c1ccccc1O)[C@@](C)(O)c1cncs1 2099546862 VRSYGPRANXGZHZ-KGLIPLIRSA-N 278.377 2.407 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@@H]2CCNC[C@@H]2C1 2112464424 HTSJXZHEGSCGII-GRYCIOLGSA-N 264.344 2.134 10 10 CECE Nc1ccc(CCN2CCCO[C@H]3CCC[C@@H]32)cc1 2113809480 RJEHKVLSRWEPRY-HOTGVXAUSA-N 260.381 2.455 10 10 CECE CNCc1ccc(N2CCOCC3(CC3)C2)c(C)c1 2114592452 FCSYACLIWSMXQW-UHFFFAOYSA-N 260.381 2.331 10 10 CECE CCNCc1ccc(N2CCOCC2(C)C)cc1OC 2204546719 COFHIAHMDXRDMR-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1cc(N(C)C[C@@H]2C[C@@H]3C[C@H]3CO2)ccc1CN 2204542379 ZOSAVLAWIDHNQK-YDHLFZDLSA-N 276.380 2.015 10 10 CECE COc1cc(N2CC[C@@H](COC(C)C)C2)ccc1CN 2204558250 AABILMSBHMVXSB-CYBMUJFWSA-N 278.396 2.405 10 10 CECE COC[C@@H]1CC[C@@H](C(=O)NCc2cccc(C)c2O)C1 2204611578 WTIUDYLQVHPCRC-CHWSQXEVSA-N 277.364 2.380 10 10 CECE CNC1(C(=O)NCc2cccc(C)c2O)CCCCC1 2204612181 VERNREYLLIZGAL-UHFFFAOYSA-N 276.380 2.239 10 10 CECE Cc1ccc(CN[C@@H]2CCc3cn(C)nc3C2)c(O)c1 2204636152 WVPDZHJYIRHQPI-CQSZACIVSA-N 271.364 2.081 10 10 CECE COCC12CC(CN3CCC[C@@H](CN=[N+]=[N-])C3)(CO1)C2 2206034106 BFEONNLZGLBUGS-HSBZDZAISA-N 280.372 2.204 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)[C@]23CCC[C@]2(C3)C1=O 2207207709 FAFCWUKDDJFPIM-GTTSAUCSSA-N 271.316 2.382 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)C[C@H](C)F 2216995559 QWKQZPIFOSUMAY-VIFPVBQESA-N 261.318 2.109 10 10 CECE COCC1CC(O[C@H](C)C(=O)Nc2ccc(N)cc2)C1 2207490395 VQYFFMVUDNKGIO-CDWSIMAYSA-N 278.352 2.037 10 10 CECE CC[C@](CO)(CN(C)c1ccc(OC)cc1)NC(C)C 2207684772 OLZQLQIZABGPQV-MRXNPFEDSA-N 280.412 2.271 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@H]1[C@H]2[C@H]3[C@H]2C[C@@H]2[C@H]3[C@H]12 2208378882 XANSTIAHILSSPG-DAKLQIJESA-N 276.330 2.370 10 10 CECE CSc1ncc(CNC[C@@H]2COC(C)(C)CO2)s1 2208572359 JIWDEAVAYFPVJR-SECBINFHSA-N 288.438 2.149 10 10 CECE CON(C)CCCN[C@@H](C)c1ccc(C)cc1O 2218695873 KPNKXSYDUVXBFN-LBPRGKRZSA-N 252.358 2.235 10 10 CECE CN(Cc1ccc(N)cc1)C[C@@H](F)[C@H]1CCOC1 2222363673 JTFLRSNYGOZESL-GXTWGEPZSA-N 252.333 2.075 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)CCO)c(C)c1 2223924436 VGNVUSOANMULDB-ZDUSSCGKSA-N 250.386 2.484 10 10 CECE O[C@H]1CN(c2ccc3c(c2)OCCCO3)C[C@H]1C1CC1 2235120052 BWBSZYZPAQYGEF-KBPBESRZSA-N 275.348 2.055 10 10 CECE COc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]32)cc1OC 2235123594 BCUMANUAXNKYAG-KWCYVHTRSA-N 277.364 2.444 10 10 CECE COc1ccc(N2C[C@@H]3CSC[C@H]3C2)c(C[C@@H](C)N)c1 2235977176 NTDHQTVPUUGSCZ-MRVWCRGKSA-N 292.448 2.384 10 10 CECE COc1ccc(N2[C@H]3CCC[C@H](O)[C@H]2CC3)c(CO)c1 2236003063 PMOUWVMXNCSOOF-MAZHCROVSA-N 277.364 2.070 10 10 CECE CCc1nccnc1CN[C@@H](C)c1cc(O)ccc1O 2236660726 MMKZBCPVMXFKFM-JTQLQIEISA-N 273.336 2.301 10 10 CECE CNCc1ccc(N2C[C@H](C)C[C@H](O)[C@H]2C)cc1C 2227616529 VANVXAZRYZARJM-KFNAQCHYSA-N 262.397 2.310 10 10 CECE COCC1CC(SCC(=O)Nc2ccc(N)cc2)C1 2229859023 ZZKWTYKTGDBHMT-UHFFFAOYSA-N 280.393 2.366 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H]2COCCO2)c(C)c1 2240766269 ZNYYUEAZGIARSD-ZFWWWQNUSA-N 278.396 2.127 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](F)[C@@H](CO)C2)c(C)c1 2240842961 YYXKXSNLDVNUTK-BPLDGKMQSA-N 280.387 2.432 10 10 CECE CSc1ncc(CNC[C@@]23CCC[C@@H]2NCC3)s1 2257122419 CDAHZLWWCUSTOP-AAEUAGOBSA-N 283.466 2.487 10 10 CECE C[C@@H](CF)N(C)CCCC(=O)Nc1ccc(N)cc1 2270203729 XBZAYHJMMIDHDO-NSHDSACASA-N 267.348 2.277 10 10 CECE C[C@@H]1C[C@@H]1C[C@@H](O)c1ccc(N2CCNCC2)cc1 2270556142 BTFZJQJVQLIPTF-XNRPHZJLSA-N 260.381 2.176 10 10 CECE CCO[C@@]1(CN(C)c2ccc(OC)cc2)CCOC1 2271596023 FDDSDYKTNDZUMI-OAHLLOKOSA-N 265.353 2.327 10 10 CECE FC(F)Oc1ccc(N2CCC3(CNC3)C2)cc1 2263917225 XOOJNDROJMAFSG-UHFFFAOYSA-N 254.280 2.088 10 10 CECE C[C@]1(CO)C=CCCN1c1ccc2c(c1)CC[C@@H]2O 2264380645 BVVBUSXSWYVHSO-JKSUJKDBSA-N 259.349 2.184 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)ccc1[C@H](C)N 2269655301 AHABXDCHAKOIPQ-DUPGQFARSA-N 260.381 2.364 10 10 CECE Cc1cc(N2CC3(CCCN3C)C2)ccc1[C@@H](C)O 2269695957 OCZGUXHPLUXZOK-CYBMUJFWSA-N 260.381 2.333 10 10 CECE CCCCN(CC(N)=O)c1ccc([C@@H](C)N)c(C)c1 2269665647 HVNBZXDKXQRYID-GFCCVEGCSA-N 263.385 2.107 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@@H]2C[C@@H]2C1(C)C 2284536097 HKBVZBIAMDDPNI-SUNKGSAMSA-N 273.380 2.326 10 10 CECE O=C(O)CC[C@H]1CN(Cc2cc(Cl)ccc2O)CCO1 2295058900 DRQDNFMTMZNPJR-LBPRGKRZSA-N 299.754 2.111 10 10 CECE Cc1cc(N(C)CCS(=O)(=O)C(C)C)ccc1[C@H](C)O 2285166015 IQAZMRRCCYUDHK-ZDUSSCGKSA-N 299.436 2.308 10 10 CECE Cc1cc(N2C[C@@H]3CCN(C)C[C@@H]3C2)ccc1[C@@H](C)O 2285163192 IVNNGPSCDRTYEM-QLFBSQMISA-N 274.408 2.436 10 10 CECE O=C(O)C[C@@H]1C[C@H]1CNCc1cc(Cl)ccc1O 2314314158 BQMCDRZUGHTCMF-IUCAKERBSA-N 269.728 2.246 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2C[C@H]3C=C[C@@H]2C3)cc1 2330998282 RDUDXXQJPLKVDX-GUTXKFCHSA-N 256.349 2.282 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H]2C(F)(F)C3)c(CO)c1 2333717987 FTDNGQFQTSCQGI-RNCFNFMXSA-N 269.291 2.421 10 10 CECE CC[C@@]1(C)[C@@H](O)CCN1c1ccc(CNC)cc1C 2336754762 XFVTVOKLGUFSLD-HOTGVXAUSA-N 262.397 2.454 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc2c(c1)CC[C@H]2O 2336808293 GNQNHHXBHDLLRA-BZUAXINKSA-N 261.365 2.406 10 10 CECE COc1ccc(CNc2cnccc2OC)c(O)c1 119184824 YYRBNZSAUCCFND-UHFFFAOYSA-N 260.293 2.417 10 10 CECE C[C@@H]1C[C@H]1N(CCO)c1ccc(CN)c(C2CC2)c1 2339161501 SSVPENGPADQNEF-BDJLRTHQSA-N 260.381 2.230 10 10 CECE Oc1ccccc1CNCc1ccn(C(F)(F)F)n1 2340402212 GRADOCQEPKBXHF-UHFFFAOYSA-N 271.242 2.355 10 10 CECE Cc1c([C@H](C)N)ccc(N2CCS[C@@H](CO)C2)c1C 2340859763 NZFHCOCOECNZBM-QWHCGFSZSA-N 280.437 2.237 10 10 CECE CN(Cc1ccccc1O)[C@]1(C(=O)O)CCCSC1 2345450702 KKHXJZMIPTUYBN-CQSZACIVSA-N 281.377 2.174 10 10 CECE CSc1cc(N2CCC[C@@H]2C2(O)CC2)ccc1CN 2353858333 JBFKIIMTORFLOC-CQSZACIVSA-N 278.421 2.361 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CCN1[C@@H](C)c1cc(O)ccc1O 2353890800 MXKKXKYFOUUGRS-DCAQKATOSA-N 279.336 2.344 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCC[C@@H]2CC[C@@H]21 2354049420 JBNCJBHNCVRVSR-ZOWXZIJZSA-N 273.380 2.470 10 10 CECE CN(C[C@@H]1C[C@@H]2CC[C@H]1O2)c1c(F)cc(CO)cc1F 2355008948 AZBGHFLNZHGXBM-COPLHBTASA-N 283.318 2.461 10 10 CECE CCCN(CC(=O)NC)c1ccc(CNC2CC2)c(C)c1 50584177 YOZRENDZKQHZIP-UHFFFAOYSA-N 289.423 2.209 10 10 CECE CC(C)CN(C)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 118587517 HTYJJUAWLTYRIW-LBPRGKRZSA-N 267.760 2.384 10 10 CECE CNC(=O)[C@H]1CCCN1c1ccc(CNCC(C)C)cc1 62737510 BQROELVBKFBALA-MRXNPFEDSA-N 289.423 2.147 10 10 CECE COc1cccc(CNC(=O)Cc2ccccc2)c1O 171486763 UIEUNFKIRGQHOC-UHFFFAOYSA-N 271.316 2.260 10 10 CECE CC(=O)Nc1cccc(/N=N/N2CCC(=O)CC2)c1 1860486005 JPPAXYDSTMFESF-FOCLMDBBSA-N 260.297 2.309 10 10 CECE NCc1ccc(N2CCC(CO)CC2)c(Cl)c1 62792850 UFEIHEOZKKVMKZ-UHFFFAOYSA-N 254.761 2.007 10 10 CECE Cc1cc(O)c(O)cc1CCNC(=O)c1ccccc1O 170190374 RQQRBIVQMIKAMQ-UHFFFAOYSA-N 287.315 2.084 10 10 CECE CN(CC(F)(F)[C@@H]1CCOC1)c1ccc(CO)cc1 2128933953 NUNOGZHHUJXKDH-GFCCVEGCSA-N 271.307 2.287 10 10 CECE Oc1c(Cl)cc(Cl)cc1[C@H]1NCCC[C@@H]1O 1952614528 FGCHNRGLOVPJHX-VHSXEESVSA-N 262.136 2.484 10 10 CECE OC[C@H]1[C@@H]2C[C@H]1N(c1ccc(CNC3CC3)c(Cl)c1)C2 2358071216 OSQFPXPHDXAWRN-DIOULYMOSA-N 292.810 2.409 10 10 CECE Cc1cc(Br)c(C)c([C@@H]2COCCN2)c1O 219041052 GTKHUIYWQUTMLH-JTQLQIEISA-N 286.169 2.432 10 10 CECE Cc1ccc(O)c([C@@H](NCc2ccco2)C(=O)O)c1 211717553 DBLMOURGLSLUNQ-CYBMUJFWSA-N 261.277 2.209 10 10 CECE CS[C@@H]1CCC[C@@H]1NC(=O)c1cccc(O)c1O 229412811 HGKYLVOKKFNWEB-GXSJLCMTSA-N 267.350 2.112 10 10 CECE CN1CC[C@H](CNCc2c(O)cccc2Cl)C1 83552390 VNOCPVYJYDGVMT-SNVBAGLBSA-N 254.761 2.087 10 10 CECE CCN(CC)C(=O)CNCc1ccc2c(c1)CCCN2C 134535438 QFHMQQXIAJVSGR-UHFFFAOYSA-N 289.423 2.027 10 10 CECE COc1ccc(S(=O)(=O)CCCN=[N+]=[N-])cc1 42416498 YKNVHOSQRBMROM-UHFFFAOYSA-N 255.299 2.169 10 10 CECE 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Nc1ccc(O)c(CN2CC[C@]3(O)CCCC[C@H]3C2)c1 249907537 MUCPMSWDSJAHKB-XJKSGUPXSA-N 276.380 2.101 10 10 CECE COc1ccc([C@H](C)Nc2nccc(O)n2)c(O)c1 1877600167 SBKGUFJEMPABRT-QMMMGPOBSA-N 261.281 2.070 10 10 CECE Oc1cccc2c1[C@@H](Nn1nnc3c1CCCC3)CC2 2143843888 FKLNGXHUZQAPQP-LBPRGKRZSA-N 270.336 2.094 10 10 CECE C[C@@H](c1ccccc1O)N(C)[C@@H]1CCN2CC[C@H]1C2 1877840140 QFUGKSCLYIYILI-KCQAQPDRSA-N 260.381 2.479 10 10 CECE CNCc1ccc(N2CC(O)(c3cccs3)C2)cc1 1878933816 HCOSZGVJPIDCRP-UHFFFAOYSA-N 274.389 2.175 10 10 CECE CN[C@H]1CCc2cc(N3CCC[C@H]3[C@@H](C)O)ccc21 1879178484 CNRNVLGBLDKIKS-RLCCDNCMSA-N 260.381 2.243 10 10 CECE C[S@](=O)C[C@@H](NCc1cccc(F)c1O)C(C)(C)C 1964617814 HUPRCVOYSGMAKV-BLVKFPJESA-N 287.400 2.414 10 10 CECE CC1(C)CCN(Cc2ccccc2O)[C@@H](C(=O)O)C1 1964723338 LQPILXGUHOCXPY-GFCCVEGCSA-N 263.337 2.467 10 10 CECE CCOc1cccc(CNC[C@@H](C(C)C)N(C)C)c1O 20145637 OURAIQRRENLITE-AWEZNQCLSA-N 280.412 2.467 10 10 CECE COc1ccc(CNC23CCC(CC2)OC3)c(O)c1 1885137202 QOVIEVUTTXHURC-UHFFFAOYSA-N 263.337 2.202 10 10 CECE Nc1ccc(CNc2ccccc2-n2cncn2)cc1 2148942295 VXYLDMVRIVEOEI-UHFFFAOYSA-N 265.320 2.462 10 10 CECE Oc1ccc(Br)cc1CNC[C@@H]1[C@@H]2COC[C@@H]21 2006173793 ZFVMNHOUJWJHBM-ZSBIGDGJSA-N 298.180 2.137 10 10 CECE CONCc1c(C(F)(F)F)ccc(OC)c1O 258379133 NUPPCPPXAODGGS-UHFFFAOYSA-N 251.204 2.071 10 10 CECE COCC1=CCN(CCCc2ccc(N)cc2)CC1 167830333 QOVBKBOZZJZHCZ-UHFFFAOYSA-N 260.381 2.480 10 10 CECE Cc1cc(CCCC(=O)O)cc(CN(C)C)c1O 258765974 WGVCHDDFKQXOCZ-UHFFFAOYSA-N 251.326 2.170 10 10 CECE COc1cccc(CN[C@@H]2CCCC[C@H]2CCO)c1O 2146733375 DYPSWLSUXIYREP-GXTWGEPZSA-N 279.380 2.432 10 10 CECE COc1ccc2c(c1)[C@H](N)[C@@H]1CSCC[C@H]1N2C 259372414 QQBJXQHLKFJDFW-BNOWGMLFSA-N 264.394 2.267 10 10 CECE COC1(OC)CC(CN[C@H](C)c2ccc(O)cc2O)C1 2146903405 LTKSIKMNPLMFSY-SNVBAGLBSA-N 281.352 2.148 10 10 CECE CCOC(=O)CC[C@@H](N)c1c(F)cc(F)c(OC)c1O 260387551 WNTNRYOZCAHBAP-SECBINFHSA-N 289.278 2.022 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H](N)c3ccoc3)ccc21 2147425177 SBUDERLCIAPSTF-HOTGVXAUSA-N 272.348 2.395 10 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264.344 2.059 10 10 CECE CN(CCn1cc(Cl)cn1)c1ccc(CN)cc1 2027194788 ZVDLVSXROVDPHR-UHFFFAOYSA-N 264.760 2.132 10 10 CECE OCc1ccc(N2C[C@H](O)[C@H](C3CC3)C2)cc1Cl 2030216095 ABIJZCOLSJFBGR-JSGCOSHPSA-N 267.756 2.039 10 10 CECE Cc1cnc(CNCc2ccc3c(c2)CCO3)cn1 61320724 GPLVBAJHTFIOJS-UHFFFAOYSA-N 255.321 2.010 10 10 CECE COCCN1CC[C@H](N(C)[C@H](C)c2ccccc2O)C1 2160028095 BBKMSTBEDDBHIK-KGLIPLIRSA-N 278.396 2.106 10 10 CECE CNCc1cc(F)c(N2CCC[C@@H]2CN(C)C)c(F)c1 62719148 ALHINOPOIKENRL-GFCCVEGCSA-N 283.366 2.215 10 10 CECE CCCN(CCOCCOC)c1ccc(CN)cc1 70480553 AAOLFPVTAMIWIU-UHFFFAOYSA-N 266.385 2.025 10 10 CECE O=C(NCc1ccccc1O)c1cncc(Cl)c1 307952283 FHWUVCJUDARGPF-UHFFFAOYSA-N 262.696 2.371 10 10 CECE CC(C)c1cnn(CC(=O)Nc2ccc(N)cc2)c1 401994929 BFVFZJDTJDMOLX-UHFFFAOYSA-N 258.325 2.227 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H](CN)CC1CC1 404633366 XNZADSUTYWLNJN-DGCLKSJQSA-N 276.380 2.287 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@H]3C[C@H]2C[C@@H]3O)c(O)c1 2160695318 AKTPREQNTULAEG-VHKOSHJNSA-N 277.364 2.211 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2[C@H]3CCC(F)(F)[C@H]32)cc1 2170819162 LTZACOGMRZSXRV-IACUBPJLSA-N 280.318 2.361 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H]2CN(C)CC[C@@H]21 2170935075 DBPZPHBWMPWROD-AGIUHOORSA-N 276.380 2.185 10 10 CECE Oc1cc2c(cc1CNCC[C@H]1CC1(F)F)OCO2 701950899 LHGLLRBHTUFSKR-VIFPVBQESA-N 271.263 2.256 10 10 CECE C[C@@H]1C[C@@H](CN(C)CCOc2ccc(N)cc2)CCO1 2161682685 ITFCAAZIDNFXHH-KGLIPLIRSA-N 278.396 2.395 10 10 CECE Cc1cc(N2CCC[C@@H]3CN(C)CC[C@@H]32)ccc1CN 2171161570 WCWYEAXNQBRLBH-WBVHZDCISA-N 273.424 2.374 10 10 CECE CCCN(c1ccc([C@H](C)N)cc1)[C@@H]1CCCNC1=O 2171238985 WKGUELUIZWBWFK-SWLSCSKDSA-N 275.396 2.201 10 10 CECE CCCN(c1ccc([C@@H](C)O)cc1)[C@H]1CCCNC1=O 2171243656 XSMNMEMNMGJPTP-DOMZBBRYSA-N 276.380 2.235 10 10 CECE C[C@@H]1C[C@H](C(=O)O)N[C@@H](c2ccc3c(c2)CCN3C)C1 2176729925 PMUWUCBOLNBGMH-ZLKJLUDKSA-N 274.364 2.193 10 10 CECE CCN(C)C1CCN(Cc2c(O)cccc2OC)CC1 2171339224 XTAFXOJOSRQEGH-UHFFFAOYSA-N 278.396 2.317 10 10 CECE C[C@H]1CCCN(CCCOc2ccc(N)cc2)[C@H]1CO 688715885 BZJNOCGCJDHELV-BBRMVZONSA-N 278.396 2.131 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC[C@H]1[C@@H]1CCCN1 708494820 PYRTXNBRIJZOCB-KBPBESRZSA-N 282.334 2.387 10 10 CECE CCC1CC(O)([C@H](NC)c2ccc3c(c2)CCN3C)C1 2163140036 FHEGQJPBAATHKP-PTXATLKXSA-N 274.408 2.491 10 10 CECE CNCc1ccc(N(C)Cc2ccnn2C)c(C)c1 689526559 RPSACDKAZDBCLB-UHFFFAOYSA-N 258.369 2.084 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2cnn(C)n2)c(Cl)c1 2172424329 OCYWSFCLAKTKRN-SNVBAGLBSA-N 293.802 2.385 10 10 CECE CCNCc1ccc(N2CC[C@](C)(CO)C2)c(F)c1 381332352 BTDMSGQSNZVTJF-HNNXBMFYSA-N 266.360 2.144 10 10 CECE COCC1(CC(=O)N2CCC[C@@H]2CN=[N+]=[N-])CC1 692873199 OUYBOFBXJGSYSM-SNVBAGLBSA-N 252.318 2.104 10 10 CECE COCCOC(=O)N(Cc1ccc(N)cc1)C1CC1 381791363 CGGSAVMWEAVBKB-UHFFFAOYSA-N 264.325 2.016 10 10 CECE CN(C)[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(N)cc2)C1 715530846 FCKLOOSBFQAIBF-ZIAGYGMSSA-N 276.384 2.263 10 10 CECE CCCNCc1ccc(N2CC(O)(CC)C2)c(C#N)c1 384043522 KMHAZCYMKIQGEM-UHFFFAOYSA-N 273.380 2.019 10 10 CECE Oc1c(F)cccc1CN[C@H]1CC12CCOCC2 386902105 BMUJRYRNNNCHEE-LBPRGKRZSA-N 251.301 2.190 10 10 CECE CNCc1ccc(N2CC[C@H]3[C@@H]2CCCN3C)cc1 720435050 SMDWSXCYQBHAPI-HOTGVXAUSA-N 259.397 2.079 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCCN2C)C(C)(C)O 393984758 BOMDQGSDHDOPCT-GFCCVEGCSA-N 262.397 2.318 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)c1ccc(CN)c(F)c1F 724138983 FAUDOKMSMAUWIH-GXSJLCMTSA-N 256.296 2.037 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(N(C)C)C2)c(F)c1 394456282 NZRZKQDZCGYJLD-NSHDSACASA-N 265.376 2.246 10 10 CECE NCc1ccc(N2CC[C@H]3OCC[C@H]3C2)c(Cl)c1 724833025 JPLUMRDAPOAHBK-SMDDNHRTSA-N 266.772 2.414 10 10 CECE NCc1ccc(N2CCC[C@]3(CO)CCC[C@@H]23)c(F)c1 2165239940 KVFLLTMSQHHHAF-CVEARBPZSA-N 278.371 2.416 10 10 CECE CC[C@@H](N[C@@H]1CCNC(=O)CC1)c1ccccc1O 396718628 MCIHRNNPEGYVHY-WCQYABFASA-N 262.353 2.102 10 10 CECE CC(C)(C)[C@@]1(O)CCN(c2ccc(CN)c(F)c2F)C1 2177588734 SINOGULOHDAJRP-OAHLLOKOSA-N 284.350 2.411 10 10 CECE CN(Cc1ccco1)C(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2179616239 MWVZWTVZJJTSMD-NSHDSACASA-N 277.328 2.013 10 10 CECE CCN[C@@H](C)c1ccc(N2CCOC3(CC3)C2)cc1O 2168295548 HYVILJMOEWNNOC-LBPRGKRZSA-N 276.380 2.432 10 10 CECE CCNCc1ccc(N2CCN(C)[C@@H]3CC[C@@H]32)cc1C 2168361843 OQUOPPCGCLBYHJ-SJORKVTESA-N 273.424 2.387 10 10 CECE Cc1cc(O)c([C@H](C)n2cc(C(=O)O)c(O)n2)cc1C 2070722212 KTQCPILZNWPUHH-VIFPVBQESA-N 276.292 2.219 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H](OCCO)C2)c(Cl)c1 2170216116 MZCFTQCNOYVCRQ-AAEUAGOBSA-N 299.798 2.371 10 10 CECE C[C@H]1C[C@H](N(C)C(=O)Nc2ccc(N)cc2)CCN1C 2170390991 ACYTZWWVBAEAGF-SMDDNHRTSA-N 276.384 2.215 10 10 CECE CN(c1ccc(CN)cc1Cl)[C@H]1CO[C@@]2(CCOC2)C1 2179025024 AWHVCJDNFWYRPI-DOMZBBRYSA-N 296.798 2.183 10 10 CECE CN1CCCc2cc(CNC[C@@H]3[C@H]4CCO[C@@H]34)ccc21 2176454319 NDUHLAMFPJSKTO-BFYDXBDKSA-N 272.392 2.194 10 10 CECE C[C@H](NC(=O)[C@]1(C)CCCC[C@@H]1N)c1ccccc1O 2192621343 BHOOHMGBMDCJKM-HZUKXOBISA-N 276.380 2.477 10 10 CECE C[C@H](NC(=O)C[C@H]1CCNC1(C)C)c1ccccc1O 2192627227 KHTACVRSZDBEAJ-NWDGAFQWSA-N 276.380 2.348 10 10 CECE 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CC1(C)CCN(c2ccc3c(c2)CC[C@@H]3N)CC[S@@]1=O 2184740793 ZSMLBTDVOSGAOX-YWZLYKJASA-N 292.448 2.370 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H](C)CC[C@@H]3CO)ccc21 2184727103 NRJSPFIWRVIYRM-SRCQZFHVSA-N 274.408 2.491 10 10 CECE CCCN(Cc1c(O)cccc1F)[C@@H]1CCNC1 2042632652 JHOREOYABSICSJ-LLVKDONJSA-N 252.333 2.105 10 10 CECE CCOC(=O)[C@H](NC(C)C)c1c(C)cccc1O 2042604550 CZGHYEZRFWIRHA-CYBMUJFWSA-N 251.326 2.303 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H](C)[C@@](C)(CO)C2)c(F)c1 2194685692 AWYRNTMSEKJKPU-HFBDOXOYSA-N 284.350 2.439 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@@H]1C(F)(F)F 2100665099 XPSLFPVSMGTYFJ-MNOVXSKESA-N 272.270 2.426 10 10 CECE CNCc1ccc(N2C[C@@]3(C)CC[C@@]2(CO)C3)c(C)c1 2199511920 LMSKMTUDSSJLOB-IRXDYDNUSA-N 274.408 2.456 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)C1(O)CC(CF)C1 2118349140 LZSDICDDUUKBPY-XGTXGMFGSA-N 266.360 2.124 10 10 CECE Nc1ccc(OCCN2C[C@@H](F)C[C@H](F)C2)cc1 2062388883 RFTNJUOTJXGZNW-QWRGUYRKSA-N 256.296 2.030 10 10 CECE CC1(C)C[C@H](CO)CN1c1ccc(CO)cc1Cl 2064398462 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CC[C@@H]1C[C@@](N)(c2ccc3c(c2)CCN3CC)CO1 2106791113 OZURXOMABXQIPS-ZBFHGGJFSA-N 260.381 2.422 10 10 CECE CN1CCc2cc([C@H](N)c3cc(Cl)n(C)n3)ccc21 2106843980 NXIGVVTVQDWTSU-AWEZNQCLSA-N 276.771 2.114 10 10 CECE CCN1CCc2cc([C@H](NN)C3[C@H](C)[C@H]3C)ccc21 2106860347 BEHKGDCKPYCTBT-UVWXRNBGSA-N 259.397 2.475 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2CCNC3(CC3)C2)cc1 2106802069 SAJDKKDGVORNSX-HIFRSBDPSA-N 260.381 2.318 10 10 CECE N[C@@H]1CC[C@H]([C@@H](O)c2ccc(N3CCCC3)cc2)C1 2106834790 XLAQIFYRYVQORJ-LZWOXQAQSA-N 260.381 2.448 10 10 CECE COc1ccc(O)c(CNC2(CO)CC(C)(C)C2)c1 2107264811 BYDRRTBXHDQJRB-UHFFFAOYSA-N 265.353 2.042 10 10 CECE CO[C@H](C)Oc1ccc(N2CCC(N)CC2)c(C)c1 2087590216 KKWMNUMQPOBBFE-LBPRGKRZSA-N 264.369 2.294 10 10 CECE CN1CCCc2cc([C@H]3NC[C@@H](C4CC4)O3)ccc21 2088238654 ZEWUXFBZJADHFA-HOTGVXAUSA-N 258.365 2.466 10 10 CECE CN(c1ccc(CO)cc1F)C1(CO)CC(C)(C)C1 2108306629 NLFYDPZPFDUQNE-UHFFFAOYSA-N 267.344 2.305 10 10 CECE CN(CCCC(F)F)c1ccc2c(c1)NC(=O)[C@@H]2N 2110269067 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2.154 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1cncc(Cl)n1 2218741915 PBXMGYHVBSVXKM-BQBZGAKWSA-N 266.692 2.091 10 10 CECE OC1(C(F)F)CN(c2ccc(OC3CC3)cc2)C1 2219590443 SXZGRIUPGKYXRY-UHFFFAOYSA-N 255.264 2.044 10 10 CECE COc1ccc(N2CC[C@H](O)C3(CC3)C2)cc1F 2219611379 AQGDQQHSKTURIA-ZDUSSCGKSA-N 251.301 2.186 10 10 CECE C[C@@H](N)c1ccc(N2CC(F)(F)C[C@H]2CO)c(F)c1 2271890717 ALYPNLILOSWQPV-SCZZXKLOSA-N 274.286 2.052 10 10 CECE CO[C@]12CC[C@@H]1CN(c1ccc(CN)c(F)c1F)C2 2230482640 NJXASGZCRROPTB-YGRLFVJLSA-N 268.307 2.039 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@@H](CO)C12CC2 2232096033 MEAITALYFIJTRE-JSGCOSHPSA-N 260.381 2.366 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)Cc1cn(C)cn1 2232098649 QDOUWIJTTKHUGT-LBPRGKRZSA-N 258.369 2.385 10 10 CECE C[C@H](C(=O)O)[C@@H](C)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2234173432 XVYNFABHVYOGEW-OUAUKWLOSA-N 282.344 2.282 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]3C2)c(F)c1 2224588238 MAUMYHLAOMCHSX-LIBKGXAOSA-N 265.328 2.086 10 10 CECE 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CSc1ncc(CNCC23CCC(CC2)NC3)s1 2257131943 OMFXANMQRPFQOF-UHFFFAOYSA-N 283.466 2.487 10 10 CECE COc1cc(OC)c(N2C[C@H](N)C[C@@H]2C)cc1Cl 2258078977 MOAACYNFRUHHMU-DTWKUNHWSA-N 270.760 2.283 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](O)[C@@H]2C)c(F)c1 2260444357 QJPQSFZWQJKMRI-BHDSKKPTSA-N 252.333 2.066 10 10 CECE CN(Cc1ccc(N2CCNCC2)cc1)C(C)(C)C 2270550388 AVOMVQGBFNYADY-UHFFFAOYSA-N 261.413 2.327 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H]3O)cc1Cl 2270732941 XSOPANSURCCWID-ZVXAKGHKSA-N 280.799 2.437 10 10 CECE C[C@H](NC(=O)C[C@@H](C)C(C)(C)N)c1ccccc1O 2271230250 HYWYOCZGUKKMFJ-MNOVXSKESA-N 264.369 2.333 10 10 CECE CN(C)c1ccc([C@H](N)c2nccn2C(F)F)cc1 2265325443 OVDFVSVZQCUGEV-NSHDSACASA-N 266.295 2.392 10 10 CECE COc1ccc(N2CCN[C@@H]3CC[C@@H]32)c2c1CCC2 2269171730 PMMIRUYSRQKPIH-HIFRSBDPSA-N 258.365 2.125 10 10 CECE COC[C@]1(C)C[C@H]1CNCc1c(O)cccc1OC 2269304673 ZJNCXVGNZMVUSE-NHYWBVRUSA-N 265.353 2.163 10 10 CECE N=C1C(=Cc2c[nH]c3ccccc23)C(=O)N=C2SC=NN12 2293332633 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Cc1cccc(CNC(=O)[C@](C)(N)CC(C)C)c1O 2270007926 HDEINFOWXBJQMM-OAHLLOKOSA-N 264.369 2.080 10 10 CECE COc1ccc(O)c(CNC[C@@]23CCC[C@]2(CO)C3)c1 2208165305 RRNPDSUNWYFPKR-JKSUJKDBSA-N 277.364 2.043 10 10 CECE CC(C)=C(C)[C@H](O)c1ccc(N2CCNCC2)cc1 2270551449 VEFDCORDZAVDND-INIZCTEOSA-N 260.381 2.486 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@H]1C[C@@]12CC2(F)F 2218743191 UHFCRJOVZWUXBL-IBCQBUCCSA-N 256.256 2.379 10 10 CECE COc1ccc(N2CC[C@H](NC(C)C)C2)c(F)c1 2220321179 IMVQNFRDACEQNW-NSHDSACASA-N 252.333 2.411 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CC[C@@H]2[C@@H]1C2(F)F 2230368081 MBFUXCDFZQXARY-MGAJPHDKSA-N 269.291 2.059 10 10 CECE Oc1ccnc(Sc2ncc(CNC3CCC3)s2)n1 2231446820 SDYSBUCHJQPRQH-UHFFFAOYSA-N 294.405 2.432 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[C@@H](CO)C12CC2 2232093940 MPHMJOKLLXWSMC-JSGCOSHPSA-N 261.365 2.400 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@@H]1OC[C@@H]2CCC[C@H]21 2233279728 YUCCBDJBLKRQEZ-PEYYIBSZSA-N 276.380 2.221 10 10 CECE COc1ccc(N2CCC(CCCO)CC2)c(C=O)c1 2235978013 AODLDNXOHIIBHA-UHFFFAOYSA-N 277.364 2.497 10 10 CECE CCNCc1cc(OC)ccc1N1CC[C@]2(CCO2)C1 2235961893 DUHMGVLKRTUFEF-INIZCTEOSA-N 276.380 2.174 10 10 CECE CCC[C@H]1COC[C@@H]1N(C)c1ccc(OC)cc1CN 2235960868 DQUFXCGQJYISPP-LRDDRELGSA-N 278.396 2.405 10 10 CECE CCC[C@H]1CN(c2ccc(OC)cc2CO)C[C@@H]1CO 2235965543 FVMCZCXXFZEXMZ-GXTWGEPZSA-N 279.380 2.032 10 10 CECE CCCOc1ccc(N2CC[C@](O)(COC)C2)cc1 2226769553 LRHBONNYMGSAEA-OAHLLOKOSA-N 265.353 2.063 10 10 CECE CCOc1ccc(N2C[C@H](C)O[C@H](CCO)C2)cc1 2226748251 XBVGYHWOXLMKNU-SWLSCSKDSA-N 265.353 2.061 10 10 CECE COc1ccc(N2CC[C@H](C)[C@](C)(O)C2)cc1OC 2226803782 DUSLVPGNQXAHAY-XHDPSFHLSA-N 265.353 2.301 10 10 CECE CCCN[C@H](c1ccccc1O)[C@H](O)[C@H]1CC1(F)F 2227024211 GVGTXJVNMWOSCS-RAIGVLPGSA-N 271.307 2.449 10 10 CECE CN(C)c1ccc(OCc2cccnc2C(N)=S)cc1 2237693409 HFXJZSFSRZOBOD-UHFFFAOYSA-N 287.388 2.361 10 10 CECE COc1ccc(N2C[C@H]3C(C(F)F)[C@@H]3C2)c(CO)c1 2227710915 KETBCOLZRZMKNJ-GHMZBOCLSA-N 269.291 2.135 10 10 CECE C[C@H]1C[C@H]1CCN1CCN(c2ccc(N)cc2)CC1 2228210871 XCDRXFINPMVRKJ-UONOGXRCSA-N 259.397 2.437 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)CCN1CCCC1=O 2240841370 GFCOYRURAWUSLD-ZDUSSCGKSA-N 276.380 2.107 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCCC[C@H]1CC(N)=O 2240832191 ZVNKTIQKXOHZSY-OCCSQVGLSA-N 276.380 2.283 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C(N(C)C)[C@@H]3C2)cc1C 2285132026 AQFAYUJZNIMQGP-DAXOMENPSA-N 273.424 2.272 10 10 CECE COc1cc(OC)c(N2CC(C)(CO)C2)cc1Cl 2258060481 TYPIRLBHNQRKOH-UHFFFAOYSA-N 271.744 2.176 10 10 CECE COc1ccc(CNCCCCCN(C)C)c(O)c1 2273134698 KXYKXXOBMGTKAD-UHFFFAOYSA-N 266.385 2.222 10 10 CECE O[C@H]1C[C@@H](F)CN(c2ccc(OC(F)F)cc2)C1 2263852001 ZAUIQRZMLRDWOO-SCZZXKLOSA-N 261.243 2.197 10 10 CECE O[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ccc(OCF)cc1 2263853135 LYFKYGSNZFJKLA-ITGUQSILSA-N 251.301 2.485 10 10 CECE C[C@@H](O)c1ccc(N2CCC=C[C@@]2(C)CO)c(F)c1 2264386237 CJENPUDIOWSEGR-ABAIWWIYSA-N 265.328 2.396 10 10 CECE COc1ccc(N2C[C@H](O)C[C@@H]3CCCC[C@H]32)c(N)c1 2279550139 AMFQPBHREAUUIP-YWPYICTPSA-N 276.380 2.407 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](O)C(C)(C)C2)cc1C 2269669575 MXQMBUSBWCJWPL-SWLSCSKDSA-N 262.397 2.483 10 10 CECE Cc1cc(N2CCS[C@@H](CCO)C2)ccc1[C@@H](C)O 2269678735 LUERZXMIZFSXCT-OCCSQVGLSA-N 281.421 2.353 10 10 CECE COC[C@@]1(C)C[C@@H]1CN(C)C(=O)Nc1ccc(N)cc1 2284689126 GJNXPRJODVOSBP-IAQYHMDHSA-N 277.368 2.405 10 10 CECE Cc1cc(N(C)[C@H]2CS(=O)(=O)C2(C)C)ccc1[C@@H](C)O 2285168326 PTTAYJCWQMLLHM-RISCZKNCSA-N 297.420 2.060 10 10 CECE Cc1cc(N(C)CC(C)(C)S(C)(=O)=O)ccc1[C@@H](C)O 2285171967 ZRYQRHSMZZTSPM-GFCCVEGCSA-N 299.436 2.308 10 10 CECE CCCN1N=C(C)C(=Cc2ccc(O)c([N+](=O)[O-])c2)C1=O 2332144738 KAXHEULSAUXHIW-UHFFFAOYSA-N 289.291 2.312 10 10 CECE Nc1ccc(CC[C@@H](O)C[C@@H]2[C@@H]3CCOC[C@@H]32)cc1 2331284486 ZOPKQDHRSUQLBU-QXSJWSMHSA-N 261.365 2.235 10 10 CECE CN(CCC[C@@H]1C[C@@H]1C(=O)O)Cc1ccccc1O 2337482464 IEDBEYVAZVAXFT-YPMHNXCESA-N 263.337 2.325 10 10 CECE CCN(CCN=[N+]=[N-])CC(=O)NC1CCC(C)CC1 2337778402 WEESRGPBUKALFE-UHFFFAOYSA-N 267.377 2.314 10 10 CECE Cc1c([C@@H](C)N)ccc(N(C)[C@H](C)CC(N)=O)c1C 2340859712 NKTCZJDMFHGWBL-BXKDBHETSA-N 263.385 2.023 10 10 CECE COc1ccc(N(C)C[C@]2(O)C[C@@H]2C(F)(F)F)cc1 2344290875 PHLDRJKFIAYMRK-NWDGAFQWSA-N 275.270 2.445 10 10 CECE CS[C@H]1C[C@@H](OCC(=O)N(C)c2ccc(N)cc2)C1 2353306238 QNSMDECQTHDFJS-BETUJISGSA-N 280.393 2.142 10 10 CECE CSc1cc(N2CC[C@@H]3[C@@H]2C[C@@]3(C)O)ccc1CN 2353848952 OPXOSEIXMRVWNV-VNHYZAJKSA-N 278.421 2.217 10 10 CECE CSc1cc(N(C)C[C@@H]2CCCN2C)ccc1CN 2353858496 LPJYOOKLXDQUSZ-AWEZNQCLSA-N 279.453 2.398 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H](C)C[C@H](O)C3)ccc21 2356171879 BHVYCOFVLUGOQB-NUTKFTJISA-N 274.408 2.491 10 10 CECE CN(Cc1nnc[nH]1)Cc1c(O)ccc2ccccc12 179792264 UFCLJQRKMQGWRA-UHFFFAOYSA-N 268.320 2.296 10 10 CECE C[C@@H](NCCc1nccs1)c1cc(O)ccc1O 63133372 BFQANZPAOCXCHS-SECBINFHSA-N 264.350 2.448 10 10 CECE C[C@H]1CN(c2cc3c(cc2N)NC(=O)CC3)CCS1 137090126 YVXJLXSNDDKNQZ-VIFPVBQESA-N 277.393 2.095 10 10 CECE CCN([C@@H](C)c1ccc(F)cc1O)[C@@H]1CCNC1 71312359 WRVOCZHOMNGNDG-CMPLNLGQSA-N 252.333 2.276 10 10 CECE Cc1cc(C)n(CCCc2ccc(N)cc2)c(=O)n1 122685545 YQUVQEXYNPJUFJ-UHFFFAOYSA-N 257.337 2.075 10 10 CECE CC(C)C[C@H](C)NS(=O)(=O)Cc1ccc(N)cc1 37264515 OYRUIFDUAHYTHU-NSHDSACASA-N 270.398 2.123 10 10 CECE CN(C)c1ncccc1NCc1cc2c(cc1O)OCO2 42879936 XXCXBEUGQFMZPC-UHFFFAOYSA-N 287.319 2.194 10 10 CECE CN1CCC[C@H]1CNCc1cc(Cl)ccc1O 227440242 JICOKJDODZEUND-LBPRGKRZSA-N 254.761 2.229 10 10 CECE CCOCCCOC(=O)c1ccn(-c2ccc(N)cc2)n1 87326209 SKIWFNBHOTZBBP-UHFFFAOYSA-N 289.335 2.038 10 10 CECE CC1(CNCc2cccc(Cl)c2O)OCCCO1 190839250 FBWCREYRHQSMSZ-UHFFFAOYSA-N 271.744 2.288 10 10 CECE Nc1ccc(OC[C@H](O)CN2CC[C@@H]3CCCC[C@@H]32)cc1 226608837 WHPBSWGJZGSVCS-LXZKKBNFSA-N 290.407 2.273 10 10 CECE Cc1cc(CN)ccc1N1C[C@@H]2CCC[C@H](C1)N2C 2131079522 RGBHHTZSLBYSFE-GASCZTMLSA-N 259.397 2.127 10 10 CECE COc1ccc(CN2CCOC3(CCC3)C2)c(O)c1 93640652 SRPUSYGSAJYGPW-UHFFFAOYSA-N 263.337 2.156 10 10 CECE CCCN1C[C@@H]2C[C@H]1CN2c1ccc(CO)cc1C 2131066568 HTBYGYIDMPBKLM-GJZGRUSLSA-N 260.381 2.160 10 10 CECE CCc1ccccc1[C@H](NCCCN=[N+]=[N-])C(N)=O 90260121 BNJBQOYQYOBNLZ-LBPRGKRZSA-N 261.329 2.065 10 10 CECE COCC(CCNCc1c(C)cccc1O)COC 2131002400 NQWMRWHZICOXRF-UHFFFAOYSA-N 267.369 2.089 10 10 CECE C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)[C@H](C)CO1 92017632 QXMGJPYRBVRPJK-HUUCEWRRSA-N 290.407 2.132 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc([C@H](C)NC)cc1 2131054911 ZCTQUTLNNXUGCO-VBNZEHGJSA-N 259.397 2.250 10 10 CECE O=C1CC[C@H](c2ccc(Br)cc2O)N1 238727420 SJUNHAPLSJBSGB-MRVPVSSYSA-N 256.099 2.106 10 10 CECE C[C@@H](N)c1ccc(N2CCCSCC2)cc1O 93670732 GVIJCUSZORNENA-SNVBAGLBSA-N 252.383 2.355 10 10 CECE CCNCc1ccc(N(CC)CC(=O)NCC)cc1C 50584076 DWLFYJRSKKNWCX-UHFFFAOYSA-N 277.412 2.067 10 10 CECE Cc1ccc([C@H](C)NC[C@H](O)[C@H]2CCCO2)c(O)c1C 527959831 ZIILHJPCHHQMQN-AEGPPILISA-N 279.380 2.200 10 10 CECE C[C@H](NCC[C@@H](C)[S@](C)=O)c1ccc(F)cc1O 252813865 SCTZHYHSXNTKEN-JJQCHNSYSA-N 273.373 2.339 10 10 CECE COC(=O)CCc1c(F)cc(O)c(O)c1Br 260715492 WRKHGUSOUOSRCZ-UHFFFAOYSA-N 293.088 2.105 10 10 CECE CCCN(Cc1ccccc1O)C(=O)Cc1ccnn1C 278682411 UHCUUWCWFSIIQR-UHFFFAOYSA-N 287.363 2.107 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C)[C@H]2CO)c(F)c1 299981251 TZJNISCCFOAOEH-GPCCPHFNSA-N 252.333 2.053 10 10 CECE COc1ccc(N2CCC[C@@H]2[C@H]2CCCN2)c(OC)c1 2162638830 XVOKYVXVQHIWSU-ZIAGYGMSSA-N 276.380 2.425 10 10 CECE CN[C@@H](c1ccc(N2CCCC2)cc1)c1ccnn1C 2163101091 XTXOASHOPZPTSO-INIZCTEOSA-N 270.380 2.329 10 10 CECE CN1CCCc2cc([C@](C)(N)c3ccncn3)ccc21 2163100917 WJCOEUDVQGYRKR-INIZCTEOSA-N 268.364 2.081 10 10 CECE C[C@H]1CNC[C@H](C)C1(O)c1ccc2c(c1)CCCN2C 2163102769 NQLZSFHSADQMFH-STQMWFEESA-N 274.408 2.132 10 10 CECE NN[C@@H](c1ccc(N2CCCCC2)cc1)[C@@H]1CCCO1 2163105091 HYAZARHCDKPGPM-HOTGVXAUSA-N 275.396 2.360 10 10 CECE Cc1cccnc1[C@H](O)[C@@H](N)c1ccc(N(C)C)cc1 2163131837 VLZSMMMQKCBZSS-GOEBONIOSA-N 271.364 2.189 10 10 CECE CCN1CCc2cc([C@H](N)[C@H](O)[C@H]3CC34CC4)ccc21 2163130426 HMAWXQBMVZCIQK-VNQPRFMTSA-N 272.392 2.230 10 10 CECE CCNCc1ccc(N2C[C@@]3(C)C[C@]3(CO)C2)cc1C 2165444708 VDDWZIDVKSFRRL-IAGOWNOFSA-N 274.408 2.313 10 10 CECE CCN1CCc2cc([C@H](N)[C@@]3(O)CCS[C@@H]3C)ccc21 2163137713 FYMVEIHMCSFJQM-XFBWCDHKSA-N 292.448 2.325 10 10 CECE C[C@@H]1CCO[C@@H]1[C@H](NN)c1ccc(N2CCCC2)cc1 2163148965 CVUSFVUMVJAQGT-WQVCFCJDSA-N 275.396 2.216 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@@H]2C[C@H]3OCC[C@@H]3O2)C1 2163198640 MOPUTZUSYOEPPM-XDQVBPFNSA-N 280.372 2.345 10 10 CECE CN1CCc2cc([C@H](N)c3nc(C4CC4)ns3)ccc21 2163452285 ACYGQWCYMIDWHQ-ZDUSSCGKSA-N 286.404 2.456 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](C)[C@H]2CO)cc1O 711566860 TWJLREFFAJTDDS-JTNHKYCSSA-N 264.369 2.009 10 10 CECE CC[C@H](NC)c1ccc(N2CCS[C@H](CO)C2)cc1 720038623 LLRAVKQGNRDBBA-GJZGRUSLSA-N 280.437 2.271 10 10 CECE CN(C)c1ccc(CNC(=O)NCCCCF)cc1F 812926376 DYUPVHLANXQGGT-UHFFFAOYSA-N 285.338 2.441 10 10 CECE CCc1cc([C@H](O)C(=O)O)c2c(O)csc2c1 725301392 DTBRKBWCLPAHEL-NSHDSACASA-N 252.291 2.287 10 10 CECE C[C@H](c1noc(-c2cccc(O)c2O)n1)[C@@H]1CCCO1 720276625 VCSHUNYQVMIURJ-KWQFWETISA-N 276.292 2.430 10 10 CECE COC(=O)N(C)CCNCc1cc(Cl)cc(C)c1O 827370706 IXGYLECHEJLBGS-UHFFFAOYSA-N 286.759 2.142 10 10 CECE COc1cc(O)c(CN2CC[C@@H]2C2CC2)cc1OC 824650770 QOWJHZOKWPPYDI-GFCCVEGCSA-N 263.337 2.394 10 10 CECE COc1ccc(O)c(CN2CCO[C@](C)(C3CC3)C2)c1 826878083 SJRBBXGSTJWNTH-INIZCTEOSA-N 277.364 2.402 10 10 CECE CN(C)c1ccc(CNC(=O)[C@@H]2CCO[C@H]2C2CC2)cc1 905318696 QVTBTRDGLCDORJ-CVEARBPZSA-N 288.391 2.184 10 10 CECE COc1ccc(N2CCCN(C(=O)CCF)CC2)cc1 900295203 ZAFJUYXIDXEEMD-UHFFFAOYSA-N 280.343 2.094 10 10 CECE Cc1cc(O)c(CN[C@@H]2CNCCC2(F)F)cc1C 841074575 DKLVPWJNHUFGKN-CYBMUJFWSA-N 270.323 2.096 10 10 CECE Cc1ccc(C(=O)N2CC[C@@]3(C2)CC3(F)F)c(O)c1O 846620089 IIVPWDDBZFCPPV-ZDUSSCGKSA-N 283.274 2.278 10 10 CECE Nc1ccc(CCNC(=O)NCC2(C3CC3)CC2)cc1 841862711 ALVRDRJJXORAJC-UHFFFAOYSA-N 273.380 2.301 10 10 CECE CCc1cccc(CN(C)CC(=O)NC(C)(C)C)c1O 848879736 ASZNAOVGOQPJTH-UHFFFAOYSA-N 278.396 2.301 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)NCC1CSC1 923814423 CDPLGCDUCAABNV-UHFFFAOYSA-N 293.436 2.257 10 10 CECE O=C(NCc1c(O)cccc1F)c1ocnc1C1CC1 928705229 FATGCWZQGASLEB-UHFFFAOYSA-N 276.267 2.327 10 10 CECE COC[C@H](CN1CCCCc2cc(OC)ccc21)OC 851884918 VOFJTFRBZAAFRF-HNNXBMFYSA-N 279.380 2.499 10 10 CECE CC[C@@H]1COC[C@H]1N[C@@H](C)c1cc(O)ccc1O 699524302 GMXNPNLYYJYVFP-OPQQBVKSSA-N 251.326 2.173 10 10 CECE COCCC1(C(=O)N2Cc3cccc(O)c3C2)CC1 871204248 WNIVSWDBPKDQHH-UHFFFAOYSA-N 261.321 2.051 10 10 CECE COc1ccc2c(c1)N[C@@](C)(C(C)C)CN2CCN 76931148 CDQLIDLCFUBVDB-OAHLLOKOSA-N 263.385 2.301 10 10 CECE Cc1ncccc1/C=C\C(=O)N(C)c1ccc([N+](=O)[O-])nc1 1128455049 ZDZSASSIWOUDDT-YVMONPNESA-N 298.302 2.369 10 10 CECE CC[C@H]1CN(CC)[C@H](c2cccc(OC)c2O)CN1 83479584 IAVURNLHNOGNIV-AAEUAGOBSA-N 264.369 2.146 10 10 CECE Cc1cc(NCc2ccc(N3CCCNCC3)cc2)no1 84847205 OYMYMUZFMAFMSB-UHFFFAOYSA-N 286.379 2.395 10 10 CECE CCCNCc1ccc(N2CCOC[C@@H](O)C2)cc1Cl 399971306 YAOUZLKUXSMOCQ-AWEZNQCLSA-N 298.814 2.037 10 10 CECE COC(OC)[C@H](C)NCc1ccc(N2CCCC2)cc1 79607810 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CN(CCCOc1ccc(N)cc1)[C@]1(C)CCOC1 2119026004 RHYVHECLUPRGCW-OAHLLOKOSA-N 264.369 2.149 10 10 CECE CO[C@@H]1CN(Cc2c(O)cccc2F)CC(F)(F)C1 2128711107 SNVMAGRENOMZKV-VIFPVBQESA-N 275.270 2.387 10 10 CECE O=C(NC1C[C@H]2[C@H](C1)C2(F)F)c1cc(O)cs1 1329369214 KGCXMEIEEZOYIM-YUMQZZPRSA-N 259.277 2.227 10 10 CECE CC(C)(C)NCc1ccc(N2CC=C[C@H]2CO)cc1 2119815359 KBSYXENQALQNKB-HNNXBMFYSA-N 260.381 2.312 10 10 CECE COc1ccc(N(C)C[C@@H]2[C@@H]3CCCO[C@H]32)c(N)c1 2119935645 WWRMQJNBDJNSFO-YWPYICTPSA-N 262.353 2.139 10 10 CECE CCC[C@@H](CO)CN[C@@H](C)c1cc(OC)ccc1O 2120746956 DXLKZVAOLRXOKZ-NWDGAFQWSA-N 267.369 2.460 10 10 CECE O[C@@H]1CCCc2cc(N3C[C@H]4OCC[C@@H]4C3)ccc21 2128272493 HSAKFCAEABZPPU-DAXOMENPSA-N 259.349 2.281 10 10 CECE C[C@@H]1C[C@@H](CO)CCN1c1ccc2c(c1)CC[C@@H]2O 2128319110 ZQQXKCFGHAQUBU-WQGACYEGSA-N 261.365 2.263 10 10 CECE CO[C@H]1C[C@H]1NCc1ccc(C)c(Br)c1O 1905136913 GOVZEVRBZQWHBI-ZJUUUORDSA-N 286.169 2.340 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@@H]4COC[C@@H]43)ccc21 2129810408 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10 10 CECE C1=C(c2ccc(N3CCCC3)cc2)C[C@H]2COC[C@H]1N2 2285748546 ONXPONRCSAKKCO-HOTGVXAUSA-N 270.376 2.431 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC4(CC=CC4)C3)ccc21 2286984486 NUSRSGTXDQUXCB-AWEZNQCLSA-N 269.348 2.185 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1c(OC)cc(OC)cc1OC 2288892831 PNOSCXHIBVXHNY-VXGBXAGGSA-N 281.352 2.062 10 10 CECE CC[C@@H](NCc1cccc(OC)c1O)[C@@H](C)CN(C)C 2288839419 KILWNKROORRUCO-GXTWGEPZSA-N 280.412 2.467 10 10 CECE CN(Cc1ccccc1O)C(=O)C1CCCNCCC1 2289555001 UFUNXBIAIBFSHP-UHFFFAOYSA-N 276.380 2.130 10 10 CECE Cc1nnccc1CN(c1ccc(CN)cc1)C1CC1 2290095522 JOJHBFOPVBDTDT-UHFFFAOYSA-N 268.364 2.413 10 10 CECE CC=CC[C@@H](CO)NCc1cc(Cl)cc(OC)c1O 2309546477 XOATZADZMHVLLI-LBPRGKRZSA-N 285.771 2.471 10 10 CECE CSc1cc(N2CC[C@@H](C3OCCO3)C2)ccc1CN 2308069441 ATYVAYLRSYCXLY-GFCCVEGCSA-N 294.420 2.066 10 10 CECE Nc1ccc(O)c(CN2C[C@@H]3C[C@H]2C(F)(F)C3)c1 2308473927 VMHQSKKNAFRINC-PELKAZGASA-N 254.280 2.204 10 10 CECE N[C@H]1C[C@@H]2C[C@H](C1)N(Cc1cc(Cl)ccc1O)C2 2310964822 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2.276 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C[C@@H]1CCCCS1 718272146 XSOVHLKBWMSMHW-LBPRGKRZSA-N 295.404 2.498 10 10 CECE CN(C[C@H]1CCCS1)c1ccc([N+](=O)[O-])c(CO)c1 718357256 GTFPAKGZHKMTMT-GFCCVEGCSA-N 282.365 2.419 10 10 CECE C[C@@H](N[C@@H]1CC12CCOCC2)c1c(O)cccc1O 387265444 LOMJCIGKORRGGU-ZWNOBZJWSA-N 263.337 2.318 10 10 CECE CNCc1ccc(N(C)Cc2nccs2)c(C#N)c1 387500208 KLIWWWROCADAQX-UHFFFAOYSA-N 272.377 2.371 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@H](O)C(C)(C)C2)cc1O 388100396 RYIYWUMDVQCZEP-NHYWBVRUSA-N 278.396 2.270 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@H](CCO)C2)cc1Cl 2172871527 NDANRUQPKMCYNA-WCQYABFASA-N 298.814 2.208 10 10 CECE CO[C@H](CNCc1ccc2c(c1)CCN2C)C1CC1 394463223 WUOBNNKPDCZMAS-MRXNPFEDSA-N 260.381 2.194 10 10 CECE C[C@H](N)c1ccc(N2CC(F)(CO)C2)cc1C(F)(F)F 2172924729 MESHODLXTDUOGC-QMMMGPOBSA-N 292.276 2.246 10 10 CECE COc1ccc(CN2C[C@H](CN)[C@@H](C)C[C@@H]2C)c(O)c1 397411585 OYTAPAXJEAUUGB-OBJOEFQTSA-N 278.396 2.206 10 10 CECE C[C@H](NCc1cc(Cl)ccc1O)c1ncon1 397863456 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10 10 CECE C[C@H](O)[C@H]1CCN(c2ccc(CN)c(Cl)c2)C1 161573523 JRWLEAVYGWXGGR-ONGXEEELSA-N 254.761 2.006 10 10 CECE CC[C@](C)(COC)NC(=O)CCc1ccc(N)cc1 2131087128 SWJJIUSAHFKYKP-OAHLLOKOSA-N 264.369 2.133 10 10 CECE CC[C@H](C)N(CCO)c1ccc(CN)cc1Cl 383541097 UHYOPHWGXRKSJZ-JTQLQIEISA-N 256.777 2.396 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1ccccc1Cl 90260489 SFIUJMNSPUXLFR-GFCCVEGCSA-N 281.747 2.331 10 10 CECE COc1cccc(CS(=O)(=O)Nc2ccc(O)cc2)c1 243511159 NXXJIXANBRNVEW-UHFFFAOYSA-N 293.344 2.343 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H]1CCCNC1=O 50394485 INGWFJMLYFRJCK-UTUOFQBUSA-N 274.364 2.117 10 10 CECE C[C@@H]1Oc2ccc(N(C)C)cc2C(=O)[C@H]1n1ccnc1 248082350 VUBYBMGNWPWJHR-HZMBPMFUSA-N 271.320 2.154 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC[C@H]1CC(=O)O 251232664 BNZWNOXBGDRVQX-UWVGGRQHSA-N 265.309 2.098 10 10 CECE CC[C@H](NCCCN1CCOC1=O)c1ccccc1O 183312354 GCJUBBOFIQXXCT-ZDUSSCGKSA-N 278.352 2.275 10 10 CECE CNC(=O)c1nc[nH]c1N=Nc1ccc(OC)cc1OC 254482494 RJLGXJDDNYSOSE-UHFFFAOYSA-N 289.295 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CC(C)(CN1CCOCC1)NCc1ccc(Cl)cc1O 1652667752 OEZFOCPBYMEFPX-UHFFFAOYSA-N 298.814 2.246 10 10 CECE OCC[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128270332 DLYCILGCBJJZPV-MLGOLLRUSA-N 261.365 2.265 10 10 CECE CC[C@H](O)c1ccc(N2CCN(C)C3(CC3)C2)cc1 2131890399 UNUGGXWLHROJPT-HNNXBMFYSA-N 260.381 2.414 10 10 CECE Oc1ccc(CNC[C@@H]2CC3(CCCC3)O2)cc1O 2132944346 QPBONUUVPSFDGK-LBPRGKRZSA-N 263.337 2.289 10 10 CECE CN(C[C@@H]1CC12CCC2)C(=O)c1cccc(O)c1O 2133083306 QZUXRDBLAUQETH-JTQLQIEISA-N 261.321 2.360 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1Cl 1914287495 IZSQANPSBFYLDI-IGJMFERPSA-N 254.761 2.319 10 10 CECE C[C@@H]1C[C@@H](CN)CN1Cc1ccc2c(c1)CCCN2C 216033588 CAOZWNYKMIVRAS-HIFRSBDPSA-N 273.424 2.238 10 10 CECE C[C@@H]1CCC[C@H]1CS(=O)(=O)N1CC[C@H](N=[N+]=[N-])C1 1912143878 LPLFSUZKOFKCSY-VWYCJHECSA-N 272.374 2.137 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1ccc2n[nH]cc2c1 1912168928 YDALZXGNTHGDNI-UHFFFAOYSA-N 258.285 2.335 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)Cc2ccccc2O)C1 1912195183 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Cc1ncncc1NC(=O)c1ccc(N=NC(N)=O)cc1 1472628661 OWHBZILTQMYJKH-UHFFFAOYSA-N 284.279 2.200 10 10 CECE COc1ccc(N2CC[C@H](N)C(F)(F)C2)c(F)c1F 2136986501 WKWLPEGLXXRNMR-VIFPVBQESA-N 278.249 2.146 10 10 CECE Nc1ccc(CCCN2CC=CCC23COC3)cc1 2137003680 AXTOQDGDZXGLMZ-UHFFFAOYSA-N 258.365 2.232 10 10 CECE CC(C)(N)c1ccc(N2Cc3cncnc3C2)cc1 211682925 FCVANIXEUDHNSA-UHFFFAOYSA-N 254.337 2.191 10 10 CECE Nc1ccc(Cn2nnnc2-c2ccccc2F)cc1 213321971 LZRZSWDTLOELMZ-UHFFFAOYSA-N 269.283 2.110 10 10 CECE CC1(C2(NC(=O)Cc3ccc(O)c(O)c3)CC2)CC1 1627423728 YKRWOFFMIOLEGL-UHFFFAOYSA-N 261.321 2.089 10 10 CECE CC(C)(CNC(=O)Cc1ccc(O)c(O)c1)C1CC1 1558599784 ZFYLNJWAPUQCRO-UHFFFAOYSA-N 263.337 2.193 10 10 CECE COC(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1O 1556196717 WLYZWYTZJRBBDM-UHFFFAOYSA-N 293.300 2.198 10 10 CECE CN1CCc2cc(CNCC[C@H]3CCOC3)ccc21 230164636 MWHAUMJAHJEEJM-ZDUSSCGKSA-N 260.381 2.195 10 10 CECE Cn1cc([N+](=O)[O-])c(NCc2cccc(Cl)c2O)n1 1643298515 OVDHEIIFFJHHPC-UHFFFAOYSA-N 282.687 2.299 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@@H](O)[C@@H](C)C1 230636233 JHXFHBFBLYWXIC-SUMWQHHRSA-N 274.408 2.454 10 10 CECE C/C(=C\c1ccco1)C(=O)NCc1c(O)cccc1O 1647289821 JKMNCHYMPCARBT-CSKARUKUSA-N 273.288 2.411 10 10 CECE NC[C@]12CCC[C@H]1CCN2Cc1ccc(F)cc1O 2139772253 MHVPABXRDHEARL-SWLSCSKDSA-N 264.344 2.235 10 10 CECE Cc1cccc(CN[C@H]2CC[C@]23CCCNC3)c1O 2139757420 HWHVZDFHQLCMPG-HOCLYGCPSA-N 260.381 2.322 10 10 CECE Nc1ccc(CN2CCC(C3(O)CCC3)CC2)cc1 2140255176 YOYKTEKLYVYFCY-UHFFFAOYSA-N 260.381 2.396 10 10 CECE COc1cccc(O)c1CNC1(CCCO)CCC1 2140857193 XNTNMZIMOZIEMY-UHFFFAOYSA-N 265.353 2.186 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)COC(C)C 157959558 LSBVRMPREJWOBN-UHFFFAOYSA-N 264.369 2.432 10 10 CECE Nc1ccc(Cn2c(=O)cnc3ccccc32)cc1 19265128 XFOVUGQSRKJUJX-UHFFFAOYSA-N 251.289 2.027 10 10 CECE CC(C)[C@@H](CN)CN(C)c1ccc2c(c1)OCCO2 259048695 RWWBMAJCTZQLRG-LBPRGKRZSA-N 264.369 2.125 10 10 CECE CC(C)Oc1ccc(N2CCNC(=O)C2(C)C)cc1 259399945 XPWPYOGVQJNZKZ-UHFFFAOYSA-N 262.353 2.189 10 10 CECE Cn1ncc(Br)c1COCc1ccc(N)cc1 1940258802 NTTXSQVOUIBIHK-UHFFFAOYSA-N 296.168 2.482 10 10 CECE c1cn2c(n1)[C@@H](NCc1ccc3c(c1)CCCO3)CC2 922151879 VYLBALRDCILEMY-AWEZNQCLSA-N 269.348 2.443 10 10 CECE Cc1ccc(O)c(CNCCC(=O)N2CCC[C@H](C)C2)c1 1857864624 XWDLVLZWUKEJQE-AWEZNQCLSA-N 290.407 2.439 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC[C@H](O)[C@@H](F)C1 2144568149 ZQIQIWLMYRUTRJ-HOCLYGCPSA-N 280.387 2.402 10 10 CECE Oc1ccc(F)cc1CN(C[C@@H]1CCCNC1)C1CC1 236559331 SSWCDXFKKVSMRD-GFCCVEGCSA-N 278.371 2.495 10 10 CECE CNCc1ccc(N(C)C[C@H]2OCCO[C@H]2C)cc1Cl 2143694197 HZZPLWZBKCGNDF-XHDPSFHLSA-N 298.814 2.300 10 10 CECE Oc1c(F)cccc1CNC[C@H]1C[C@@H](O)C12CCC2 1875442366 KBOVQCKSESBSBI-DGCLKSJQSA-N 265.328 2.172 10 10 CECE Nc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](F)C3)cc1 1876881589 RTHSBQYNJNLGCF-UBSAEIQESA-N 262.328 2.303 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC3CC2(C(=O)O)C3)c1 1877381140 YIQRCYALVCFRPB-RWWNRMGGSA-N 261.321 2.311 10 10 CECE C[C@H](c1ccccc1O)N(C)c1nc(C(=O)O)ns1 1877523524 GONPSGRIGRNGRU-SSDOTTSWSA-N 279.321 2.139 10 10 CECE C[C@H](NC[C@H](C(=O)O)C(F)(F)F)c1ccccc1O 1877554133 KMCBYGNREOJKGA-IONNQARKSA-N 277.242 2.306 10 10 CECE CN(Cc1ccccc1O)C[C@H](C(N)=S)C(F)(F)F 1877526075 WKIGWBLOQMOBEO-SECBINFHSA-N 292.326 2.289 10 10 CECE Oc1cc2c(cc1CNC[C@H]1CC[C@@H](F)C1)OCO2 1964596198 GSYANFIGTNKHID-GXSJLCMTSA-N 267.300 2.349 10 10 CECE C[C@@H](NCC12CC(C1)[C@@H](C)O2)c1ccc(O)cc1O 1878454566 QBXNRRGTRCKZMA-DINFMJHZSA-N 263.337 2.316 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H]2CCCCNC2=O)c1 2144037457 SATYCHCESLJPQG-QWHCGFSZSA-N 276.380 2.268 10 10 CECE C[C@@H]1CN(c2c(F)cc([C@@H](C)O)cc2F)C[C@H]1CO 1880482258 NITDXBZVUMSDEO-KKZNHRDASA-N 271.307 2.083 10 10 CECE CN(CC1(CCF)CC1)C(=O)c1ccc(O)c(O)c1 1882458728 OLGOAHLLPVJFNZ-UHFFFAOYSA-N 267.300 2.310 10 10 CECE CC1(CNCc2c(O)cccc2F)CCOCC1 1964032208 HQZPVLMNVLMBLO-UHFFFAOYSA-N 253.317 2.438 10 10 CECE CC[C@H](CCOC)C(=O)N(C)c1ccc(N)cc1 1964403852 ZMXKUKSTZTVFPH-LLVKDONJSA-N 250.342 2.294 10 10 CECE CNCc1c(O)cccc1NC(=O)OC(C)(C)C 1951860749 MYACIOPDUPLDJE-UHFFFAOYSA-N 252.314 2.459 10 10 CECE CCON1CCC(N[C@H](C)c2ccccc2O)CC1 1967519561 BJPYYPCFPLFMRT-GFCCVEGCSA-N 264.369 2.459 10 10 CECE COc1cc(Cl)cc(CNC[C@H]2CC=CCO2)c1O 1967856228 RSWPPDSRPBNYME-GFCCVEGCSA-N 283.755 2.489 10 10 CECE COc1ccc(O)c(CNC[C@H]2CC3(CC3)CO2)c1 1967807472 HTBSMWQVWAQFHC-CYBMUJFWSA-N 263.337 2.060 10 10 CECE Cc1cccc(CNCCOC2(C)CCOCC2)c1O 1967830861 RRSBUWOEPXJTIH-UHFFFAOYSA-N 279.380 2.376 10 10 CECE COc1cccc(O)c1CNC[C@H]1OCCC1(C)C 1967841850 KDEWBEWPGSABMM-CQSZACIVSA-N 265.353 2.306 10 10 CECE CCOC(=O)CC1(NCc2cccc(C)c2O)CC1 1967916546 YBTKBNBNDWNZJT-UHFFFAOYSA-N 263.337 2.276 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]2C2CCOCC2)cc1O 2145737530 SELQSZNKRWTZIB-NHYWBVRUSA-N 276.380 2.417 10 10 CECE N[C@@H]1[C@H](Sc2nccs2)CCOC12CCC2 1976001035 MHFHBWMYKMPKEH-RKDXNWHRSA-N 256.396 2.274 10 10 CECE Cc1ccc([C@H](C)N[C@H](C)[C@H]2CCS(=O)(=O)C2)c(O)c1 2146117585 KJTHSUFCLRPYLE-AGIUHOORSA-N 297.420 2.174 10 10 CECE CCOc1cc(C)nc(NCCc2ccc(N)cc2)n1 169205651 FYOKSNJDINDDLN-UHFFFAOYSA-N 272.352 2.421 10 10 CECE CC(C)(NC(=O)c1ccc(O)c(O)c1)[C@H]1CCCCO1 2150550748 AMXPVJCNWLTFBC-CYBMUJFWSA-N 279.336 2.175 10 10 CECE Cc1cc(N2C[C@]34CC[C@]3(COC4)C2)ccc1CCN 2146560807 KGRBUVUWFISPSZ-CALCHBBNSA-N 272.392 2.113 10 10 CECE CN1CCN(c2ccc([C@H]3CCCCN3)cc2F)CC1 258652936 QHXQQSWPQPAHHN-OAHLLOKOSA-N 277.387 2.392 10 10 CECE [N-]=[N+]=NCCCN1CCC[C@@H](C(F)(F)F)C1=O 2004362193 AMDCMLUAVZGIHP-SSDOTTSWSA-N 250.224 2.488 10 10 CECE CCN(CC)C(=O)[C@H](C)N(CC)c1ccc(CN)cc1 34654455 UWENSFPMTODFAZ-ZDUSSCGKSA-N 277.412 2.229 10 10 CECE CC[C@H]1CCCN(CC(=O)Nc2ccc(N)cc2)C1 36168775 OUPAMWFFCGEPLP-LBPRGKRZSA-N 261.369 2.329 10 10 CECE CC(C)[C@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 160352903 HXQPVETYGUMTNH-IINYFYTJSA-N 259.353 2.121 10 10 CECE COC[C@H](C)Oc1ccc(N2CCCNCC2)c(C)c1 161702513 VMALHZIXLYVTSK-AWEZNQCLSA-N 278.396 2.208 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@H](O)c1ncc(C)[nH]1 2148161103 FINVBQJKZOIVSV-KBPBESRZSA-N 275.352 2.198 10 10 CECE CNCc1ccc(N2CC3(CCN(C)CC3)C2)c(F)c1 2152506329 UEOPWKUGTVRHLH-UHFFFAOYSA-N 277.387 2.077 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H](O)[C@H](C)C2)cc1O 166409460 JAYYLSDOPHIQHX-JMSVASOKSA-N 278.396 2.270 10 10 CECE C[C@@H]1C[C@@H](C)N(Cc2ccc(O)c(O)c2)C[C@H]1C(=O)O 2153734624 HJGBRZCUXZYCNR-CKYFFXLPSA-N 279.336 2.029 10 10 CECE COc1ccc(N(C)[C@@H](CN)c2cc(Cl)n(C)n2)cc1 2153833105 SDLDMWPVZRUXDD-ZDUSSCGKSA-N 294.786 2.218 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1Cc1ccnc(Cl)n1 2009443013 LKZYOZGTWVKONC-SECBINFHSA-N 252.709 2.405 10 10 CECE Cn1ncc(Cl)c1CN1CCC[C@@H]1CN=[N+]=[N-] 2009444229 DJIOEDFCSNXZDI-MRVPVSSYSA-N 254.725 2.348 10 10 CECE Cc1nc([C@@H](N)c2ccc3c(c2)CCCN3C)cn1C 2154677199 KODMJRBBKYDVMT-INIZCTEOSA-N 270.380 2.159 10 10 CECE C[C@@H](N[C@H]1C[C@@H]2CC[C@H](C1)N2C)c1cc(O)ccc1O 2154912830 FNVVNXHRVIKCQN-LPWJVIDDSA-N 276.380 2.374 10 10 CECE CO[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N)cc1 2154904875 IVWCXAGKZJTIFA-WDNDVIMCSA-N 275.352 2.443 10 10 CECE CNCc1ccc(N(C)C2(CO)CC2)cc1Br 2012607868 PTMDHTATHXAHMK-UHFFFAOYSA-N 299.212 2.130 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@H](O)[C@H](F)C2)cc1 2027972828 NBICJDMMWRLTOT-MCIONIFRSA-N 252.333 2.006 10 10 CECE Oc1cc(Cl)ccc1CN1CCC[C@H]2NCC[C@H]21 2029641828 RLHSBJMKQNZVEY-CHWSQXEVSA-N 266.772 2.372 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2C[C@@H]3CC[C@H](C2)N3)c1 2159675441 AOLMWCKZSVBXAP-WDNDVIMCSA-N 276.380 2.116 10 10 CECE N[C@H](c1ccccc1O)[C@]1(O)CCCCC1(F)F 2035273172 BRTAGKNFFVXCJM-VXGBXAGGSA-N 257.280 2.332 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2C[C@H]3C[C@H]2C[C@H]3F)cc1 2157650213 NEIFIOHCVKQEJX-AYRXBEOTSA-N 276.355 2.454 10 10 CECE CC(C)SC1CN(CCOc2ccc(N)cc2)C1 2036376518 JBOJQRXEDCMOAX-UHFFFAOYSA-N 266.410 2.473 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CCCc2ncno2)CC1 2037999331 FELKVKVFDBAGQG-JTQLQIEISA-N 250.306 2.167 10 10 CECE C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2038002645 NYSWPDQTQGXZFE-HBNTYKKESA-N 252.318 2.103 10 10 CECE CCCSC[C@@H](N)c1nc(-c2ccc(O)c(O)c2)no1 2157836896 OLULUKLVOKJADV-SECBINFHSA-N 295.364 2.291 10 10 CECE Oc1ccc(CNCc2ccc3nccn3c2)cc1O 2159805701 ZWRXRANPOYGZQM-UHFFFAOYSA-N 269.304 2.035 10 10 CECE CN(CCCC1CC1)CC(=O)N(C)c1ccc(N)cc1 400795385 JIXWXJWXTFQJBQ-UHFFFAOYSA-N 275.396 2.354 10 10 CECE CCNCc1ccc(N2CCC(CCO)CC2)cc1 400988526 WUXYTGJRGSDXDZ-UHFFFAOYSA-N 262.397 2.395 10 10 CECE CNCc1ccc(N2CC[C@@H]2c2noc(C)n2)c(C)c1 2160444649 UXIVDHSYAHZZFW-CQSZACIVSA-N 272.352 2.357 10 10 CECE Nc1ccc(O)c(CN2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)c1 311935679 VHTJWMDTGHQCBR-UOVKNHIHSA-N 258.365 2.452 10 10 CECE CC[C@@H](NC)c1ccc(N2CCN(CC)C(=O)C2)cc1 2158788106 XHIFNFCRVNIEQL-OAHLLOKOSA-N 275.396 2.026 10 10 CECE CCCN(C[C@@H]1CC[C@H](CO)CO1)c1ccc(N)cc1 2159017091 BEFCXSXDVOBVPY-CJNGLKHVSA-N 278.396 2.273 10 10 CECE COc1cccc(O)c1CN1C[C@@H]2CC[C@@H](OC)[C@H]2C1 2160736914 TVVWODOSMKRFFX-MQIPJXDCSA-N 277.364 2.258 10 10 CECE Cn1ncc2c1CCC[C@@H]2NCc1c(O)cccc1F 2160795276 VJEOXUOUXBVZQZ-ZDUSSCGKSA-N 275.327 2.432 10 10 CECE CC[C@H]1C[C@@H](C(=O)O)N(Cc2c(O)cccc2OC)C1 2160722855 HQVNBQYIWBWEDU-JQWIXIFHSA-N 279.336 2.086 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]2CCN(C)C)cc1O 701507487 GEGNRVUFDRBAJS-QWHCGFSZSA-N 278.396 2.366 10 10 CECE [N-]=[N+]=NCCCNC(=O)[C@H]1CSC(c2ccccc2)=N1 701292202 WVUBNYGWHDFYEJ-LLVKDONJSA-N 289.364 2.365 10 10 CECE C[C@@]1(C2CC2)CN(C(=O)Nc2ccc(N)cc2)CCO1 709924697 PBWXOYZDIFGCKB-HNNXBMFYSA-N 275.352 2.302 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](CN(C)C)C2)c(F)c1 688512607 GHICOINNTTYJGU-NSHDSACASA-N 283.366 2.072 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC[S@](=O)C[C@@H]1C 2171969517 REEWFKZADYYZMY-XOBRGWDASA-N 294.464 2.450 10 10 CECE NCc1ccc(N2C[C@H]3CCO[C@H]3C2)c(C(F)(F)F)c1 2172043914 HFLONOKCBZGODF-MFKMUULPSA-N 286.297 2.389 10 10 CECE CC(C)Oc1ccc(N2C[C@@H](N)C[C@]23CCOC3)cc1 2162636382 PGTMIERVZVQBBN-BBRMVZONSA-N 276.380 2.170 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@]23CCC[C@H]2OCC3)C1 687390710 OIMVZNOCINMVHI-NQBHXWOUSA-N 264.329 2.247 10 10 CECE CCCN1CC[C@@H](CN[C@H](C)c2ccc(O)cc2O)C1 710299851 HWTYOVWHVJRRNE-OLZOCXBDSA-N 278.396 2.480 10 10 CECE CN1CCc2cc([C@H](O)[C@]3(N)CCC[C@@H]4C[C@@H]43)ccc21 2163073383 IMIGONQXFFIYAN-UMPQAUOISA-N 272.392 2.230 10 10 CECE Cc1nnccc1[C@@H](N)c1ccc2c(c1)CCCN2C 2163095223 RLSQBBFEZDFKQN-INIZCTEOSA-N 268.364 2.216 10 10 CECE CC[C@@H]1C[C@H](N[C@@H](C)c2ccc(O)cc2O)CO1 711220480 TXXRUTGGOCZWCO-JBLDHEPKSA-N 251.326 2.316 10 10 CECE C[C@@H]1NCCN(Cc2c(O)cccc2Cl)[C@H]1C 379502924 XVPQXWNLIKYQFS-UWVGGRQHSA-N 254.761 2.228 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]4C3)c(Cl)cc21 379546049 ZXNXGJVTDQQCQC-BFHDXFOESA-N 277.755 2.009 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC[C@@H](CF)C2)cc1 711507661 WLAKTFDJNSCWIV-SWLSCSKDSA-N 265.376 2.044 10 10 CECE CN(C)c1ccc(CNC[C@H]2CCN2C2CC2)cc1 691833702 JOXOKNCSDWMXSX-MRXNPFEDSA-N 259.397 2.079 10 10 CECE CCCNCc1ccc(N2CC3CC2(CO)C3)cc1C 694523768 KBXMPESZIMEYMW-UHFFFAOYSA-N 274.408 2.456 10 10 CECE Cc1[nH]nc(CN[C@@H](C)c2ccc(O)cc2O)c1C 716445406 GBJWSJOVVAOLFH-JTQLQIEISA-N 261.325 2.289 10 10 CECE CC1(C)CN(Cc2cc(F)ccc2O)[C@H]2COC[C@@H]21 384788470 SMHCHNNGXODNFM-STQMWFEESA-N 265.328 2.388 10 10 CECE CNCc1ccc(N2C[C@@H](O)C[C@H]2C)cc1Br 384791076 SYIIGBQUTYAERF-SKDRFNHKSA-N 299.212 2.128 10 10 CECE CCOc1cccc(CN(CC)[C@@H]2CCOC2)c1O 388696610 FDZIXGAFWJMAHR-CYBMUJFWSA-N 265.353 2.402 10 10 CECE C[C@@H]1C[C@@H](CNCc2cccc(O)c2O)CCO1 388883119 MLWBIANRZXXGIN-MNOVXSKESA-N 251.326 2.003 10 10 CECE Nc1ccc(OCC(=O)NCC2(C3CC3)CCC2)cc1 391486637 HPOPUJUXNIUGRO-UHFFFAOYSA-N 274.364 2.344 10 10 CECE CN1CCc2cc(CNCCN3CC=CCC3)ccc21 392306439 IZTFBQZOSLFONA-UHFFFAOYSA-N 271.408 2.030 10 10 CECE CO[C@@H]1CC[C@H]1N(C)c1ccc(CO)c(Cl)c1 724146969 NFOHALKBIJLAEJ-CHWSQXEVSA-N 255.745 2.446 10 10 CECE Cc1ncc(CNCc2cc(Cl)ccc2O)[nH]1 724677848 NKLQFBAVVDYQKA-UHFFFAOYSA-N 251.717 2.367 10 10 CECE CCC[C@H]1CCCN1C[C@H](O)COc1ccc(N)cc1 397059456 OYSXLADSXFTMEU-GJZGRUSLSA-N 278.396 2.273 10 10 CECE CNCc1ccc(N2C[C@@H]3CC[C@H](O)C[C@H]3C2)c(F)c1 399049550 GCOOVQGNMVUWDA-IHRRRGAJSA-N 278.371 2.142 10 10 CECE CSC[C@H]1CCCN1CC(=O)Nc1ccc(N)cc1 400039636 MIZSJQNLJHMLHW-CYBMUJFWSA-N 279.409 2.035 10 10 CECE 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CN(C)[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 160234907 HNLMEGUNWJXDKV-LLVKDONJSA-N 254.761 2.182 10 10 CECE COC[C@@H](C)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 155406710 XPLLTZUYEQBMEK-GJZGRUSLSA-N 292.423 2.456 10 10 CECE Cc1nscc1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2213582325 GXENOGQULUYJPP-IUCAKERBSA-N 251.315 2.413 10 10 CECE CC1(C)[C@@H](N)CCCN1c1ccc2c(c1)OCCO2 259239957 DSSOBCSZZCWSBU-AWEZNQCLSA-N 262.353 2.164 10 10 CECE Nc1ccc(CCNC[C@H]2CC23CCOCC3)cc1 1894346355 HUGJNCSIIJLZDY-CQSZACIVSA-N 260.381 2.218 10 10 CECE Oc1cccc(CN[C@H]2CCC[C@@]34C[C@@H](CO3)[C@@H]24)c1O 2144359317 RIJBEKYUEOJCGA-DUPGQFARSA-N 275.348 2.145 10 10 CECE CN1CCCc2cc(CN[C@H]3C[C@@H](O)C3(C)C)ccc21 129444587 VAEPDSDXQPHHKT-JKSUJKDBSA-N 274.408 2.318 10 10 CECE Cc1cccc(CN[C@H](C)CCN2CCOC2=O)c1O 1876028073 QUOYHGYSOQVRFZ-GFCCVEGCSA-N 278.352 2.021 10 10 CECE NCC[C@H]1CCCCN1C(=O)Nc1ccc(N)cc1 1876149027 JTVIODWJDSUGSB-CYBMUJFWSA-N 262.357 2.004 10 10 CECE Oc1c(Br)cccc1CN[C@@H]1C[C@@H]2OCC[C@@H]21 1946516188 GHFKSZKERXTYNJ-JLLWLGSASA-N 298.180 2.422 10 10 CECE O=Cc1cnc(SCC(=O)N2CCCCC2)s1 1949613464 DQTHUSGIEQSHSW-UHFFFAOYSA-N 270.379 2.060 10 10 CECE Cc1nc(N)cc(N(C)[C@H](C)c2ccccc2O)n1 1877517243 GEJVZKIGFRFOLV-SECBINFHSA-N 258.325 2.270 10 10 CECE Cn1ncc2c1CCC[C@@H]2NCc1ccc(N)cc1 1963369187 NNEKYRQKBVJMIB-AWEZNQCLSA-N 256.353 2.170 10 10 CECE COc1ccc([C@@H](C)NOC2CCOCC2)c(O)c1 1878747507 ZKMPVNXEGMRQLY-SNVBAGLBSA-N 267.325 2.162 10 10 CECE C[C@H]1CC[C@](CO)(NCc2ccc(F)c(F)c2O)C1 1880896825 FQQKZFKZFROMEA-XPTSAGLGSA-N 271.307 2.311 10 10 CECE C[C@H]1CCNCC[C@H]1NCc1ccc2c(c1)CCCO2 1964686932 ZDSACIQJUSZBIY-XJKSGUPXSA-N 274.408 2.489 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H]2C(=O)N(C)C)cc1 2143707649 JKTMPHKGOFRYKT-DOMZBBRYSA-N 275.396 2.024 10 10 CECE Oc1cc(Br)ccc1CN[C@@H]1CC[C@@H](O)C1 1902635718 KEDHIQGHJGKLDT-GHMZBOCLSA-N 286.169 2.158 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCO[C@H]3COCC[C@@H]32)c1 2143765181 IIQJTRNTYAQOCI-NOLJZWGESA-N 277.364 2.251 10 10 CECE CC(C)(C)N1CC[C@@H](NCc2c(O)cccc2F)C1 1964079457 LLAWREJIDVXUQC-LLVKDONJSA-N 266.360 2.494 10 10 CECE CC(C)(C)OC(=O)C[C@@H](CCN)c1ccc(O)c(O)c1 1951961887 KRAYYDFDHANVRU-LLVKDONJSA-N 281.352 2.262 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)[C@H]1CCSC1 251524271 BSFJPJPNANYMKB-GWCFXTLKSA-N 279.409 2.033 10 10 CECE Oc1cc(F)ccc1CN[C@@H]1CCCN2CCSC[C@H]12 1967818897 FEFRXWKBMVCMKV-ZIAGYGMSSA-N 296.411 2.201 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CC2(CC2)CO1 1967808743 ORJQIHZIBZTQQX-NSHDSACASA-N 263.337 2.060 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@H](CN)C2)c([N+](=O)[O-])c1 253180850 DVZGCGNUSHEDHR-GHMZBOCLSA-N 279.340 2.025 10 10 CECE O=C(O)[C@H]1C=CCCN1Cc1ccc(Cl)cc1O 1974265689 BQGUTHHZXYMCPX-LLVKDONJSA-N 267.712 2.261 10 10 CECE COc1cc([C@H](C)NCc2ccc(O)c(O)c2O)sn1 2145564879 LKGFBDAGLCMHNZ-ZETCQYMHSA-N 296.348 2.119 10 10 CECE CN(Cc1c(O)ccc2ccccc12)[C@H]1[C@@H]2CNC[C@@H]21 2149951006 ORNHJWRFXVUGLP-HALDLXJZSA-N 268.360 2.195 10 10 CECE Nc1ncc(F)cc1OCc1cc(Cl)ns1 1979700536 JJAKQJPBQGCAGZ-UHFFFAOYSA-N 259.693 2.492 10 10 CECE Cc1ccc(S(=O)(=O)NCc2ccc(N)cc2)cc1C 32146988 DEBIWCFUICUSEC-UHFFFAOYSA-N 290.388 2.364 10 10 CECE COC(=O)CC[C@H](N)c1ccc2[nH]cc(C)c2c1O 260844818 HBRKFMAETAPBJT-JTQLQIEISA-N 262.309 2.135 10 10 CECE CCCCNC(=O)[C@H](C)N(CC)c1ccc(CN)cc1 34654502 RHHNAVOVXYGQTN-ZDUSSCGKSA-N 277.412 2.276 10 10 CECE NCc1ccc(N2CCC[C@@H](O)C2)cc1C(F)(F)F 36796689 YVARJMXTMGQSIO-LLVKDONJSA-N 274.286 2.125 10 10 CECE Nc1ccc(O)c(CNC(=O)c2ccc(F)c(F)c2)c1 36737477 RXBADXRAZOKEFJ-UHFFFAOYSA-N 278.258 2.183 10 10 CECE CCN[C@H](C1CCC1)[C@@H](O)c1ccc2c(c1)CCN2C 2147490407 MHYAGTFNRLUQRJ-SJORKVTESA-N 274.408 2.491 10 10 CECE Cc1cncc([C@@H](N)[C@@H](O)c2ccc(N(C)C)cc2)c1 2147862884 ODKBHLSSBULAJI-CVEARBPZSA-N 271.364 2.189 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)C2[C@@H]3CCC[C@@H]23)cc1 2151276058 RKMKTWSQFNVREH-OAGGEKHMSA-N 273.424 2.483 10 10 CECE CC(=O)c1ccc(O)c(CN2CCOC3(CCC3)C2)c1 2151755214 YFTSYFSZHWCKAO-UHFFFAOYSA-N 275.348 2.350 10 10 CECE COc1ccc(CNCCc2ccccn2)c(O)c1 40905741 WPSMODLLBDMSRM-UHFFFAOYSA-N 258.321 2.128 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]2[C@@H](C)O)cc1Br 2011145605 MIPITYXYLNUUQU-RWEMILLDSA-N 299.212 2.428 10 10 CECE CCN(C1CC1)[C@H](CN)c1ccc2c(c1)CCN2C 50287063 BCWIXKRZBQGRLI-MRXNPFEDSA-N 259.397 2.163 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@@H](O)c2ccccc2)CC1 2155559578 DNZMLRFTPXAFMP-STQMWFEESA-N 274.324 2.411 10 10 CECE NCc1ccc(N2CC(SC(F)F)C2)cc1F 2019951437 DDJSBJSOXWAZHL-UHFFFAOYSA-N 262.300 2.429 10 10 CECE Nc1ccc(OCC(=O)NC[C@H]2CCC(F)(F)C2)cc1 2156214087 FGHXLYJJCWFMRD-JTQLQIEISA-N 284.306 2.199 10 10 CECE C[C@H]1CSCCCN1C(=O)c1ccc(O)c(O)c1 2027095967 CPPDSYLBQZYOEO-VIFPVBQESA-N 267.350 2.065 10 10 CECE CCCSC[C@@H](C)NC(=O)c1cccc(O)c1O 2028118189 ISEGDFZYPGGPHW-SECBINFHSA-N 269.366 2.359 10 10 CECE CN(Cc1cc(N)ccc1O)C1CCC2(CC1)OCCO2 2029125008 JQFOXLMJXDUBBR-UHFFFAOYSA-N 292.379 2.092 10 10 CECE C[C@H]1C[C@H](O)[C@H](C)CN1c1ccc(CO)cc1Cl 2032207338 LUJAEQIQSXBSFT-BFVZDQMLSA-N 269.772 2.428 10 10 CECE Nc1ccc(N2CCOC[C@H]2CC(F)(F)F)cc1 2032975731 LWFYFDPSKGUTES-LLVKDONJSA-N 260.259 2.426 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)N)c(O)c2)CC[C@@H]1C 300028149 YAAZVHFTIAXMCV-ZIBATOQPSA-N 264.369 2.273 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H]1C[C@@]12CCOC2 2156758022 OOOIACHONNYSRD-CZUORRHYSA-N 276.380 2.006 10 10 CECE C[C@H]1CC[C@@H](C(=O)NCCc2ccc(N)cc2)S1 2034236812 HOWWOWYYGQEERG-GWCFXTLKSA-N 264.394 2.212 10 10 CECE CNCc1cc(F)c(N2C[C@@H](F)[C@H](C)C2)c(F)c1 2035295984 BVUIYUWWEPIBIR-PRHODGIISA-N 258.287 2.478 10 10 CECE CC1(C)CCO[C@@H]1CNCc1ccc(O)cc1O 2036745286 XMJSGHVMGZAEHK-CYBMUJFWSA-N 251.326 2.003 10 10 CECE C[C@@H]1C[C@@H](c2nc(-c3ccc(O)c(O)c3)no2)CCN1 300459917 ZMMCGDFYBIAOBQ-SCZZXKLOSA-N 275.308 2.003 10 10 CECE CCNCc1ccc(N2CCN(C)C[C@H]2C)c(C)c1 300540043 FYJYNJJQPRRMMH-CQSZACIVSA-N 261.413 2.245 10 10 CECE CSc1ncc(CNC[C@]2(N)CC[C@@H](C)C2)s1 2248741218 MUWMCOKCQAOINM-SKDRFNHKSA-N 271.455 2.472 10 10 CECE CCCN[C@H](C)c1ccc(N2CC(C)(CO)C2)cc1O 2157304411 RNUGNMXPYQOMSA-GFCCVEGCSA-N 278.396 2.271 10 10 CECE CSC[C@@H]1CCCN1[C@H](C)C(=O)Nc1ccc(N)cc1 400230671 ONMJOCGHAPUOLD-RISCZKNCSA-N 293.436 2.423 10 10 CECE COC(=O)NCCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 308157944 SMQLYAIPDYRYFX-MNOVXSKESA-N 278.352 2.195 10 10 CECE CN(C[C@@H]1CC[C@@H]2C[C@@H]21)C(=O)COc1ccc(N)cc1 2157960741 PLGLUUCKDGEBEU-XUJVJEKNSA-N 274.364 2.152 10 10 CECE CC(=O)c1cc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])n(C)c1 701264112 NQBPVJCSUQZVBZ-LLVKDONJSA-N 275.312 2.143 10 10 CECE O=C(O)[C@@H]1CC2(CCC2)CN1Cc1c(O)cccc1F 2160779346 CEJKUSIMZBTJLB-LBPRGKRZSA-N 279.311 2.361 10 10 CECE C[C@H]1C[C@@H](N(C)c2c(F)cc(CO)cc2F)CCN1C 2170395249 UKBQISVHOGEDQY-JQWIXIFHSA-N 284.350 2.376 10 10 CECE Nc1ccc(CCCNC[C@]23COC[C@H]2C3(F)F)cc1 2161886416 JCQROYGJONRGLW-KGLIPLIRSA-N 282.334 2.073 10 10 CECE CCNCc1ccc(N(C)CC2CC(O)C2)c(F)c1 91462522 UIICUFVMHTXFKJ-UHFFFAOYSA-N 266.360 2.142 10 10 CECE C[C@H](O)[C@H]1CCCCN1c1ccc(CN)c(F)c1F 688682872 DRHQNFDOQVWJJD-GXSJLCMTSA-N 270.323 2.163 10 10 CECE C[C@H](N)c1ccc(N2CCN([C@@H]3CCSC3)CC2)cc1 2171550658 IUYPHRYXXSRWRU-XJKSGUPXSA-N 291.464 2.334 10 10 CECE Cc1cc(N2CC(OCC(F)(F)F)C2)ccc1CN 687900812 XFIRYUVTQYWBLB-UHFFFAOYSA-N 274.286 2.221 10 10 CECE CCNCc1ccc(N(C)C[C@]23COC[C@H]2C3)c(F)c1 689286947 UZMSTFTYXNBAEZ-CZUORRHYSA-N 278.371 2.408 10 10 CECE Cn1nccc1[C@@H]1CCN(CCc2ccc(N)cc2)C1 2171786424 GQKXQALODJLYMO-CQSZACIVSA-N 270.380 2.034 10 10 CECE CC[C@@H](CO)N(C)c1ccc(CNC2CC2)cc1C 380859057 DMHLNGSMYWUGBR-HNNXBMFYSA-N 262.397 2.454 10 10 CECE CCS[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 382969493 TVQDAZVJRWACAN-CYBMUJFWSA-N 264.394 2.165 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3[C@H](N4CCCC4)[C@H]3C2)cc1 384420424 SYGDEGYQNXTEQU-VZEFYGNVSA-N 271.408 2.237 10 10 CECE CNCc1ccc(N(C)[C@@H]2C[C@@H](C)O[C@@H]2C)c(C#N)c1 384794122 ROAIEYTXXYUHKD-XHBSWPGZSA-N 273.380 2.280 10 10 CECE Nc1ccc(C[C@@H](O)c2cccc3c2OCC3)cc1 696596208 SIQJKOKUXZFMAC-OAHLLOKOSA-N 255.317 2.480 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])Cc2ccccc2[C@H]1C 699304231 QNNAIKZQYNWEDY-QMTHXVAHSA-N 274.324 2.158 10 10 CECE Cc1cn(C)nc1CN1CCc2cc([C@@H](C)N)ccc21 724011365 REPHYIDLJGOJIC-GFCCVEGCSA-N 270.380 2.311 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)c1ccc(CO)cc1Cl 724148860 WNIVRTBPXWQLBN-QWHCGFSZSA-N 255.745 2.446 10 10 CECE CC1([C@@H](NCCN=[N+]=[N-])C(N)=O)CCCCCC1 394673705 QEOCBCBNIQXUKR-JTQLQIEISA-N 253.350 2.101 10 10 CECE C[C@@H](NCCOC(F)(F)F)c1c(O)cccc1O 398250485 IHVMAXBBXKNHKJ-SSDOTTSWSA-N 265.231 2.285 10 10 CECE CC[C@@]1(C)CCN(CCOc2ccc(N)cc2)C1=O 399271014 BHBZIKTUCKKSNE-HNNXBMFYSA-N 262.353 2.296 10 10 CECE Oc1cccc2c1[C@@H](N[C@H]1CCc3nccn3C1)CC2 834718413 UVOQSBFYZUNAPY-STQMWFEESA-N 269.348 2.181 10 10 CECE O=C(NCc1c(O)cc(O)cc1O)C1(C2CCC2)CCC1 2062307408 CLLYKUQJFHEDSX-UHFFFAOYSA-N 291.347 2.390 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCN[C@@H](CC(F)F)C1 2177311540 HROFRNBPSWCIMU-ZJUUUORDSA-N 286.322 2.088 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H](O)C3(CF)CCC3)ccc21 2166505870 GIGYLIOQKMSFKI-HUUCEWRRSA-N 278.371 2.179 10 10 CECE CN(C[C@H]1[C@H]2CCC[C@H]21)c1ccc2c(c1)NC(=O)[C@H]2N 2167282601 PZOWNWHRCNFRSO-WJNVRWDZSA-N 271.364 2.121 10 10 CECE CN1CCCc2cc([C@]3(O)CCN[C@H]4CC[C@H]43)ccc21 2177704909 NKJNHSBUMXEJEM-HLLBOEOZSA-N 272.392 2.029 10 10 CECE CC(C)[C@@H](O)CN(C)c1ccc([C@H](C)O)cc1[N+](=O)[O-] 2167643857 UDZGTWIZMYRPIA-HZMBPMFUSA-N 282.340 2.101 10 10 CECE COC(=O)c1cc(C)nn1Cc1ccc(Cl)cc1O 2069933648 AQBPMYIOMQZKBS-UHFFFAOYSA-N 280.711 2.385 10 10 CECE OCc1cnn(Cc2cc(C(F)(F)F)ccc2O)c1 2070012826 NVAHDMLSMOPICN-UHFFFAOYSA-N 272.226 2.148 10 10 CECE Oc1c(F)cc(Br)cc1CNCC1COC1 883190565 HCLVFWYTWKPDFH-UHFFFAOYSA-N 290.132 2.030 10 10 CECE Cc1cccc(O)c1Cn1ncc(CN)c1Br 2070335577 NLRVDRJGCNCJHI-UHFFFAOYSA-N 296.168 2.167 10 10 CECE COCCNCc1ccc(OCC2(OC)CC2)c(C)c1 2167845722 ATCBDXWRFNONJM-UHFFFAOYSA-N 279.380 2.289 10 10 CECE Cc1ccc(O)c([C@@H](C)n2cc(CN(C)C)c(O)n2)c1 2070717276 AAZCXJJCRBIJHI-LLVKDONJSA-N 275.352 2.274 10 10 CECE CC(C)[C@H](C(=O)O)N(C)Cc1ccc2c(c1)CCN2C 2174985507 PDXKCGCLHOBWKS-OAHLLOKOSA-N 276.380 2.220 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC[C@@H]2[C@@H](O)C[C@@H]21 2178159947 LGHYVTFAKZJIKF-XIRDDKMYSA-N 274.408 2.453 10 10 CECE O[C@@H]1C[C@@H]2[C@@H]1CCN2c1ccc(CNC2CC2)cc1F 2178170860 YQWRBWVGBRLQEU-APHBMKBZSA-N 276.355 2.037 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3[C@H](O)C(C)(C)[C@H]32)c(F)c1 2178166456 YHHXKJMHOJTJLV-GQANPOSXSA-N 278.371 2.441 10 10 CECE NCCO[C@@H]1CCN(c2ccc(OC3CCC3)cc2)C1 2168990753 HCSQHTWECVUUSO-MRXNPFEDSA-N 276.380 2.172 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)[C@@H]1CCC[C@@H]1F 2175592251 HLYIBYKPMKPEGQ-UONOGXRCSA-N 280.343 2.387 10 10 CECE CNC[C@@H]1CN(c2ccc3c(c2)CCCN3C)C[C@H]1C 2169435609 GZGAARMVKJLVFU-UKRRQHHQSA-N 273.424 2.361 10 10 CECE CCN(CCCCN1CCCC1=O)c1ccc(N)cc1 2169785581 PSHSOGROSHBESC-UHFFFAOYSA-N 275.396 2.498 10 10 CECE CO[C@H]1CCC[C@H](NCc2ccc(O)cc2O)C1 1172917382 FZVLUVMTZQSHOB-AAEUAGOBSA-N 251.326 2.145 10 10 CECE C[C@H](F)[C@@H]1CCCN1[C@@H](C)C(=O)Nc1ccc(N)cc1 2181220867 BTHLLVMGSUBMRB-MJVIPROJSA-N 279.359 2.418 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H]3[C@H]4COCC[C@@H]43)ccc21 2181299601 LNGIJVBZQPWSRB-XJNFMUPTSA-N 272.392 2.351 10 10 CECE 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[N-]=[N+]=N[C@H]1CCCN(Cc2nnc3n2CCCC3)CC1 2155565287 VBVAMRLAHAXACQ-NSHDSACASA-N 275.360 2.279 10 10 CECE CC(C)(C)[C@H](CCO)NCc1ccc(F)cc1O 293748606 XVPMSRAHUPUYKP-ZDUSSCGKSA-N 255.333 2.418 10 10 CECE CC[C@H](CNCc1cc(OC)ccc1O)COC 2027330829 DLRTZQRPDFWEKK-LLVKDONJSA-N 253.342 2.163 10 10 CECE C[C@H](O)c1ccc(N2CC(COC(F)(F)F)C2)cc1O 2156322720 CAZQKPVNYSTNBC-QMMMGPOBSA-N 291.269 2.418 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3C[C@]3(CO)C2)c(Cl)c1 2029643390 GUMAVPZBXVDZGZ-NURSFMCSSA-N 266.772 2.178 10 10 CECE CNCc1ccc(N2CC(F)(F)C[C@]2(C)CO)c(C)c1 2159050990 HMUWTSYJPFWWAZ-CQSZACIVSA-N 284.350 2.311 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H](N)C2(CC2)C1 2034692761 HGNKZZVSBIQJJY-ZANVPECISA-N 250.317 2.015 10 10 CECE CO[C@@H]1CCCN(c2ccc(CN)cc2F)[C@H]1C 2037811084 DVLBTNHFTVEOBH-IINYFYTJSA-N 252.333 2.288 10 10 CECE C[C@H]1C[C@H](CO)CN1c1ccc([C@@H](C)O)cc1F 2038890356 LCTGAUBVQNPXSQ-AXFHLTTASA-N 253.317 2.086 10 10 CECE CCN1CCCN([C@H](C)c2ccc(OC)cc2O)CC1 307897089 MOEAMYHAIFNODD-CYBMUJFWSA-N 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10 CECE COCCCN(C)c1ccc(CN)c(Br)c1 228152053 AOWSQZMDSZWAAR-UHFFFAOYSA-N 287.201 2.381 10 10 CECE Oc1c(CN2CC[C@@H]3CCO[C@H]3C2)ccc(F)c1F 1233076901 XHNLMLYWTXXAOY-SKDRFNHKSA-N 269.291 2.281 10 10 CECE CS[C@@H]1CCCC[C@@H]1Nc1c(N)cccc1C(N)=O 235116290 NSEGXSLVPYWMSX-NWDGAFQWSA-N 279.409 2.454 10 10 CECE CCOc1ccccc1[C@H](NCCN=[N+]=[N-])C(=O)O 90256469 CCXWNLMASKIYRY-NSHDSACASA-N 264.285 2.111 10 10 CECE CC(C)(C)OC(=O)NCc1cc(C(=O)O)ccc1O 258527084 MMDYGVRDLTYUFP-UHFFFAOYSA-N 267.281 2.115 10 10 CECE Cc1cc(N2CC[C@H](C)[C@H]2CO)ccc1CNC1CC1 299951474 DSIGTQLPGBYSNZ-YVEFUNNKSA-N 274.408 2.454 10 10 CECE C[C@H]1CCN(c2ccc(CNC3CC3)cc2F)[C@H]1CO 299946755 BBFSDEDSNJAWOC-ZBEGNZNMSA-N 278.371 2.285 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@H](C(=O)O)[C@H]1C 252598357 JTORDQYVUFBVQI-LNLATYFQSA-N 267.300 2.387 10 10 CECE O=C(O)/C=C/c1ccc(N2C[C@H]3C[C@H]3C2)c([N+](=O)[O-])c1 380409825 YUZNGDBFLVSVSC-BUYCOLMZSA-N 274.276 2.149 10 10 CECE CN(C)c1ccc([C@H](O)Cc2ncc(Cl)n2C)cc1 700221127 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Cc1cc2c(cc1N(C)C[C@H](CN)C(C)C)OCO2 259025068 PYYQZEMXFFOXFA-LBPRGKRZSA-N 264.369 2.391 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCC[C@@H]1CC(=O)O 235495219 CTHCUYCETRKFFE-WDEREUQCSA-N 279.336 2.488 10 10 CECE CC[C@@H](NC)c1ccc(N(C)C[C@@H]2COCCO2)cc1 2143684957 GJPGKVYQNDGKDZ-HZPDHXFCSA-N 278.396 2.209 10 10 CECE CC(C)[C@](C)(NCc1ccc2c(c1)CCCO2)C(N)=O 2143832439 VFBSWAZOSIPSOA-INIZCTEOSA-N 276.380 2.001 10 10 CECE C[C@H]1C[C@@H]1Cc1noc(-c2cc(O)c(O)c(O)c2)n1 1875983414 ZYQPYPNNHOJLMK-NKWVEPMBSA-N 262.265 2.052 10 10 CECE C[C@@](F)(CNCc1ccc(O)c(O)c1O)C(F)(F)F 1876646317 UGIOASQQRWZVOP-SNVBAGLBSA-N 283.221 2.184 10 10 CECE CN1C[C@@H](CNCc2cc(F)ccc2O)CC1(C)C 1877037510 AMUYCKVOSYJTIB-LLVKDONJSA-N 266.360 2.351 10 10 CECE CC(C)[C@H](C(=N)NO)N(C)[C@@H](C)c1ccccc1O 1877539683 YFPXBSRTYPJQEI-GXFFZTMASA-N 265.357 2.366 10 10 CECE CN(Cc1ccccc1O)[C@H]1CC[C@]12CCCNC2 1877547665 ZHGWGERKYGOZCS-HOTGVXAUSA-N 260.381 2.356 10 10 CECE COC(=O)C1(CN(C)[C@H](C)c2ccccc2O)CC1 1877532618 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Cc1cccc(CN[C@H]2CCC[C@H](S(C)(=O)=O)C2)c1O 2145394558 HQTOFCRUIDDMOP-KBPBESRZSA-N 297.420 2.146 10 10 CECE NCCC1CC(NCc2ccc3c(c2)CCCO3)C1 1967979931 GYEDDWNDHZGYDP-UHFFFAOYSA-N 260.381 2.229 10 10 CECE Cc1nccc(COC(=O)CCc2ccc(N)cc2)n1 2145802470 HRMBUNDIEKAODE-UHFFFAOYSA-N 271.320 2.043 10 10 CECE C[C@]1(F)CCCN(C(=O)Cc2ccc(N)cc2)C1 1972453499 QSEJDUFZSLZAFM-AWEZNQCLSA-N 250.317 2.162 10 10 CECE O=C(O)[C@H]1CCCCN(Cc2cc(F)ccc2O)C1 1972908141 GQNUBWRVUCFTSO-JTQLQIEISA-N 267.300 2.218 10 10 CECE C[C@H](Nc1c(N)cccc1Cl)[C@H](C)S(C)(=O)=O 2004007918 CKUJRLJVJMDKET-YUMQZZPRSA-N 276.789 2.156 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCC[C@@H]1OC 161124675 VNJJAEFMLZVSKH-STQMWFEESA-N 278.352 2.425 10 10 CECE C[C@@H](Cn1cccn1)N[C@H](C)c1ccc(O)cc1O 37155585 ZNRJEDYZCQCHMQ-WDEREUQCSA-N 261.325 2.034 10 10 CECE CCCN[C@@H]1CCN(c2ccc(OC)c(OC)c2)C1 37240745 SUYXKJHUXQYDJG-GFCCVEGCSA-N 264.369 2.282 10 10 CECE COC(=O)c1ccccc1NCc1ccc(O)cc1O 37308302 VSMUYQMPPGBWLG-UHFFFAOYSA-N 273.288 2.497 10 10 CECE CCCN[C@H](c1ccccc1O)[C@H](O)[C@@H]1CC[C@@H](C)O1 2148146722 FWVZEISPDKMEKL-MSQAHXEGSA-N 279.380 2.361 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CC(C)(C)OC1(C)C 2148146219 CCPNWSXHWKAWJG-CJNGLKHVSA-N 279.380 2.361 10 10 CECE NCc1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)c2ccccc12 2151394357 WGDXOESXGUFVKX-MJEQTWJJSA-N 268.360 2.116 10 10 CECE C[C@@H]1C[C@@H](C)N(Cc2cc(F)ccc2O)C[C@@H]1C(=O)O 2153735582 ODCNXLKSNNTSCZ-BREBYQMCSA-N 281.327 2.462 10 10 CECE C[C@@H](c1nccs1)N(C)C(=O)COc1ccc(N)cc1 2155699806 SCUYVZQTYPPOQI-JTQLQIEISA-N 291.376 2.324 10 10 CECE CC[C@@H]1CCN(c2ccc3c(c2)OCCO3)CCN1 49661286 JMNKVLKOLZNTDI-GFCCVEGCSA-N 262.353 2.036 10 10 CECE CNCc1ccc(OC)c(CN(CCOC)C2CC2)c1 50125229 SZZLCPPPTDRZMO-UHFFFAOYSA-N 278.396 2.025 10 10 CECE CC(C)Cn1cnc([C@@H](O)c2ccc(N(C)C)cc2)n1 2159404900 MFEDRUXDXMKNOI-AWEZNQCLSA-N 274.368 2.082 10 10 CECE CCN(C)C[C@H]1CCN(Cc2ccc(F)cc2O)C1 295245099 FHRFGXLEWIZWBE-GFCCVEGCSA-N 266.360 2.305 10 10 CECE NCc1ccc(N2C[C@H]3CC[C@@]2(CO)C3)c(Cl)c1 2029250652 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C[C@@H](COC(=O)COc1ccc(N)cc1)CC(F)F 688750206 XJXYLLQQTYFDPT-SECBINFHSA-N 273.279 2.482 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2CCC[C@@H]2O)cc1O 689252958 BOKRFJPVPUKKQB-WDMOLILDSA-N 265.353 2.043 10 10 CECE CCN1CC[C@H](N[C@@H](C)c2cc(F)ccc2O)C1 389540655 KEGPEUADTDVWES-JQWIXIFHSA-N 252.333 2.276 10 10 CECE O=C(O)[C@@H]1CC(F)(F)CN1Cc1c(O)cccc1Cl 713602363 UYQRGTSSIJFRDY-VIFPVBQESA-N 291.681 2.340 10 10 CECE O=C(NC[C@]12CCCC[C@@H]1C2)c1ccc(O)c(O)c1 693575401 AXZKSMCGZUJTTD-IAQYHMDHSA-N 261.321 2.408 10 10 CECE C[C@H](N)c1ccc(N2CC(CN(C)C)C2)c(Cl)c1 382343657 LUVZAYZLEUOCHX-JTQLQIEISA-N 267.804 2.358 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@H]2CN3CCC2CC3)cc1 382479461 DYBPJLWIYMCPNJ-WBMJQRKESA-N 259.397 2.237 10 10 CECE CC1=C(C)CN(c2ccc3c(c2)NC(=O)[C@H]3N)CC1 382904914 IBCXKHWPVQOMIH-AWEZNQCLSA-N 257.337 2.185 10 10 CECE CNCc1ccc(N2CC[C@H](OC)C[C@H]2C)c(C#N)c1 383086121 KUXFUASNDSPMGB-DOMZBBRYSA-N 273.380 2.281 10 10 CECE CCN[C@H](C)c1ccc(N2CC3CC2(CO)C3)cc1 694588595 KUDSATBMTLAHFA-VEAWUBTESA-N 260.381 2.318 10 10 CECE C[C@H]1CCN(c2cc3c(cc2N)OCCO3)C[C@@H](C)O1 694831841 ALWHQDWFUHUPOS-WDEREUQCSA-N 278.352 2.044 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2COC3)c(C)c1 695038889 FBHQSAYVTGAKQW-GJZGRUSLSA-N 260.381 2.472 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(O)(C3CC3)C2)cc1 384071767 UIGSHMLJOIHBQC-LBPRGKRZSA-N 260.381 2.318 10 10 CECE CN(Cc1ccc(N)cc1)[S@](=O)C1CCCC1 385413971 GZRCXCYTLYAGAG-QGZVFWFLSA-N 252.383 2.307 10 10 CECE Nc1ccc(N[C@@H]2CCCN3CCSC[C@@H]23)cc1 720439319 QZJOQNNJTPLFRM-KGLIPLIRSA-N 263.410 2.261 10 10 CECE CCc1nc(C)c(CNCc2cccc(O)c2O)o1 389237207 AWECUPDFOQTYGQ-UHFFFAOYSA-N 262.309 2.246 10 10 CECE C[C@@H](NCc1cccc(F)c1O)c1csnn1 398313569 DAVJJVMRWVAOBV-SSDOTTSWSA-N 253.302 2.234 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)C3(CCCC3)C2)cc1O 2174372088 UVGYTIFCOKYMFM-ABAIWWIYSA-N 277.364 2.187 10 10 CECE CN(Cc1cccc(Cl)c1O)[C@@H]1CO[C@@]2(CCOC2)C1 2179004177 CYXURPJOQWFHKV-WFASDCNBSA-N 297.782 2.425 10 10 CECE CCO[C@H]1CC[C@H](CNC(=O)c2ccc(O)c(O)c2)C1 2174877045 MECKZRNIPQOEDV-JQWIXIFHSA-N 279.336 2.033 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H](CC(=O)O)O[C@H](C)C1 2179282923 OGCMSHQAPIADQU-WOPDTQHZSA-N 279.336 2.017 10 10 CECE CN(C(=O)[C@@H]1CNc2ccccc2N1)[C@@H]1CCC[C@H]1F 2175596168 KOMOIOLNKJHISF-DDTOSNHZSA-N 277.343 2.242 10 10 CECE C[C@@H]1c2c(cnn2C)CN1c1c(F)cc(CN)cc1F 2168502842 BOKWOFBJXKRPJC-MRVPVSSYSA-N 278.306 2.238 10 10 CECE C[C@@H](NC1CN(C2CCCC2)C1)c1ccc(O)cc1O 2169249045 FAATUIXJAROXKF-LLVKDONJSA-N 276.380 2.375 10 10 CECE COCCNCc1ccc(N(C)CC[C@H](C)OC)cc1 2179916051 DLWQCLMHQFNLGI-AWEZNQCLSA-N 280.412 2.284 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@H]2CCCNC2=O)cc1 2171079189 KRZNKUWKGGMLBC-DOMZBBRYSA-N 275.396 2.072 10 10 CECE CNCc1ccc(N(C)Cc2cnccc2OC)cc1 2177471496 LIQVZBAATYAZBM-UHFFFAOYSA-N 271.364 2.446 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H](n3cncn3)C2)cc1 2171250750 APIKMGLNNLCSNR-DOMZBBRYSA-N 271.368 2.139 10 10 CECE CCN(CCN(C)C)Cc1ccc(Cl)cc1O 1140461373 JRDUVDTUKYSSAA-UHFFFAOYSA-N 256.777 2.429 10 10 CECE CCOC(=O)c1c(C2CCC2)nn2c(O)cc(C)nc12 2080847970 FHHOQBBYHSTXLL-UHFFFAOYSA-N 275.308 2.188 10 10 CECE Oc1ccccc1CN1CCO[C@H]([C@H]2CCCOC2)C1 2171684780 NSIRDAUSNOEALK-HOCLYGCPSA-N 277.364 2.020 10 10 CECE Cn1nccc1[C@@H]1CCCN1Cc1cc(N)ccc1O 2171783330 WZJUCOPJDLCOCK-AWEZNQCLSA-N 272.352 2.045 10 10 CECE CN1CCCc2cc([C@H](O)C[C@@H]3[C@@H]4COC[C@@H]43)ccc21 2188903797 FJWSODVIUKDPEW-JYYAWHABSA-N 273.376 2.385 10 10 CECE CN[C@H](C)c1ccc(N(C)C2CC3(COC3)C2)cc1O 2182206942 HGMAQQROKKCLBN-LLVKDONJSA-N 276.380 2.288 10 10 CECE C[C@@]1(NC(=O)c2cc(O)c(O)c(O)c2)CCCC1(F)F 2188911040 ZLWRMFFOOSURIU-GFCCVEGCSA-N 287.262 2.111 10 10 CECE CCC(=O)N1CCN([C@@H](C)c2cc(C)ccc2O)CC1 2182601627 HPPOSFZTKGPJMU-ZDUSSCGKSA-N 276.380 2.316 10 10 CECE CC[C@@H](NC)c1ccc(N(CCOC)C2COC2)cc1 2193569947 IISCVSSUYNGCLF-MRXNPFEDSA-N 278.396 2.209 10 10 CECE CNCc1ccc(N2CC[C@@H](C(F)(F)CO)C2)cc1C 2197762027 MWPIGOKAYPXQKD-CYBMUJFWSA-N 284.350 2.168 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1[C@H]2CC[C@H]3[C@@H](C2)C[C@H]31 2197959347 GAGSEPXMVVECSE-LKSXDXAVSA-N 271.364 2.214 10 10 CECE OCc1ccc(N2CC[C@H](O)C(F)(F)CC2)c(Cl)c1 2093629218 RHGUKQLGCFXULV-LBPRGKRZSA-N 291.725 2.429 10 10 CECE CN[C@@H]1CCCc2cc(N3CCC[S@@](=O)CC3)ccc21 2184689166 LQAPTIKKCVKPJB-OXQOHEQNSA-N 292.448 2.242 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3N)C[C@@H]1N(C)C 2184690918 IMIATEDKOYHUIY-JLZZUVOBSA-N 273.424 2.409 10 10 CECE CCN[C@@H]1CCCc2cc(N3CCN(C)CC3)ccc21 2184686718 KCUIFXGKLSQPGZ-QGZVFWFLSA-N 273.424 2.425 10 10 CECE CN[C@H]1CCc2cc(N3C[C@@H](O)CC4(CC4)C3)ccc21 2184727435 VIANXWRKDGETBR-HOCLYGCPSA-N 272.392 2.245 10 10 CECE CCCN[C@@H]1CCc2cc(N3C[C@@H](C)[C@@H](O)C3)ccc21 2184743354 JGMPUYMSRGPMPW-JLZZUVOBSA-N 274.408 2.491 10 10 CECE CN1CCC(CN(C)c2ccc3c(c2)CC[C@@H]3O)CC1 2184736732 XIAUXMNCDCNVRP-KRWDZBQOSA-N 274.408 2.444 10 10 CECE Nc1ccc(OCC(=O)N2CC[C@H]3CCC[C@@H]3C2)cc1 2184855823 AIZDKULQRHZLKI-CHWSQXEVSA-N 274.364 2.296 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3CC(O)C[C@H]3C2)c(F)c1 2194515175 YUEUTWZKASPQJC-LSJOCFKGSA-N 283.318 2.225 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CC[C@@]2(CCCOC2)C1 2185129962 NFEQQQDAVOXTBX-STQMWFEESA-N 282.344 2.081 10 10 CECE CCC[C@@H]1C[C@@H](N(C)C(=O)Cc2ccc(N)cc2)CO1 2185618181 GJJSEPFVCODTJE-HUUCEWRRSA-N 276.380 2.227 10 10 CECE CCO[C@H](CC)[C@H](NN)c1ccc(N(C)C)cc1 2044754347 KEUKKAJZYFIGNP-ZIAGYGMSSA-N 251.374 2.072 10 10 CECE CCNCc1ccc(N(C)CCCOCCOC)cc1 2186302926 BHJATIBSLWWIJV-UHFFFAOYSA-N 280.412 2.285 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@]3(O)C2)cc1Cl 2051364740 ALMUYRQPVXOJFJ-RULNRJAQSA-N 267.756 2.354 10 10 CECE C[C@@H](COC(F)(F)F)NCc1cccc(O)c1O 2053143217 MCSMAIFSFAMAEA-ZETCQYMHSA-N 265.231 2.112 10 10 CECE Nc1ccc(CC(=O)Nc2ccc3c(c2)NCC3)cc1 2191756784 XKPDHIDLPMXSDO-UHFFFAOYSA-N 267.332 2.418 10 10 CECE [N-]=[N+]=NCCCCN1C[C@H](N)CC[C@H]1C(F)(F)F 2054254002 WBGOGAWOSGCEGV-BDAKNGLRSA-N 265.283 2.431 10 10 CECE CC[C@@H](c1ccccc1O)N1CC=C[C@@H](C(=O)O)C1 2103548405 DRSVCRFICQPYIE-YPMHNXCESA-N 261.321 2.416 10 10 CECE CC(C)[C@@]1(C)CC(=O)N1C(=O)CCc1ccc(N)cc1 2191889171 UNMSMOPTPVZNLP-MRXNPFEDSA-N 274.364 2.375 10 10 CECE CN1CCc2cc([C@@H]3N[C@H](C(=O)O)C(C)(C)S3)ccc21 2195329687 DKAPMBJJIYMMFG-CHWSQXEVSA-N 292.404 2.246 10 10 CECE C[C@H](NC[C@H]1[C@H]2OCC[C@H]12)c1ccc(F)cc1O 2056389411 QZCSKUUAEJPZHP-MBGOOHRESA-N 251.301 2.217 10 10 CECE CCN1[C@@H](C)CN(Cc2c(O)cccc2OC)C[C@H]1C 2186928474 XBXDLORMSDDIDP-BETUJISGSA-N 278.396 2.315 10 10 CECE CN[C@H](CC(COC)COC)c1ccc(N(C)C)cc1 2187440687 YUHJHIXBLRKFFF-MRXNPFEDSA-N 280.412 2.312 10 10 CECE C[C@H](Nc1cc(=N)[nH]n2ccnc12)c1ccccc1O 2192629584 SPSCITPYJNCRPI-VIFPVBQESA-N 269.308 2.021 10 10 CECE C[C@@H](Nc1ccc(N)cc1C(N)=O)c1ccccc1O 2192628839 QNVGRQUKUFFXFL-SECBINFHSA-N 271.320 2.246 10 10 CECE O=C(CSCCOC1CC1)c1ccc(O)c(O)c1 2070824325 QFAWPHMORWSHLS-UHFFFAOYSA-N 268.334 2.193 10 10 CECE OCc1ccc(N2C[C@H]3C[C@H]2CN3CC(F)(F)F)cc1 2188364160 NPMGJXZYCMMDFZ-OLZOCXBDSA-N 286.297 2.004 10 10 CECE C[C@H](N[C@H]1C[C@@H](CCO)C1)c1cc(F)ccc1O 2078421487 CFJQIQFPLPXIFC-JBLDHEPKSA-N 253.317 2.343 10 10 CECE NC[C@@]12CC[C@H]1CN(Cc1c(O)cccc1Cl)C2 2081584279 QXDKMDMKFKTYGB-IINYFYTJSA-N 266.772 2.216 10 10 CECE C[C@@H](CC1CC1)N(C)CC(=O)Nc1ccc(N)cc1 2101843044 IASBCBZLIQITPT-NSHDSACASA-N 261.369 2.328 10 10 CECE CCc1nc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])c(C)o1 2104311533 SMNAYJJAZQWHJQ-SECBINFHSA-N 263.301 2.460 10 10 CECE CNCc1ccc(N2C[C@H](N(C)C)CC2(C)C)cc1 2105427319 DOOOEPTWYKFTBH-OAHLLOKOSA-N 261.413 2.325 10 10 CECE CN1CCc2cc([C@H](N)C3(O)CC(C)(C)C3)ccc21 2106857191 HZSLVUIDXBCRBM-AWEZNQCLSA-N 260.381 2.230 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@@H]1C[C@@H](F)CN1 2106821087 QSYSFXJVVGHHLX-SNPRPXQTSA-N 264.344 2.020 10 10 CECE C[C@@]1([C@@H](O)c2ccc(N3CCCCC3)cc2)CCN1 2106834922 YRXWDIYOFMSGEH-HOTGVXAUSA-N 260.381 2.462 10 10 CECE C[C@@H](CN(C)[C@H](C)c1ccccc1O)CS(C)(=O)=O 2087105362 JZTQLIYMGPWKOB-NWDGAFQWSA-N 285.409 2.066 10 10 CECE CCS(=O)(=O)CCCN(C)[C@@H](C)c1ccccc1O 2087134817 SUEVLKWVMJRVNS-LBPRGKRZSA-N 285.409 2.210 10 10 CECE CN1CCc2cc([C@H]3N[C@@H](CC(F)F)CO3)ccc21 2088335436 WRSHLXHEKISUDS-FZMZJTMJSA-N 268.307 2.321 10 10 CECE CC[C@@H]1CCN1CCCC(=O)Nc1ccc(N)cc1 2088663031 VDIWEWAGQFVPFM-CQSZACIVSA-N 261.369 2.472 10 10 CECE Cc1cc(N2CC[C@H]3COCC[C@@H]32)ccc1CCN 2088751880 SYOJJWZGLHBSHL-HOCLYGCPSA-N 260.381 2.111 10 10 CECE CNCc1ccc(N2C[C@@]3(C)C[C@@]3(CO)C2)cc1Cl 2109163689 WWQUYVUBYFWULG-CABCVRRESA-N 280.799 2.268 10 10 CECE CCCOc1cnc(OCc2ccc(N)cc2)nc1 2109326987 HBJGNPAYOYMCOR-UHFFFAOYSA-N 259.309 2.427 10 10 CECE O[C@H](C[C@H]1CCN1)c1ccc(N2CCCCC2)cc1 2109421243 MSOUPTPQLMUPLI-GDBMZVCRSA-N 260.381 2.462 10 10 CECE NN[C@H](c1cc(F)c(F)c(F)c1)c1ccccc1O 2090036386 BVGJYQNOIMCHFY-CYBMUJFWSA-N 268.238 2.362 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@]3(CO)C2)cc1 2090122084 PCEHJAVBXNQQEX-GOEBONIOSA-N 260.381 2.005 10 10 CECE c1cc2c(cc1N1CC[C@H]3CCC[C@@H](C1)N3)CCO2 2110321722 JGUBGGGZRLIHBH-KGLIPLIRSA-N 258.365 2.342 10 10 CECE CN1CC[C@@H]2CCN(Cc3ccc(N)cc3)C[C@@H]2C1 2092511521 WZBWKBBJEYHPTE-CABCVRRESA-N 259.397 2.042 10 10 CECE COCCNCc1ccc(N2CC(C)(F)C2)cc1C 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271.360 2.472 10 10 CECE COc1cc(N)c(N2CCC[C@@H](OC)[C@H]2C)cc1OC 2155358270 RHHZMUHSYBTWCT-ZWNOBZJWSA-N 280.368 2.290 10 10 CECE CN(c1ccc(CN)cc1Br)C1CC(CO)C1 2018089816 HSYOWOHGLLOHGW-UHFFFAOYSA-N 299.212 2.115 10 10 CECE COCCOC[C@@H]1CCCN1c1ccc(CN)cc1C 2158954741 LUXZTRMHZFOKMG-HNNXBMFYSA-N 278.396 2.086 10 10 CECE Cc1nc(Cl)nc(Oc2ccc(N)cc2)c1N 2021666044 GYHVBIFQJQSDJJ-UHFFFAOYSA-N 250.689 2.395 10 10 CECE NCCCC1CN(Cc2cc(Br)ccc2O)C1 2022085985 SDEDEDDWAVOGOC-UHFFFAOYSA-N 299.212 2.325 10 10 CECE COc1cc(N2CCCSCC2)ccc1CN 2024763795 ZWQOVAYOFKYDLW-UHFFFAOYSA-N 252.383 2.097 10 10 CECE Oc1cc(F)ccc1CN[C@H]1CCCC2(C1)OCCO2 2024891424 XTZCPZRDZUOCNL-ZDUSSCGKSA-N 281.327 2.307 10 10 CECE CS[C@H]1COC[C@H]1NCc1ccc(Cl)cc1O 2026371390 MPRWXCMVTYHZOU-PWSUYJOCSA-N 273.785 2.266 10 10 CECE Oc1cc(F)ccc1CN1CCN2CCCC[C@@H]2C1 295350568 NEFOFOLRSWTWJO-CQSZACIVSA-N 264.344 2.201 10 10 CECE Oc1cccc(CNCc2cc(Cl)ccc2O)n1 2028022880 BZBIYTNKNCXATB-UHFFFAOYSA-N 264.712 2.436 10 10 CECE CN(C)c1ccc([C@@H]2N[C@@H](CC(F)F)CO2)cc1 2028007506 BJWKAZVGTJFTQR-GXFFZTMASA-N 256.296 2.395 10 10 CECE Oc1cccc(CNCC(F)(F)C(F)(F)F)c1O 2029188769 RDWXDNNKKQHXBE-UHFFFAOYSA-N 271.185 2.385 10 10 CECE C[C@@H]1CC[C@@H](CNCc2cc(F)ccc2O)N1C 2034200035 QXAAAGZNVPYEOW-MFKMUULPSA-N 252.333 2.104 10 10 CECE CCCN(CC(=O)N(C)C(C)C)c1ccc(N)cc1 63115978 MRLZBJIISRZKGG-UHFFFAOYSA-N 263.385 2.352 10 10 CECE CCN(C[C@](C)(O)C(F)(F)F)c1ccc(N)cc1 2038039902 YYIQCIQEJLIJLT-NSHDSACASA-N 262.275 2.408 10 10 CECE CN(C)c1ccc(C=CC(=O)NC[C@@H]2CCCOC2)cc1 2041588368 GYDTVBHEXZRWCY-HNNXBMFYSA-N 288.391 2.309 10 10 CECE COC[C@@](C)(O)CNCc1c(O)ccc2ccccc12 69912674 LPAUJFDLLFDZBF-INIZCTEOSA-N 275.348 2.032 10 10 CECE Cc1noc2ncnc(NCCc3ccc(N)cc3)c12 71194746 QZJVLXWLQIPDBC-UHFFFAOYSA-N 269.308 2.163 10 10 CECE COc1ccc(O)c(CN[C@H]2CC[C@H]3CC[C@H]2O3)c1 401663509 VWRMBBXQUHUXDX-CORIIIEPSA-N 263.337 2.200 10 10 CECE CNCc1ccc(N2CCN(C3CC3)C[C@H]2C)c(F)c1 402667553 ATMSUOUKKWMVAC-GFCCVEGCSA-N 277.387 2.218 10 10 CECE 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COc1ccc(O)c([C@H](C)N[C@H](C)C(C)(C)O)c1 393959087 AINGPSBXXHWXSR-VHSXEESVSA-N 253.342 2.211 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CC[C@H](O)C[C@H]3C2)cc1 398890348 ZFKHWJMDLFJIQB-PCBIJLKTSA-N 260.381 2.304 10 10 CECE CC[C@@H]1C[C@H](C)CN1S(=O)(=O)Cc1ccc(N)cc1 399491374 IBHVLOUEVSLYJX-SMDDNHRTSA-N 282.409 2.219 10 10 CECE CC(C)[C@H](C)CN(C)C[C@@H](O)COc1ccc(N)cc1 399463033 WAXCIHMEYURFHD-UKRRQHHQSA-N 280.412 2.232 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)c1cnco1 2177826937 PCXJFWQZFGJYLL-CABCVRRESA-N 275.352 2.125 10 10 CECE COc1ccc(N2CC[C@@](CO)(C(F)(F)F)C2)c(N)c1 2167682799 GSCCCDFXIZMRON-GFCCVEGCSA-N 290.285 2.029 10 10 CECE Cc1nn([C@@H](C)c2cc([N+](=O)[O-])ccc2O)cc1C(=O)O 2070240082 CYTRSFUCYIEMBH-QMMMGPOBSA-N 291.263 2.113 10 10 CECE CC[C@H](O)c1ccc(N(CC)[C@H](C)CS(C)(=O)=O)cc1 2170419834 IZOJKGUEGIDJAC-DOMZBBRYSA-N 299.436 2.389 10 10 CECE CCOC(=O)c1c(C(C)C)nn2c(O)cc(CC)nc12 2080845626 MKVPLGAEJQNZKA-UHFFFAOYSA-N 277.324 2.297 10 10 CECE 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COc1ccc(N(C)CC[C@@H]2CCOC2)c(CN)c1 2227683174 TXGYRFQAWGPRFP-GFCCVEGCSA-N 264.369 2.017 10 10 CECE COc1ccc(N(C)CCO)c(CNC(C)(C)C)c1 2227680178 SVIPANXZHLBAOQ-UHFFFAOYSA-N 266.385 2.012 10 10 CECE COc1ccc(N2CCC[C@](C)(OC)C2)c(CO)c1 2227709393 TVEONCBNLIBUNS-HNNXBMFYSA-N 265.353 2.193 10 10 CECE COc1ccc(N2C[C@H]3CCCC[C@@]3(CO)C2)c(N)c1 2239178725 SNRCYVJAOUZXNF-WBMJQRKESA-N 276.380 2.266 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCN(C(C)C)C(=O)C1 2240840312 QTDXPZZBLZUUIH-ZDUSSCGKSA-N 276.380 2.105 10 10 CECE CCC[C@H](N)CCNCc1cnc(SC)s1 2243844727 PLRSNMQSWJQTFO-VIFPVBQESA-N 259.444 2.472 10 10 CECE CC(C)C1CN(Cc2ccc(N3CCNCC3)cc2)C1 2286073380 MPPKXNULWMHQJU-UHFFFAOYSA-N 273.424 2.184 10 10 CECE CSc1ncc(CNCC[C@H]2CCCNC2)s1 2248740970 MOCNINVNGIOEEK-SNVBAGLBSA-N 271.455 2.344 10 10 CECE NC[C@@H]1CC(F)(F)CN1c1ccc(OC2CC2)cc1 2278995840 OUUYLNMWHXLYBW-NSHDSACASA-N 268.307 2.401 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@]3(CN)C2)c(C)c1C 2269170840 GQKZVSXFQLISAX-XJKSGUPXSA-N 260.381 2.487 10 10 CECE CSc1ncc(CNc2ncc(N)cc2C(=O)O)s1 2269226983 XVGFJFDSEQVWIM-UHFFFAOYSA-N 296.377 2.153 10 10 CECE CN[C@H](C)c1ccc(N2CCN(C)[C@@H]3C[C@H]32)cc1C 2269667892 BAHMYKIQSIIPKY-DAXOMENPSA-N 259.397 2.168 10 10 CECE Cc1cc(N2CC[C@H](O)C3(CC3)C2)ccc1[C@H](C)O 2269690017 PXVKWUSPHBEWIR-WFASDCNBSA-N 261.365 2.400 10 10 CECE CC1(C)C[C@H]1C[S@@](=O)CCC(=O)Nc1ccc(N)cc1 2279947790 IULQFQZHFBSWQO-YBTHPKLGSA-N 294.420 2.392 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCOC(C)(C)[C@@H]1CO 2282824098 CMNVKEARZUFWIJ-DOMZBBRYSA-N 279.380 2.024 10 10 CECE COc1cc(C)c(N2C[C@@H](O)[C@H](O)CC2(C)C)c(C)c1 2285066948 COAQKQCVZIEOHD-ZIAGYGMSSA-N 279.380 2.023 10 10 CECE Cc1cc(N(CCS(C)(=O)=O)C2CC2)ccc1[C@H](C)O 2285162925 IBOPFAFQODFHEW-LBPRGKRZSA-N 297.420 2.062 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@H](C)O)c(C)c2)C1 2285163000 IIRFPPZSBXXIJJ-QEJZJMRPSA-N 279.380 2.288 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H](C2)C3(C)O)cc1C 2286201887 DHYRWJLPVJCBDO-FKEKPDDDSA-N 274.408 2.312 10 10 CECE CCN1CCN(Cc2ccc(OC)cc2O)C(C)(C)C1 1203635498 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Cc1c([C@@H](C)O)ccc(N2CC(CN(C)C)C2)c1C 2340855039 CEQZKPPIYMAOHP-CYBMUJFWSA-N 262.397 2.355 10 10 CECE Cc1cccc(CN2C[C@@H]3C[C@H]2C[C@@H]3N(C)C)c1O 2341136986 VDRJRQIFLSOVPZ-KKUMJFAQSA-N 260.381 2.225 10 10 CECE COc1ccc(CN[C@H]2C[C@H]3C[C@@H]2C[C@H]3OC)c(O)c1 2354392405 CAXIMLGLZCACJS-UNIGVISCSA-N 277.364 2.304 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3N[C@@H]4CC[C@H]3C4)ccc21 2354609173 WZFVRCPFXUDJFZ-LBRJOISOSA-N 272.392 2.243 10 10 CECE CCCN(C(=O)[C@H]1[C@@H]2CCCO[C@@H]21)c1ccc(N)cc1 2355572289 VPHDLFCXFOTPEY-KKUMJFAQSA-N 274.364 2.437 10 10 CECE Cc1cc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)ccc1CNC1CC1 2355619806 SAQGYFGYWCKPOQ-JCURWCKSSA-N 272.392 2.207 10 10 CECE COC[C@H](C)N(C)C(=O)NCc1ccc(N(C)C)c(F)c1 57646915 SXOZCYDAEUSBOZ-NSHDSACASA-N 297.374 2.068 10 10 CECE COC[C@H](C)C(=O)NCc1c(O)ccc2c1CCCC2 174511948 NBFNQOCTDKYWOH-NSHDSACASA-N 277.364 2.170 10 10 CECE Cc1cc(NC(=O)/C=C/c2ccc(N(C)C)cc2)[nH]n1 111589610 MMWMJOXKGAOUJN-RMKNXTFCSA-N 270.336 2.436 10 10 CECE C[C@H](NCC1CCOCC1)c1cc(O)ccc1O 111155094 QOTXAWAYZLDBFU-JTQLQIEISA-N 251.326 2.175 10 10 CECE CN(Cc1cc2c(cc1O)CCC2)C[C@H]1CCOC1 176104336 ODMKMRWZLROEJN-GFCCVEGCSA-N 261.365 2.349 10 10 CECE COc1cc(N(C)Cc2cnn(C)c2)cc(OC)c1OC 125687040 HKBSYPVSYJXHES-UHFFFAOYSA-N 291.351 2.082 10 10 CECE C[C@@H](NCCC1(C)OCCO1)c1ccc(F)c(F)c1O 187918636 YDPDGBYIVRKECR-SECBINFHSA-N 287.306 2.474 10 10 CECE Nc1cccc(F)c1NC(=O)c1cccc(O)c1O 125975418 JNVILBKBWNBDRX-UHFFFAOYSA-N 262.240 2.071 10 10 CECE Nc1ccc(N2C(=O)[C@H]3Cc4ccccc4N3C2=O)cc1 37515063 SKUBEXDTGBWMPW-CQSZACIVSA-N 279.299 2.167 10 10 CECE c1cc2c(cc1CNCCCOC[C@H]1CCOC1)CCO2 77447678 BGXXPZATWMLHLB-OAHLLOKOSA-N 291.391 2.154 10 10 CECE CC(C)C[C@H](N[C@@H](C)c1ccc(O)cc1O)C(=O)O 43432070 AKNSEJKFLBNUEZ-CABZTGNLSA-N 267.325 2.248 10 10 CECE CN(C)[C@H]1CCN(Cc2cccc(Br)c2O)C1 134170289 DNDGSXPQQRZEHP-NSHDSACASA-N 299.212 2.291 10 10 CECE CCN(CC(=O)O)[C@@H](C)c1ccc(N(C)C)cc1 86775075 INIFHBWMKYWOOR-NSHDSACASA-N 250.342 2.220 10 10 CECE CC(C)n1nccc1NC(=O)CCOc1ccc(N)cc1 40296790 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Cc1cc(N2CC(C[S@@](C)=O)C2)ccc1CNC1CC1 2166654388 UXMBYUXJGVHMJQ-HXUWFJFHSA-N 292.448 2.062 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC([C@H](F)C(=O)O)C1 2166823862 PHVDBGUEMMJWPA-HZMBPMFUSA-N 280.343 2.168 10 10 CECE CN(Cc1ccccc1O)C(=O)c1cc(Cl)ncn1 723232569 OULKJZXYQIMGAF-UHFFFAOYSA-N 277.711 2.108 10 10 CECE CCN1C[C@H](N[C@H](C)c2cc(O)ccc2O)C(C)(C)C1 722294078 FCLXFCAHRDTORU-ABAIWWIYSA-N 278.396 2.479 10 10 CECE Cc1cc(CC(=O)NCCCO)c(C)n1-c1ccccc1 821345818 OEOHLPVNYQHKQT-UHFFFAOYSA-N 286.375 2.135 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@H]2CCCCN21 901055244 LBVBMYVLINBUME-HUUCEWRRSA-N 288.391 2.368 10 10 CECE CCN(C(=O)c1cc2cc(O)c(O)cc2s1)[C@@H](C)CO 908438736 HSPDXKRVHSDZHN-QMMMGPOBSA-N 295.360 2.155 10 10 CECE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@@H](O)C1CC1 838894861 KNQPFHMZSYEWHP-DOTOQJQBSA-N 291.391 2.144 10 10 CECE CCOC[C@H](C)N[C@@H](C)c1cccc(OC)c1O 846163969 KSSFTCKKDHGCLA-QWRGUYRKSA-N 253.342 2.476 10 10 CECE Nc1ccc(CCNC(=O)N2CC[C@@]3(C2)CC3(F)F)cc1 846172419 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2125525578 GHPWPZYWSVPONH-UHFFFAOYSA-N 280.324 2.165 10 10 CECE C[C@@H]1CN(c2ccc(OCC(F)F)cc2)C[C@H]1O 2219556677 VHPAEENHIQTYHC-BXKDBHETSA-N 257.280 2.148 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3N)[C@H]1CO 2128272867 TVRPSSROJWGZBT-RLCCDNCMSA-N 260.381 2.230 10 10 CECE CCN[C@@H]1CCc2cc(N3CC[C@](C)(O)C3)ccc21 2128296380 REGSJNWMRVPYGQ-CVEARBPZSA-N 260.381 2.245 10 10 CECE CO[C@@H](COC(=O)c1cccc(O)c1O)C1CCCC1 1329439056 INGJTIWSYTVZTF-ZDUSSCGKSA-N 280.320 2.460 10 10 CECE COCC1CCN(c2ccc3c(c2)CC[C@H]3N)CC1 2128310896 NKENGWDKJBHZBZ-MRXNPFEDSA-N 260.381 2.495 10 10 CECE CN(CCCc1ccc(N)cc1)[C@@H]1CCOC[C@H]1F 2130195207 JFXMCHQYJVTTTR-HUUCEWRRSA-N 266.360 2.260 10 10 CECE CC1(C)OCCC[C@@H]1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 2130458579 BYOGYUJUBNOQEG-WDEREUQCSA-N 266.345 2.350 10 10 CECE COCC(COC)C[C@H](N)c1ccc(N(C)C)cc1 2130888093 HEYJGEUPVPZNLP-HNNXBMFYSA-N 266.385 2.052 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)[C@@H]1C[C@@H]2CCC[C@@H]21 2132246082 PWLLMEJJDKLDIK-AEGPPILISA-N 258.365 2.458 10 10 CECE C[C@@H](N)c1ccc(N2CCN(C)C(C)(C)C2)c(F)c1 104131093 ALNMUMDKBQOGHI-LLVKDONJSA-N 265.376 2.376 10 10 CECE CC[C@@H]1C[C@@H]1CN(C)C(=O)COc1ccc(N)cc1 2135301155 NOMKFDUPBWMCHK-VXGBXAGGSA-N 262.353 2.152 10 10 CECE CC[C@H](NC)c1ccc(N2CCC(C(N)=O)CC2)cc1 234038402 GZQKMJCQHOLRFR-HNNXBMFYSA-N 275.396 2.059 10 10 CECE CN(C)c1ccc(C=CC(=O)NC(C)(C)CCO)cc1 1911986847 BCQWJUMUMJTVOQ-UHFFFAOYSA-N 276.380 2.043 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCN(C)[C@@H](C)C1 1911990131 INKJUQLFLLNGDK-ZDUSSCGKSA-N 274.364 2.233 10 10 CECE CCOC(=O)C[C@@H](C)N1CCC[C@@H](CN=[N+]=[N-])C1 1912155599 IQOIBBFUAOUJDJ-MNOVXSKESA-N 254.334 2.350 10 10 CECE CCOC(=O)C1(NCCN=[N+]=[N-])C[C@H]2[C@H](C1)C2(C)C 1912183956 VFYKSNIOOQKMEV-UWVGGRQHSA-N 266.345 2.254 10 10 CECE C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)N(C)CCCN=[N+]=[N-] 1912177672 KMIKWFYZAHLCEI-IJLUTSLNSA-N 267.377 2.407 10 10 CECE CC[C@@H](COC)CC(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912210624 LWRMHAFMHRAVCD-GHMZBOCLSA-N 254.334 2.350 10 10 CECE 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NC1(C2CN(Cc3cc(Br)ccc3O)C2)CC1 1924056673 OZKYIAMZGAISJU-UHFFFAOYSA-N 297.196 2.078 10 10 CECE COc1ccc(N(C)[C@H]2CNC[C@@]3(CCCO3)C2)cc1 1924313267 NXRHODFEQQQAJK-GDBMZVCRSA-N 276.380 2.043 10 10 CECE C[C@H](NCC(=O)N1CCCCC1)c1cc(F)ccc1O 228803737 KUDCLOVJQFCNIU-NSHDSACASA-N 280.343 2.194 10 10 CECE CC[C@@]1(F)CCN(c2ccc(CO)cc2[N+](=O)[O-])C1 1925577195 ANAADCUZGOLJLV-CYBMUJFWSA-N 268.288 2.416 10 10 CECE CC[C@@H](c1ccccc1O)N1CC[C@@H](NC(=O)OC)C1 229806405 KROAHSUEUDLSHR-YPMHNXCESA-N 278.352 2.274 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1C[C@H]1c1ccsc1 1635638451 POLYHXWBQKYIKB-NWDGAFQWSA-N 289.356 2.374 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCCCC(N)=O 230036231 YNZDIVHEXZSPOH-VXGBXAGGSA-N 276.380 2.494 10 10 CECE CN(CCO[C@H]1CC1(F)F)Cc1ccccc1O 851840360 DMVVSDQWSJSNPH-LBPRGKRZSA-N 257.280 2.248 10 10 CECE NCc1ccc(N2CC[C@@H](CCO)C2)c(Cl)c1 123002083 BBLCAYUMHFYBJB-JTQLQIEISA-N 254.761 2.007 10 10 CECE O=C(O)CCC(=O)O[C@H](CCCN=NO)c1cccnc1 1848438288 YJOPBYFJRIWXFD-LLVKDONJSA-N 295.295 2.152 10 10 CECE C[C@H]1C[C@@H](NC(=O)Cc2ccc(O)c(O)c2)CCS1 1653138675 CPIYAVBQHXCWSN-ONGXEEELSA-N 281.377 2.041 10 10 CECE C[C@H]1C[C@H](C(=O)O)CCN1Cc1ccc(F)cc1O 2139767145 HYMIUJWZMVCHDF-VHSXEESVSA-N 267.300 2.216 10 10 CECE C[C@@H]1CC=C(C(=O)NCc2cc(O)ccc2O)CC1 1593881362 IOIAXYYAEWRXPK-SNVBAGLBSA-N 261.321 2.460 10 10 CECE CCOCCN(CC)c1ccc(CNC)c(OC)c1 2139697336 UBSRAQBUOXFGQR-UHFFFAOYSA-N 266.385 2.277 10 10 CECE C[C@H](CN(Cc1ccc(F)cc1O)C1CC1)C(=O)O 2139775072 FSOPZTUPQRDECF-SECBINFHSA-N 267.300 2.216 10 10 CECE CCN(C(=O)CN1CCc2cc([C@H](C)N)ccc21)C1CC1 162104383 LHCOOUNFRPUUTL-LBPRGKRZSA-N 287.407 2.080 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1C[C@H]2CC[C@@H]1O2 152850354 YDTOCJLMXUXRIZ-WLTAIBSBSA-N 253.729 2.455 10 10 CECE CCOC1CCN(c2ccc([N+](=O)[O-])c(CO)c2)CC1 233719740 RVVYEQAPYXZLPM-UHFFFAOYSA-N 280.324 2.092 10 10 CECE CC(C)[C@@](N)(CCCSc1nccs1)C(=O)O 1940640195 GVMQULGSMHVCNR-NSHDSACASA-N 274.411 2.454 10 10 CECE C[C@H]1C(=O)N(c2ccc(N)c(C(F)(F)F)c2)C(=O)[C@@H]1C 235443275 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2.215 10 10 CECE C[C@H]1OCC[C@H]1CCNCc1c(O)cccc1F 1972148869 XEHKMOIWJYSATC-GHMZBOCLSA-N 253.317 2.436 10 10 CECE CN(Cc1cc(F)ccc1O)CC(C)(C)C(=O)O 1972164716 NTABUIMCAJWJAF-UHFFFAOYSA-N 255.289 2.074 10 10 CECE Oc1c(CNCC23CCC(CC2)O3)ccc(F)c1F 1973098730 YCWXXZZABLQHIF-UHFFFAOYSA-N 269.291 2.472 10 10 CECE CC1(C)CN(c2ccc(CN)cc2C(F)(F)F)[C@H]1CO 2148954073 VNEWZAFERCAVRA-LBPRGKRZSA-N 288.313 2.371 10 10 CECE Oc1cccc(Cl)c1CNC[C@@H]1C[C@H]2COCC[C@@H]2O1 2148971410 BRINKIRCJLINIZ-PGUXBMHVSA-N 297.782 2.329 10 10 CECE NC1(c2ccc(N3CCOCC3)c(F)c2)CCCC1 258544047 VSVRMDMOYUYUIQ-UHFFFAOYSA-N 264.344 2.390 10 10 CECE C[S@@](=O)(=NCCCN=[N+]=[N-])c1cccc(N)c1 2006177542 RQEBTLWZMIDSAS-KRWDZBQOSA-N 253.331 2.426 10 10 CECE C[C@H](CC(N)=O)N(C)c1ccc(C=CC(=O)O)c(Cl)c1 2151338931 SQWBFOAIUACBAE-SECBINFHSA-N 296.754 2.138 10 10 CECE COC(=O)C[C@@H](N)c1c(C(C)C)ccc(OC)c1O 260278710 MCLZTORCGUQYKU-SNVBAGLBSA-N 267.325 2.087 10 10 CECE Nc1ccc(CCC(=O)NCCCOCC2CC2)cc1 158111893 IQDQGUBATWVLIN-UHFFFAOYSA-N 276.380 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10 10 CECE CC(C)(C)C[C@H](CO)NCc1cccc(F)c1O 393527489 USWLNOZFFDACNG-LLVKDONJSA-N 255.333 2.418 10 10 CECE COC[C@H](N[C@@H](C)c1ccc(OC)cc1O)C1CC1 397361712 MANPRRADQPLROI-HZMBPMFUSA-N 265.353 2.476 10 10 CECE Cc1cc(O)n2ncc(C(=O)N[C@@H](C)C3CCCC3)c2n1 2062393756 JUCXZIHISKDIMH-JTQLQIEISA-N 288.351 2.052 10 10 CECE CC[C@H](C(=O)N(C)Cc1ccccc1O)n1ccnc1 2062562429 SCTAVHWSBYRKBH-CYBMUJFWSA-N 273.336 2.198 10 10 CECE CCCNCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]32)c(F)c1 2178171042 ZONSPGMMGUHEEG-RCBQFDQVSA-N 278.371 2.285 10 10 CECE C[C@H](Cc1ccnn1C)NCc1ccc(N(C)C)cc1 2174323205 UURAFGMEYFFKQA-CYBMUJFWSA-N 272.396 2.207 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@H](CN)CC12CCC2 2174633222 IHAFGFKXQOQMME-NEPJUHHUSA-N 276.380 2.362 10 10 CECE CC1(C)COc2ccc(N3C[C@H]4CCNC[C@@H]4C3)cc21 2168778172 HIQCSEXNFQCKFI-CHWSQXEVSA-N 272.392 2.402 10 10 CECE Nc1ccc(CCOCC(=O)NC2CCCCC2)cc1 2176289604 FZIVZJIXEMLSHQ-UHFFFAOYSA-N 276.380 2.277 10 10 CECE C[C@@H](N)c1ccc(N2CC=C[C@H]2CO)cc1C(F)(F)F 2176345202 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COc1ccc(N(C)C[C@H](OC)C2CC2)c(CO)c1 2227708754 LXLWJXNEYVGYNI-HNNXBMFYSA-N 265.353 2.049 10 10 CECE COc1ccc(N2CC[C@H]3COCC[C@@H]32)c(C=O)c1 2227709163 QRUXLNNGHDGYCE-NHYWBVRUSA-N 261.321 2.123 10 10 CECE C[C@@H]1CC[C@H]1CN(C)CC(=O)c1ccc(O)c(O)c1 2227876388 ANTDVHUJTAZNOZ-PWSUYJOCSA-N 263.337 2.258 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CCCc2scnc21 2238100562 QTLKZZXLEYPYKT-UKRRQHHQSA-N 290.388 2.333 10 10 CECE CN(CC1(Cl)CC1)C(=O)CCOc1ccc(N)cc1 2229666097 UOIBFEFTTXBGSG-UHFFFAOYSA-N 282.771 2.268 10 10 CECE CCOc1ncc([C@H](O)[C@@H](NC)c2ccccc2O)s1 2239774063 VBRMKLGMQHOIHI-STQMWFEESA-N 294.376 2.242 10 10 CECE Oc1cccc(F)c1CNC[C@H](F)C1CCOCC1 2229966948 SKSVECRJFXDSCE-ZDUSSCGKSA-N 271.307 2.386 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCC[C@H]1C(=O)N(C)C 2240840667 WQNVQABOKOMDTK-WFASDCNBSA-N 276.380 2.105 10 10 CECE CSc1ncc(CN=c2ccnc(Cl)[nH]2)s1 2243834149 ZKQOOYYXOMKCCA-UHFFFAOYSA-N 272.786 2.342 10 10 CECE CSc1ncc(CNC(=O)C[C@H](CN)C(C)C)s1 2257013725 LUAGDZPUPVBRFT-SECBINFHSA-N 287.454 2.102 10 10 CECE C[C@H](N)c1ccc(N2CC(P(C)(C)=O)C2)cc1O 2258272168 DMNMJMVROWMNGM-VIFPVBQESA-N 268.297 2.223 10 10 CECE Nc1ccc(CNCc2nc(C3CC3)ns2)cc1 2259604983 DKVSBAQQZJAGIE-UHFFFAOYSA-N 260.366 2.288 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1ccc2c(c1)OCCCO2 2273248157 ANPAACMTFVZETC-STQMWFEESA-N 263.337 2.198 10 10 CECE CN[C@H](C)c1ccc(N2CCC=C[C@@]2(C)CO)cc1O 2279063986 MIJHALMEUGHVMQ-WBMJQRKESA-N 276.380 2.190 10 10 CECE CN[C@@H](C)c1ccc(N2CCC=C[C@@]2(C)CO)cc1O 2279063984 MIJHALMEUGHVMQ-LRDDRELGSA-N 276.380 2.190 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H]3CNC(=O)[C@@H]32)cc1Cl 2279280609 MOKUKIHZTXGSLN-PKFCDNJMSA-N 293.798 2.075 10 10 CECE Cc1cc(N2C[C@H]3[C@H](O)CC[C@H]3C2)ccc1[C@H](C)O 2269680242 YKBMROBSPSBKSV-YXAMBPQSSA-N 261.365 2.255 10 10 CECE Nc1ccc(OCCNC(=O)[C@H]2CCCC2(F)F)cc1 327763446 OMFPBNKRMMVVSB-GFCCVEGCSA-N 284.306 2.199 10 10 CECE Cc1cc(N2CCc3ncn(C)c3C2)ccc1[C@H](C)N 2285122513 UHBPJMXSZOYYAN-LBPRGKRZSA-N 270.380 2.311 10 10 CECE CCc1ccnc(NC(=O)COc2ccc(N)cc2)c1 2295793230 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CECE COc1ccc([C@H](C)N[C@H]2C[C@@H]3OCC[C@H]23)c(O)c1 2328822026 OMQVBNHJWZPQSD-AETLKFDBSA-N 263.337 2.229 10 10 CECE C[C@H]1Cc2cc(N3C[C@@H]4CCNC[C@@H]4C3)ccc2O1 2330079314 NTCBGKGNQJDUSP-SGMGOOAPSA-N 258.365 2.056 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@H]1[C@@H]2CCO[C@@H]21 2330682372 UVWYUAOPGXLZFC-JJXSEGSLSA-N 259.349 2.355 10 10 CECE C[C@@H](O[C@H]1CC[C@@H]2C[C@H]12)C(=O)Nc1ccc(N)cc1 2333329859 CKJAEOLZBHFJGS-JYILRKAJSA-N 260.337 2.411 10 10 CECE Oc1cccc(CNC[C@@H]2CC[C@@H]3C[C@H]2CO3)c1O 2334064023 IDRUUUAAAGFOQA-WCFLWFBJSA-N 263.337 2.003 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC(F)(F)[C@](C)(N)C2)c1 2336779575 ZTEDHXREMUEVIE-GXFFZTMASA-N 270.323 2.430 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1CN2c1c(F)cc(CN)cc1F 2340782862 JKXUBFMWKBRZHD-CWSCBRNRSA-N 268.307 2.037 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC=CC[C@H]2CO)c1C 2341061194 DVWLXSUXXWIBJF-KBPBESRZSA-N 260.381 2.450 10 10 CECE COc1cc(Cl)c(N(C)[C@H]2CNC[C@@H]2F)c(OC)c1 2343621547 IQSCXDFTQPQFCJ-QWRGUYRKSA-N 288.750 2.103 10 10 CECE 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CECE CN[C@@](C)(CCCCSc1nccs1)C(=O)O 45596394 UFGGGKRNPOIRNP-NSHDSACASA-N 274.411 2.468 10 10 CECE C[C@H]1[C@@H](C)SCCN1CC(=O)c1ccc(O)c(O)c1 133243684 DAFTUTJITOKEST-VHSXEESVSA-N 281.377 2.106 10 10 CECE COc1ccc(CN(CCC(=O)O)C(C)C)c(O)c1 86748093 AHVUUBWWPZYIJY-UHFFFAOYSA-N 267.325 2.086 10 10 CECE C[C@H](OC(=O)CCc1ccc(N)cc1)C(=O)NC(C)(C)C 41101764 LVTDNKVWPKRJET-NSHDSACASA-N 292.379 2.048 10 10 CECE COc1ccc(CN2C[C@H](C)OC[C@H]2C)c(O)c1 132198944 TUVTVFUQWYCVJH-MNOVXSKESA-N 251.326 2.010 10 10 CECE CC(C)/C=C/C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 194848437 VWKCLWQJNKKFEO-TZOMUSMUSA-N 263.337 2.357 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1CCc2ccccc21 230456003 KVHCCEMGJMXODN-UHFFFAOYSA-N 269.300 2.230 10 10 CECE CCc1nn(C)c(NCCc2ccc(N)cc2)c1[N+](=O)[O-] 91576379 UYAXHGQLPBSHHG-UHFFFAOYSA-N 289.339 2.128 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)[C@@H]1CCCNC1 94621925 OZOYCPRIMMAUMF-CMPLNLGQSA-N 252.333 2.276 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCC[C@@H]1C(=O)O 235494350 GUXCXBYCUDJJRI-VHSXEESVSA-N 265.309 2.098 10 10 CECE CN(Cc1cc(Br)ccc1O)C[C@H]1CCCN1 234328688 XKHBDSSCRUCVGB-GFCCVEGCSA-N 299.212 2.339 10 10 CECE COC[C@H](C)N(C)[C@H](CN)c1ccc2c(c1)CCCN2C 250973893 GFVXTIXLIWFKNR-SUMWQHHRSA-N 291.439 2.036 10 10 CECE Cn1ccc2c(Cl)c3c(cc21)[C@H](C(=O)O)CNC3 606601130 NEOAPFOGLLYHOF-SNVBAGLBSA-N 264.712 2.103 10 10 CECE CC(C)(N)c1c(F)cc(O)c(O)c1Br 258429403 MNPBUUAQZJTOHK-UHFFFAOYSA-N 264.094 2.193 10 10 CECE CC[C@H]1CN(Cc2ccccc2O)C[C@]2(CCOC2)O1 373483714 VUEYXNMJDVPQFJ-HOCLYGCPSA-N 277.364 2.162 10 10 CECE CC(=O)C(=O)COC(=O)c1cc(Br)ccc1C 808521158 IZIKLTIQXXMEAU-UHFFFAOYSA-N 299.120 2.072 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@](C)(C(N)=O)C(C)C)c1 382186348 MTQNLKPVFMGVFB-XHDPSFHLSA-N 264.369 2.251 10 10 CECE CCO[C@H]1C[C@H](OC)CN(c2ccc(CNC)cc2)C1 2165458215 SHMFARKXHHNFLL-HOTGVXAUSA-N 278.396 2.036 10 10 CECE Cc1cnc(CNCc2ccc(O)c(O)c2O)c(C)c1 724058544 XWTHGLDKFOQTSQ-UHFFFAOYSA-N 274.320 2.105 10 10 CECE Cc1cc(O)c(CNC[C@@H](CO)c2cccnc2)cc1C 808429973 AKFITDRNYHGFLQ-INIZCTEOSA-N 286.375 2.270 10 10 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2.382 10 10 CECE COC[C@@H]1CCCN(Cc2ccc(OC)cc2O)C1 93338121 YOBCARSGAQEXJX-GFCCVEGCSA-N 265.353 2.259 10 10 CECE CCc1nc(O)c(C(=O)NCc2ccccc2O)cc1C 1150536256 MQBNSRNUUXTSBF-UHFFFAOYSA-N 286.331 2.294 10 10 CECE COc1ccc(CN[C@@H]2CCC[C@@H]2CCO)c(O)c1 189958937 GSVABUNVKZZXOJ-BXUZGUMPSA-N 265.353 2.042 10 10 CECE Cc1ccc(O)c(CNC(=O)c2ccc3nc(O)oc3c2)c1 1301046922 NVARUDPPVATXEX-UHFFFAOYSA-N 298.298 2.477 10 10 CECE Cc1nnc(CN(C)c2ccc([C@H](C)N)cc2F)o1 2115183675 QDVXZBDWWHECDM-QMMMGPOBSA-N 264.304 2.173 10 10 CECE CO[C@H]1CN(CCc2ccc(N)cc2)CC(F)(F)C1 2128725805 UQFBLWNAGCBNRX-CYBMUJFWSA-N 270.323 2.167 10 10 CECE C[C@](O)(c1ncccc1Cl)[C@@H](N)c1ccccc1O 2120056630 HDTWDOFXUPNMED-GXTWGEPZSA-N 278.739 2.348 10 10 CECE CN(C)[C@H]1CCCN(c2cc(Cl)c(CN)cc2F)C1 2120879315 JWVSNWFHQPZDEZ-NSHDSACASA-N 285.794 2.468 10 10 CECE CCn1c(C)cc(C(=O)NCc2cc(O)ccc2O)c1C 1176748545 WFEOCZKSOYQQDB-UHFFFAOYSA-N 288.347 2.466 10 10 CECE CN1CCc2cc([C@@H](N)[C@](C)(O)C(C)(F)F)ccc21 2122331375 PGNRCRMAIURIHE-OLZOCXBDSA-N 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Cc1cc(NS(=O)(=O)C[C@H](C)C2CC2)ccc1O 2027622447 DBIYQDOHMHJRIX-JTQLQIEISA-N 269.366 2.488 10 10 CECE CON(C)C1CN(c2ccc([C@H](C)N)c(Cl)c2)C1 2028070836 HFHRQKSJOHRYGS-VIFPVBQESA-N 269.776 2.042 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2C[C@@]23CCOC3)cc1O 2156767156 GZQCRXHTOQCIHD-MQIPJXDCSA-N 277.364 2.308 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1Cl 2029636043 PHRQFNMHOGLOMK-RBZYPMLTSA-N 267.756 2.212 10 10 CECE COc1ccc(CNCCc2nncs2)cc1C 2033511256 JHUFRLLSLYOQMA-UHFFFAOYSA-N 263.366 2.187 10 10 CECE C[C@H](O)c1ccc(N2CC3(CN(C)C3)C2)cc1Cl 2034805097 PABVVQLCWSQUQY-JTQLQIEISA-N 266.772 2.145 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)[C@H]1CC12CCC2 2035809089 WFIULPVECHEIQW-LBPRGKRZSA-N 267.350 2.385 10 10 CECE CC1(C)OCCC[C@H]1NCc1cccc(O)c1O 2036259364 WPPLCQBJMJNVOF-GFCCVEGCSA-N 251.326 2.145 10 10 CECE Cc1cc(Cl)ccc1N1N=C(C(=O)O)[C@H](C)C1=O 2037176118 AJGFJGDISYVESK-ZETCQYMHSA-N 266.684 2.072 10 10 CECE Oc1ccc(F)cc1CNCCn1cc(Cl)cn1 310940636 WANIZVFMVSZHOJ-UHFFFAOYSA-N 269.707 2.171 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])C1(SC)CCC1 311573460 RMLCUTSHBWFBMG-JTQLQIEISA-N 286.401 2.494 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@H]2CC(=O)NC3)c(Cl)c1 2159725357 LEAUOOPVEWGRDV-RYUDHWBXSA-N 293.798 2.046 10 10 CECE COc1cccc(O)c1CN1CC(C)(C)C[C@H](N)[C@@H]1C 2160734184 RXAWRKYSOHTSHL-AAEUAGOBSA-N 278.396 2.349 10 10 CECE Nc1ccc(O)c(CN2CCC(n3cccn3)CC2)c1 2170679501 JERBWVNHRLTNIT-UHFFFAOYSA-N 272.352 2.008 10 10 CECE CCNCc1cc(F)c(N(C2CC2)C2COC2)c(F)c1 2161351556 SHOFIWMYYPFFGX-UHFFFAOYSA-N 282.334 2.442 10 10 CECE C[C@]1(C(F)(F)F)C[C@H]1NC(=O)COc1ccc(N)cc1 2161755975 NXHCUADDGHNALL-PWSUYJOCSA-N 288.269 2.105 10 10 CECE Oc1c(CN[C@@H]2CC23CCOCC3)ccc(F)c1F 703257455 PRZRUHOOKIMQBZ-LLVKDONJSA-N 269.291 2.329 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H](C)C[C@H]1OC 2162130569 LPJHGEZQBKSGRI-WZRBSPASSA-N 284.360 2.023 10 10 CECE Oc1cccc(Br)c1CNC[C@@]12COC[C@@H]1C2 706845266 ZPDNIJRUIOVTKE-ZANVPECISA-N 298.180 2.281 10 10 CECE CCC[C@H]1COC[C@@H]1NCc1cc2c(cc1O)OCO2 699474973 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MPBVLLULEMHQEH-UHFFFAOYSA-N 256.296 2.125 10 10 CECE CCNCc1ccc(N(C)C[C@]2(C)COCCO2)cc1 2174267399 UDARNKCOVDYWTR-MRXNPFEDSA-N 278.396 2.038 10 10 CECE CCN1CCN(C(=O)Nc2ccc(N)cc2)C(C)(C)C1 2175037047 PAHBVQQZPKOXMX-UHFFFAOYSA-N 276.384 2.217 10 10 CECE C[C@H]1CN(CCCc2ccc(N)cc2)CC[C@H]1C(=O)O 2179661936 KIFUUTBTTOZLAT-SWLSCSKDSA-N 276.380 2.244 10 10 CECE COc1ccc([C@@H](C)N[C@H](CO)c2cscn2)c(O)c1 2175638969 MOLWYUJNLPCUKJ-BXKDBHETSA-N 294.376 2.242 10 10 CECE CC[C@H](C(F)F)N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 2178792445 YJDLMZDIJKCONU-ZYHUDNBSSA-N 284.306 2.176 10 10 CECE CNCc1ccc(N2CCNC(=O)[C@H]2C(C)C)cc1Cl 2170045768 RIOQZPDHJOGKLK-CQSZACIVSA-N 295.814 2.020 10 10 CECE NCc1cc(F)c(N2CCC[C@H]3COCC[C@H]32)c(F)c1 2170284290 SMFYHTLGNSSSOG-SMDDNHRTSA-N 282.334 2.429 10 10 CECE C[C@@H](N)c1ccc(N2CC3(CO)CCC2CC3)cc1O 2178888072 RCWFJOQABXDMPE-OPGSHWCFSA-N 276.380 2.153 10 10 CECE C[C@]12CN(C(=O)c3ccc(O)c(O)c3)CC[C@H]1C2(F)F 2187912904 SUQJAIYIRBOYPO-YPMHNXCESA-N 283.274 2.215 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@@H]2CC[C@H](C1)O2 2181368947 NIKLFYNSKPQZEV-XMQYKBBCSA-N 274.364 2.185 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2CC1[C@H]2COC[C@H]12 2188898159 RVZZHVUQDYQJGF-HFBAOOFYSA-N 272.392 2.222 10 10 CECE COC(=O)[C@H]1CC[C@H](COCCc2ccc(N)cc2)C1 2181828585 QQCWOHWKNYYYMH-KBPBESRZSA-N 277.364 2.417 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@]12C[C@H](CCO1)C2 2193668460 FBCKLNSWQHYNEX-KDYLLFBJSA-N 272.392 2.467 10 10 CECE CNCc1ccc(N(C)C2CC(n3cccn3)C2)cc1 2182201517 AKMJXYRQSHFZLC-UHFFFAOYSA-N 270.380 2.442 10 10 CECE CCOc1cccc(CN2CCC23CC(CN)C3)c1O 2182206537 DBLUHRKBHCEGFP-UHFFFAOYSA-N 276.380 2.104 10 10 CECE CO[C@H]1CCC[C@@H](C(=O)N(C)Cc2ccc(N)cc2)C1 2182765806 UIBFTLKJUJNEAK-HIFRSBDPSA-N 276.380 2.432 10 10 CECE O[C@H]1CCc2cc(N3C[C@]45CC[C@]4(COC5)C3)ccc21 2184739591 JBMRYZKLAPPKOF-YESZJQIVSA-N 271.360 2.283 10 10 CECE CC(=O)c1cnc(Sc2ncnc3[nH]cnc23)s1 2041817871 UQUIENBIPGHMDI-UHFFFAOYSA-N 277.334 2.163 10 10 CECE COc1cccc(O)c1CN[C@H](C)C(C)(C)OC 2042581917 XFAIJODOWJCEFY-SNVBAGLBSA-N 253.342 2.304 10 10 CECE CC[C@@H]1CNCCCN1c1ccc(OC)c(F)c1 2044304569 JGNADNWWWAZDCI-LLVKDONJSA-N 252.333 2.413 10 10 CECE COc1ccc(N2CC[C@@H](CN)C[C@H]2C)c(F)c1 2044337794 BAUVDHFWPGOUSR-GHMZBOCLSA-N 252.333 2.398 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@]3(O)C2)c(Cl)c1 2051367947 VQIFLZAZGZBCSM-UDZFHETQSA-N 266.772 2.321 10 10 CECE C[C@@H](N)c1ccc(N2CCCC(C)(C)[C@H]2CO)cc1O 2185811234 LBYHCBASKYHFKR-IAQYHMDHSA-N 278.396 2.399 10 10 CECE CC[C@@H](N)CN(CC)[C@@H](C)c1c(O)cccc1O 2053103092 VWJOWPQOIFQJNG-WDEREUQCSA-N 252.358 2.218 10 10 CECE CN(CCN=[N+]=[N-])CCC(=O)N1CCCCCC1 2053474216 CTHKMJKTZCYWQX-UHFFFAOYSA-N 253.350 2.021 10 10 CECE C[C@@H](O)c1ccc(N2CC([N+](=O)[O-])C2)cc1C(F)(F)F 2191516703 LAUNMLLIXWTPJD-SSDOTTSWSA-N 290.241 2.224 10 10 CECE C[C@H]1CCC[C@H]1S(=O)(=O)NCC1(CN=[N+]=[N-])CC1 2055209709 KUMGHUPFKHNABY-VHSXEESVSA-N 272.374 2.185 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)[C@@H]1CCCC[C@H]1F 2055325109 MDVMAXRGLWIAKI-NXEZZACHSA-N 278.353 2.277 10 10 CECE Cc1cc(N2CCNCC2)ccc1OC[C@@H](C)F 2056768301 XEHZZFOMYJUCGE-GFCCVEGCSA-N 252.333 2.141 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@]12CC[C@@H](CO1)C2 2199238703 DQSNJIBTDUDGFZ-OZVIIMIRSA-N 275.348 2.481 10 10 CECE CCC[C@@H](C(=O)O)N1CCc2cc(OC)c(OC)cc21 2195425613 IKRGJIDXKIVDGT-NSHDSACASA-N 279.336 2.320 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCOC[C@H]2CF)c1 2062340929 XNHJICOWCULPNH-VXGBXAGGSA-N 253.317 2.432 10 10 CECE CN(c1ccc2c(c1)OCCO2)[C@@H]1CCC[C@H]1CN 2106334940 CXLHBAMMOWAXRX-WCQYABFASA-N 262.353 2.021 10 10 CECE Cc1nccc(CN2CCc3cc(N(C)C)ccc32)n1 2196006174 CTIBFVFDINBGEP-UHFFFAOYSA-N 268.364 2.414 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ncc(C(=O)O)cn1 2192592814 UQCWTCVAZCCGQD-VIFPVBQESA-N 273.292 2.078 10 10 CECE CN(CCOc1cccc(N)c1)Cc1ccccc1O 2192569627 IBYMWZNSACPROP-UHFFFAOYSA-N 272.348 2.485 10 10 CECE CCCN(C)C1CN(c2ccc([C@@H](C)NC)c(O)c2)C1 2192549732 WWAVZVPPYCGBLV-GFCCVEGCSA-N 277.412 2.203 10 10 CECE C[C@@H]1CCCN[C@H]1CC(=O)N(C)Cc1ccccc1O 2192569651 IGAUCFXZGQDGBA-OCCSQVGLSA-N 276.380 2.129 10 10 CECE Oc1cc(Cl)ccc1CN[C@H]1CCN2CC[C@H]1C2 2072655981 KDPSAGMIYIQDCS-AAEUAGOBSA-N 266.772 2.229 10 10 CECE CC[C@H]1CC[C@@H](CNC(=O)CCc2ccc(N)cc2)O1 2201430460 RETWHTNMWLPZRC-GJZGRUSLSA-N 276.380 2.275 10 10 CECE Nc1ccc(CCCO[C@H]2CCOC[C@H]2F)cc1 2076365474 FBWFMNVDSVQDNE-KGLIPLIRSA-N 253.317 2.345 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CC[C@H](O)CC2)cc1O 2103873310 XBHDZSQTVOQXEJ-GVXVVHGQSA-N 264.369 2.152 10 10 CECE NC[C@@H]1CCCN(c2ccc3c(c2)OCCCO3)C1 2106331860 OUIJBQSKJSWNJD-LBPRGKRZSA-N 262.353 2.023 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H]3CCCNC3)ccc21 2106797178 XZURCNHJZRSRPN-BLLLJJGKSA-N 260.381 2.102 10 10 CECE CCNC[C@@H](C)[C@H](O)c1ccc2c(c1)CCN2CC 2106792280 BFTCVODNCXVEAF-WBMJQRKESA-N 262.397 2.348 10 10 CECE CCN[C@@H](c1cn[nH]c1)c1ccc2c(c1)CCN2C 2106795343 GMKGJEZUBMSCRE-OAHLLOKOSA-N 256.353 2.101 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CCCNC3)ccc21 2106801260 MPQPXCNRVAQGHL-ZBFHGGJFSA-N 260.381 2.102 10 10 CECE CCN(CC)c1ccc([C@]2(N)C[C@@H]3COC[C@@H]32)cc1 2106828748 PZSUOFFRBRPIDJ-UHOFOFEASA-N 260.381 2.353 10 10 CECE CC[C@H](C)[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2CC 2106854382 CKKWCFDKLMWFRR-KNXALSJPSA-N 262.397 2.476 10 10 CECE Cc1nscc1[C@@H](O)[C@@H](N)c1ccc(N(C)C)cc1 2106853287 PDCNCMQMBWPGIF-UONOGXRCSA-N 277.393 2.251 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)c1cnsn1 2106854930 IWGVHYQHHMTXBX-CQSZACIVSA-N 274.393 2.229 10 10 CECE CN1CCc2cc([C@H](N)[C@@](C)(O)C3(Cl)CC3)ccc21 2106852484 GJEXZXBTBSKNNL-UONOGXRCSA-N 280.799 2.201 10 10 CECE O=C(O)[C@@H]1[C@H]2CC[C@H]1N(Cc1ccc(Cl)cc1O)C2 2107506100 RNSZEAAZZAZUSV-UFGOTCBOSA-N 281.739 2.341 10 10 CECE COc1cccc(CN[C@H]2CCCC[C@H]2OC)c1O 2088262541 UCBSMDQGDHMWTA-QWHCGFSZSA-N 265.353 2.448 10 10 CECE O=S(=O)(C[C@H]1C[C@@H]1C(F)(F)F)Nc1ccc(O)cc1 2108369069 MGAALEJXRDQYMA-XCBNKYQSSA-N 295.282 2.332 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](O)[C@H](F)C2)cc1 2088302394 VQLQLSPFTGQHPB-CABCVRRESA-N 266.360 2.094 10 10 CECE COc1ccc(O)c(CNC[C@@H]2CCCOCC2)c1 2089047798 LKJWXPBYTWLIGW-GFCCVEGCSA-N 265.353 2.307 10 10 CECE 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2.074 10 10 CECE NCc1ncc([C@H](O)c2ccc(N3CCCC3)cc2)s1 2163103178 QTHYBSPLZUOSMO-OAHLLOKOSA-N 289.404 2.284 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)[C@]3(C)CC3(C)C)ccc21 2163141438 UQSCCVJHBMQGKJ-ZOBUZTSGSA-N 274.408 2.476 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H](O)c1ccncc1 2163147849 QLONTERMECLPEL-HOTGVXAUSA-N 271.364 2.142 10 10 CECE C[C@@H]1OC(=O)N[C@H]1c1cc(Br)ccc1O 396749147 OTTSEZROUQMTLQ-SSDLBLMSSA-N 272.098 2.324 10 10 CECE CN(C[C@H]1CC(C)(C)CO1)C(=O)Cc1ccc(N)cc1 2166218639 YVLABVYZMOBHOQ-CQSZACIVSA-N 276.380 2.085 10 10 CECE C[C@@H](CCN(C)c1ccc2c(c1)NC(=O)[C@H]2O)C(F)F 2166590155 FMLLQBCHBWQELZ-UFBFGSQYSA-N 284.306 2.400 10 10 CECE CC(=O)C(=O)COC(=O)c1cccc(C(F)(F)F)c1F 808524651 BHIGAXDVEXVXIG-UHFFFAOYSA-N 292.184 2.159 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@H](O)c2cnsn2)cc1 2167134599 WKOYANGGMBYIJG-UONOGXRCSA-N 292.408 2.118 10 10 CECE CCc1cccc(CN[C@H]2C[C@H](O)C23CCC3)c1O 827366494 WJBDMYXQMHPQNI-KBPBESRZSA-N 261.365 2.348 10 10 CECE Oc1cc2c(cc1CN1CCC[C@]3(CCOC3)C1)OCO2 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COCc1ccnc(NCc2cc3c(cc2O)OCO3)c1 846118477 ZIGILSONWRVIGR-UHFFFAOYSA-N 288.303 2.274 10 10 CECE CCOc1ccc(CN2CC[C@@H](C)[C@H](C(=O)O)C2)c(O)c1 843041148 OZNHDSIJQCEQCB-BXUZGUMPSA-N 293.363 2.334 10 10 CECE COc1ccc(CNC(=N)NC2CCCCC2)c(O)c1 849025038 KKFMPTYGEVZCEL-UHFFFAOYSA-N 277.368 2.347 10 10 CECE CCc1nccc(NCCc2ccc(O)c(O)c2)n1 1333380626 UUAZYKITCSFCPW-UHFFFAOYSA-N 259.309 2.105 10 10 CECE COc1ccc(O)c(CNC(=O)N[C@H](C)C(C)(C)OC)c1 918745144 DJQSVMDEZDSSRE-SNVBAGLBSA-N 296.367 2.014 10 10 CECE C[C@@H](N[C@H]1C[C@@](C)(O)C1)c1cc(F)cc(F)c1O 841760685 XWIDFNQFFVVEPU-JPVBRFOXSA-N 257.280 2.234 10 10 CECE COc1cccc([C@H](C)NCCc2cn(C)cn2)c1O 846169749 SNYJHPNKZSXDIF-NSHDSACASA-N 275.352 2.028 10 10 CECE Cc1cc(N(C)C)ccc1CN1CC(F)(F)C[C@H]1CO 840939993 RVCRWCKEMLKDON-AWEZNQCLSA-N 284.350 2.263 10 10 CECE CNCc1ccc(N(C)[C@H]2CCCC[C@@H]2O)cc1C 132076212 TZGHLYUWYSIJNR-HOTGVXAUSA-N 262.397 2.454 10 10 CECE CN[C@H]1CCCc2cc(N3C[C@@H]4C[C@H](C3)O4)ccc21 1899731348 KRGRXQLHEMKMHT-LZWOXQAQSA-N 258.365 2.261 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)[C@H]3C[C@@H]3C)C2)cc1 855228143 WGTWFUOVVTTXHO-HUBLWGQQSA-N 274.364 2.046 10 10 CECE CO[C@@H](COc1ccc(N(C)C)cc1)[C@@H]1CCOC1 853693604 RSCOYBBWCDORGR-DOMZBBRYSA-N 265.353 2.183 10 10 CECE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCN[C@H]1C 861700645 HJXUIGFGZXWGPC-GXTWGEPZSA-N 291.395 2.064 10 10 CECE C[C@H]1CCCN(C(=O)c2cc(O)c(O)c(O)c2)CC1 170190766 QFVHLMMHXYFJNF-VIFPVBQESA-N 265.309 2.066 10 10 CECE O=C(NCCOCC1CCC1)NCc1ccccc1O 765300463 CZLVBDARFBORNG-UHFFFAOYSA-N 278.352 2.008 10 10 CECE CCN(C[C@@H](C)CO)c1ccc(OC)c(OC)c1 766914740 WDAXKVBWZVLCBA-LLVKDONJSA-N 253.342 2.159 10 10 CECE Cc1ccc2c(n1)N(C(=O)/C=C\c1cnn(C)c1)CCC2 876490613 BXZOYCLAPLKROJ-VURMDHGXSA-N 282.347 2.116 10 10 CECE CN1CCN(Cc2cc(F)ccc2O)Cc2cccnc21 872267147 KYGRSSGUYNIGEN-UHFFFAOYSA-N 287.338 2.378 10 10 CECE CCOCCOCCNCc1ccc(Cl)cc1O 1462604026 KQNPYZRHBAEWFC-UHFFFAOYSA-N 273.760 2.188 10 10 CECE CCc1cccc(CN[C@H](COC)[C@H]2CCCOC2)c1O 895859401 QYNYMGOAYOWTLW-JKSUJKDBSA-N 293.407 2.486 10 10 CECE Cc1nc([C@H](N)c2ccc(O)c(O)c2)sc1C 83382725 INXSXWZHWSNSOF-LLVKDONJSA-N 250.323 2.219 10 10 CECE Oc1ccc(CNc2nccc(Cl)n2)c(O)c1 83385573 QIDPAUVYAFZKMN-UHFFFAOYSA-N 251.673 2.153 10 10 CECE CC[C@@H](NCc1cccc(Br)c1O)[C@H](C)O 395711933 HCGJAIYATHPOMV-GZMMTYOYSA-N 288.185 2.404 10 10 CECE O=C(O)[C@H]1CCc2sc(-c3ccc(O)c(O)c3)nc21 300459065 BDNTWJYBLHVAND-ZETCQYMHSA-N 277.301 2.336 10 10 CECE CC1(C)C[C@@H]([S@@](=O)CCc2ccc(N)cc2)CO1 705639801 RFKSHBNYFJAKSU-ACJLOTCBSA-N 267.394 2.128 10 10 CECE CCN(c1ccc2c(c1)NC(=O)[C@@H]2NC)C1CCC1 706823340 KDAPKIJCPIYXII-CQSZACIVSA-N 259.353 2.278 10 10 CECE C[C@@H](O)c1ccc(N2CC(n3ccnc3)C2)c(F)c1 707628217 UGTUBBCNRCJOJD-SNVBAGLBSA-N 261.300 2.137 10 10 CECE C[C@H](N)c1ccc(N2CC(n3ccnc3)C2)c(F)c1 707664717 LIKKHFYDSYIAEH-JTQLQIEISA-N 260.316 2.103 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](CO)CC[C@H]2C)cc1O 708468623 JKVLGCAJSOFOEU-UPJWGTAASA-N 278.396 2.270 10 10 CECE Oc1ccc(CN2CCCC[C@H]2[C@@H]2CCCN2)cc1O 63188427 XXXUKGHLTUFGTQ-KBPBESRZSA-N 276.380 2.204 10 10 CECE CN1CCc2cc(CNCC[C@@H]3CCCN3C)ccc21 693914109 BQCGTCHVRIZHAL-INIZCTEOSA-N 273.424 2.253 10 10 CECE COc1cccc(O)c1CN1CCC[C@H]2COCC[C@H]21 770285915 LSNBGXOZXUEVOH-GXTWGEPZSA-N 277.364 2.402 10 10 CECE CCNCc1ccc(N(C)C[C@H]2CCCN2C)c(F)c1 92633085 SATXVQAGGRZNPL-CQSZACIVSA-N 279.403 2.466 10 10 CECE O=C(O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1NCc1cc(Cl)ccc1O 2117603257 GFXYBYVTSLRIGR-KKOKHZNYSA-N 281.739 2.244 10 10 CECE Oc1ccc(CNC2CC(C3CCC3)C2)c(O)c1O 2120268748 NSTKPPUTGRJSRC-UHFFFAOYSA-N 263.337 2.472 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3N)C[C@@H]1F 2128271647 OVDAIGUJFHWUTP-SOUVJXGZSA-N 264.344 2.196 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3O)C[C@@H]1O 2128277618 QDJVPUBLGILGGH-LYRGGWFBSA-N 261.365 2.263 10 10 CECE O[C@H]1CCCc2cc(N3CC[C@H]4C[C@H]3CO4)ccc21 2128275770 WGKKODMCSVBZBR-DZKIICNBSA-N 259.349 2.424 10 10 CECE CCO[C@@H]1C=CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128323169 VQNVYROQBLUERV-GDBMZVCRSA-N 259.349 2.448 10 10 CECE O[C@@H]1CCc2cc(N3CCO[C@@H](CCF)C3)ccc21 2128321780 NEZMSVHZNKCTDP-DZGCQCFKSA-N 265.328 2.231 10 10 CECE CCN(C)[C@H]1CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128319133 ZWYRKGJYNMIMIV-GOEBONIOSA-N 260.381 2.197 10 10 CECE COc1cc(Cl)cc(CN2CCC[C@]2(C)CN)c1O 2126304751 XMPSDHIQHQASGS-CQSZACIVSA-N 284.787 2.367 10 10 CECE Oc1c(F)cccc1CNCc1c[nH]nc1C(F)F 2126651408 QAPLSUCJZNSFRT-UHFFFAOYSA-N 271.242 2.482 10 10 CECE CN(CCc1ccc(N)cc1)C[C@@H]1C[C@H]2C[C@@H]2CO1 2122824093 CJKMKNJHFQJGAL-FMKPAKJESA-N 260.381 2.168 10 10 CECE CN(CCC1(C)CC1)CC(=O)c1ccc(O)c(O)c1 2123191015 XRJYKGWRWZEDGS-UHFFFAOYSA-N 263.337 2.403 10 10 CECE Cc1cc(CNC2CC2)ccc1N(CCO)CC(F)F 231329245 VLBNRAGQZOAARA-UHFFFAOYSA-N 284.350 2.311 10 10 CECE C[C@@H](c1ccccc1O)N(C)[C@@H]1CCC(=O)N(C)C1 2131937891 XOOOAZXSMJWILW-NWDGAFQWSA-N 262.353 2.006 10 10 CECE CC[C@H](CO)NCc1ccc(C)c(Br)c1O 1905140890 CBBACVUEOMAQOE-SNVBAGLBSA-N 288.185 2.324 10 10 CECE O=C(NCCCCC1CC1)c1cc(O)c(O)c(O)c1 2132348509 NBWXMSSQBFVTMS-UHFFFAOYSA-N 265.309 2.114 10 10 CECE Oc1c(Br)cccc1CNC[C@@H]1[C@@H]2CCO[C@@H]21 1907563964 WKQFFGWHRDIGIK-CWSCBRNRSA-N 298.180 2.279 10 10 CECE CO[C@H]1C[C@@H](CF)N(c2c(F)cc(CO)cc2F)C1 2133713582 OOSRDEAMNYNXMO-UWVGGRQHSA-N 275.270 2.020 10 10 CECE CN(CCOc1ccc(N)cc1)[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134315251 PTGLNDWVTUORNC-NFWSPEMXSA-N 258.365 2.234 10 10 CECE COc1ccc(N2CC[C@H](OC)C2(C)C)c(N)c1 1914300635 BQBQBSGFOWMATO-ZDUSSCGKSA-N 250.342 2.281 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CC(=O)NCc2cccs2)C1 1912167056 FVSHMWNEIGWPOF-JTQLQIEISA-N 279.369 2.139 10 10 CECE Cc1cccc(NC(=O)CN2CC[C@@H](N=[N+]=[N-])C2)c1 1912171896 PXBSOCFLXUXVQY-GFCCVEGCSA-N 259.313 2.318 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2cc(C(N)=O)ccc2F)C1 1912154135 GOEBYRZQPRNGDA-NSHDSACASA-N 277.303 2.199 10 10 CECE COC(=O)[C@@H](CN(C)CCN=[N+]=[N-])c1ccccc1 1912145147 CRDYUBKYSOMKOI-LBPRGKRZSA-N 262.313 2.185 10 10 CECE CC(C)(C)c1nccn1CC(=O)Nc1ccc(N)cc1 1912373063 XXUQNBKDABBSCZ-UHFFFAOYSA-N 272.352 2.402 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC(C)(C)C[C@H]1C(=O)O 1912570801 HTLDWIFAYXGXMO-CABZTGNLSA-N 279.336 2.344 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCN2C[C@@H](O)CC 1916287617 BGCROTKMZDBMGF-DOMZBBRYSA-N 262.397 2.491 10 10 CECE COc1ccc(CN2CC(C)(C)C[C@H](N)[C@@H]2C)c(O)c1 1916274962 WOEVMXXYIRIBBF-FZMZJTMJSA-N 278.396 2.349 10 10 CECE COc1ccc(N(C)C(=O)/C=C\c2cnn(C)c2)cc1 1527658024 YVWXUMWQXPAMBU-WTKPLQERSA-N 271.320 2.105 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H](O)C23CCC3)cc1 2136739396 OQFPYGRLCDFVQO-LSDHHAIUSA-N 260.381 2.461 10 10 CECE CN1CCc2cc(CN[C@H]3CCC[C@@H]3N(C)C)ccc21 1921750863 WFAKLMKHUCTUDC-RDJZCZTQSA-N 273.424 2.251 10 10 CECE COc1cccc(CNC[C@@]2(O)CC[C@H](C)C2)c1O 2136916617 XRQRYPTVNYYMDL-XHDPSFHLSA-N 265.353 2.042 10 10 CECE CN[C@H](C)c1ccc(N(CCO)C2CCC2)c(F)c1 228398457 XPUMRVFZADMONF-LLVKDONJSA-N 266.360 2.457 10 10 CECE Cc1cc([N+](=O)[O-])c(OCc2ccc(N)cc2)cn1 1924865202 CTAFGBMTNASOHN-UHFFFAOYSA-N 259.265 2.459 10 10 CECE CN(C(=O)Cc1ccc(O)c(O)c1)C1CC(C)(C)C1 1626111292 KRGZFNZHADOTNK-UHFFFAOYSA-N 263.337 2.287 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](O)CC3(CC3)C2)c(F)c1 1926035487 MNZXCKASNGIWPV-CMPLNLGQSA-N 265.328 2.230 10 10 CECE Cc1nc(O)ccc1C(=O)N[C@H](C)c1ccccc1O 1632247192 UTWFSMWRVPXAFD-SECBINFHSA-N 272.304 2.292 10 10 CECE CC(C)[C@@H](C(=O)O)[C@@H](N)c1ccc2c(c1)CCCN2C 1927694470 BLTNJMQFTJDHJQ-CABCVRRESA-N 276.380 2.426 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1cncc(Cl)c1 1635958917 CZGPDQSMMCVVBZ-UHFFFAOYSA-N 278.695 2.076 10 10 CECE CCCN(C)c1cc(OC)c(OC)cc1[N+](=O)[O-] 1642146163 KIAWKCOOAOQXDA-UHFFFAOYSA-N 254.286 2.458 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1c(O)cccc1F 231732739 VACNXGZVQFLXFT-UHFFFAOYSA-N 252.249 2.352 10 10 CECE COc1cccc(C(=O)NCc2cccc(O)c2O)c1 1651172901 KJTYKMQRZQJNFD-UHFFFAOYSA-N 273.288 2.036 10 10 CECE Cc1coc(C)c1C(=O)NCc1c(O)cccc1O 1597574539 PHWFNPPVMSZMON-UHFFFAOYSA-N 261.277 2.238 10 10 CECE COc1cc(N(CC(C)(C)O)C(C)C)ccc1CN 2139696414 HGLKSZAHKXWUCG-UHFFFAOYSA-N 266.385 2.140 10 10 CECE CC[C@@H]1COCCN(c2ccc(CN)c(OC)c2)C1 2139700266 HSQCLSFKHGOIMX-LBPRGKRZSA-N 264.369 2.017 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\C1CC1 1772919728 PUDQUNQIRPWVGD-BXKUYDPTSA-N 261.321 2.111 10 10 CECE N[C@@H]1CCN(Cc2ccc(F)cc2O)C2(CCC2)C1 2139770872 PJSBXGQKLMEJSN-CYBMUJFWSA-N 264.344 2.377 10 10 CECE COc1ccc(COc2cccnc2N)cc1OC 20483710 GDXQWVRGAFCONN-UHFFFAOYSA-N 260.293 2.260 10 10 CECE COc1ccc(N2CC[C@@H](C(C)(C)N)C2)cc1OC 2139887517 NBCKEKUGSUWVGX-LLVKDONJSA-N 264.369 2.267 10 10 CECE CC[C@@H](N)c1ccc(N2CCN3CCC[C@@H]3C2)cc1 233902299 VKNVSIDGYIRDSK-HZPDHXFCSA-N 259.397 2.381 10 10 CECE Cc1cc(CN(C)c2ccc(CN)cc2F)ncn1 2141687520 DPYHWGSPIBJBAS-UHFFFAOYSA-N 260.316 2.019 10 10 CECE C[C@H](NC(=O)[C@@H]1CCCOCC1)c1ccccc1O 827968924 DAHURGOVCGGTPV-NWDGAFQWSA-N 263.337 2.386 10 10 CECE O=C(CNCc1cc(Cl)ccc1O)Nc1nccs1 1857856279 PMQWFQMTMBTLSW-UHFFFAOYSA-N 297.767 2.230 10 10 CECE O=C(O)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1O 1964722629 CYDBHYRHZXSQSZ-XYYAHUGASA-N 261.321 2.220 10 10 CECE Oc1ccc(Cl)cc1CN[C@@H]1[C@H]2CCOC[C@@H]21 1945023176 IKUVLEAGLXYKOI-GMXVVIOVSA-N 253.729 2.170 10 10 CECE CO[C@H]1C[C@@H](N[C@@H](C)c2cc(F)ccc2O)C[C@H]1OC 1875525464 BPEUYROMEXUYSF-NDMCHQMPSA-N 283.343 2.374 10 10 CECE Cc1ccc(CNCC(O)(C2CC2)C2CC2)c(O)c1 877631625 LAJDCKBSFZTUIM-UHFFFAOYSA-N 261.365 2.341 10 10 CECE CO[C@@H]1CC[C@@H]2CN(c3ccc([C@@H](C)N)c(O)c3)C[C@H]21 2144214326 ZAVGOFMLOGONJV-MMYVAXCBSA-N 276.380 2.273 10 10 CECE COc1ccc(N(C)[C@H]2CCNCC2(C)C)c(N)c1 1876352024 VVRXFZXDXILSGZ-AWEZNQCLSA-N 263.385 2.102 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CC[C@@H]1C1CCC1 1876612091 PURJLFUBNLUSRG-DGCLKSJQSA-N 266.345 2.398 10 10 CECE Nc1ccc(CN[C@@H]2CCCC3(CC2)OCCO3)cc1 1946692972 LATOYKGAPMBDPK-OAHLLOKOSA-N 276.380 2.434 10 10 CECE CC(C)(F)[C@@](C)(F)C(=O)NCc1ccccc1O 1964890147 QHQRHYZVBRKZHZ-ZDUSSCGKSA-N 257.280 2.485 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ccncc1CN 1877532468 GKACYRHPOKOIDF-NSHDSACASA-N 257.337 2.443 10 10 CECE CC[C@@H](COC)C(=O)N(CC)Cc1ccc(N)cc1 1879006032 ULWCQMGCAOESJV-ZDUSSCGKSA-N 264.369 2.290 10 10 CECE CCC[C@H](N)CC(=O)N(C)[C@H](C)c1ccccc1O 135920340 FFKNSHVZLRFWBV-NEPJUHHUSA-N 264.369 2.429 10 10 CECE COC[C@H]1C=CCN1c1c(F)cc([C@@H](C)O)cc1F 1880479491 NVUIGPPYYGUVCN-MWLCHTKSSA-N 269.291 2.409 10 10 CECE C[C@H](O)c1cc(F)c(N2CC=C(CO)CC2)c(F)c1 1880479422 NINOZBVZRCTZNC-VIFPVBQESA-N 269.291 2.147 10 10 CECE CC[C@@]1(O)CCN(c2c(F)cc([C@@H](C)N)cc2F)C1 1880927530 KZIIGNDDQOICKO-YMTOWFKASA-N 270.323 2.336 10 10 CECE OCc1cc(F)c(N2CC[C@@H]3C[C@H](O)CC[C@H]32)c(F)c1 2143966092 JBRCNBCBSIKSMN-JTNHKYCSSA-N 283.318 2.197 10 10 CECE CCN(CC)c1ccc(CNCC(OC)OC)cc1 37388207 UDJJIVFTTWVKNC-UHFFFAOYSA-N 266.385 2.241 10 10 CECE C[C@H](N[C@H](C)[C@@H](O)C(F)(F)F)c1ccc(O)cc1O 1889507355 XAWLENYRWUOJJV-MVKOHCKWSA-N 279.258 2.060 10 10 CECE Oc1c(F)cccc1CNC[C@]1(O)C[C@@H]2CCC[C@H]21 1890989775 ZWNUXHDGBJJXGF-JVLSTEMRSA-N 265.328 2.172 10 10 CECE CO[C@@H](CN(C)c1ccc(CN)cc1)[C@@H]1CCCOC1 1967635349 MVHJOSHESXDSNN-ZBFHGGJFSA-N 278.396 2.023 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C(N)=O)CC[C@H]2C)cc1Cl 251694425 HIMZPYODJAWGNL-OUAUKWLOSA-N 295.814 2.450 10 10 CECE Cc1cccc(CN[C@@H]2CCC[C@@H]3CNC[C@H]32)c1O 1967985065 CHTZRORTUDXYQE-BPLDGKMQSA-N 260.381 2.178 10 10 CECE CN1C(=O)[C@@H](O)c2ccc(N3CC[C@@H]3C3CCC3)cc21 2144897824 IXTRVTBXEJQZTQ-HIFRSBDPSA-N 272.348 2.075 10 10 CECE Cc1coc(C)c1C(=O)NCCc1ccc(N)cc1 1969320005 BRLYOUAZPHJCEE-UHFFFAOYSA-N 258.321 2.451 10 10 CECE Cc1ccc(CN2CCOC[C@@H]2C(F)F)c(O)c1 1971850198 LZYXUWDSMPTMSF-LLVKDONJSA-N 257.280 2.167 10 10 CECE C[C@H](SC[C@H](O)COc1ccc(N)cc1)[C@H]1CCCO1 2145513164 URVYHDXNMIMTPG-NJZAAPMLSA-N 297.420 2.309 10 10 CECE Cc1ccc2[nH]c(=O)n(Cc3ccccc3O)c2c1 257970189 GJPXZGDZFVGYMV-UHFFFAOYSA-N 254.289 2.392 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3CC[C@@]2(CO)C3)cc1O 2145950784 FAFWHVKXSLCNKA-MKBNYLNASA-N 276.380 2.024 10 10 CECE CCNCc1ccc(N2C[C@H]3CC[C@@]2(CO)C3)cc1C 2145964827 UDEMTQHZUJXWIK-YOEHRIQHSA-N 274.408 2.456 10 10 CECE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc([C@H](C)O)cc1Cl 2146464481 QJOXUQBZRKUVSK-BHDSKKPTSA-N 296.798 2.354 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@@H](C(=O)O)CC1 2146594087 PPIBKPJOOFRQGE-GHMZBOCLSA-N 279.336 2.346 10 10 CECE CC[C@@H](C)[C@H](NCc1cccc(C)c1O)C(=O)OC 158710185 BZDPVXWHDCHBJZ-MFKMUULPSA-N 265.353 2.378 10 10 CECE CN1CCc2cc([C@H](O)C(=O)C[C@@H]3CC3(F)F)ccc21 2147112136 BKIPHSKSUZSXKS-RISCZKNCSA-N 281.302 2.327 10 10 CECE CN(C)c1ncccc1NCc1ccc(O)c(O)c1 37028694 ROJCCVPWYKBXRL-UHFFFAOYSA-N 259.309 2.171 10 10 CECE c1ccc2c(c1)N=S=C2c1nc([C@H]2CCCCN2)no1 2159955358 YUHCQDWQXGBXJN-LLVKDONJSA-N 286.360 2.364 10 10 CECE CCOC(=O)C1(NCCCN=[N+]=[N-])C[C@H](C)O[C@@H](C)C1 165559830 MEIWOSFDIAINFF-QWRGUYRKSA-N 284.360 2.166 10 10 CECE CN1CCC[C@H]2CN(Cc3cccc(F)c3O)CC[C@@H]21 166378806 FGUROKCVMWRJSY-WFASDCNBSA-N 278.371 2.447 10 10 CECE C[C@@]1(C2CC2)CN(c2ccc3c(c2)COCC3)CCN1 2152797941 WFTOKXYINKNRAP-KRWDZBQOSA-N 272.392 2.338 10 10 CECE NCc1ccc(N2C[C@@]34CCC[C@]3(COC4)C2)c(F)c1 2153078568 VKWYKYCLCZRRCP-HZPDHXFCSA-N 276.355 2.291 10 10 CECE CN(C[C@@H]1C=CCC1)c1ccc2c(c1)N(C)C(=O)[C@H]2O 2153113996 KYVHUKZRDJDNPY-ABAIWWIYSA-N 272.348 2.099 10 10 CECE C[C@H]1C[C@@H](C)[C@H](C(=O)O)CN1Cc1ccc(O)c(O)c1 2153734626 HJGBRZCUXZYCNR-JFGNBEQYSA-N 279.336 2.029 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]2[C@H](C)O)c(Cl)c1 2011147402 WDYYVYQNHPQJFN-AUTRQRHGSA-N 254.761 2.319 10 10 CECE CNCc1ccc(N(C)C2CCN(C)CC2)c(C)c1 50559901 XLRXGVQFDRLLCP-UHFFFAOYSA-N 261.413 2.245 10 10 CECE Nc1ccc(OC[C@H](O)COCc2cccs2)cc1 51328178 XNSKGYWENGXDAG-GFCCVEGCSA-N 279.361 2.287 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1C[C@]12CCOC2 2021239751 BMQPRNIYNSUIGL-OLZOCXBDSA-N 253.729 2.314 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@H](O)[C@@H](F)C2)cc1 2027972831 NBICJDMMWRLTOT-MJBXVCDLSA-N 252.333 2.006 10 10 CECE CNC[C@@H]1CCCN(Cc2ccc(Cl)cc2O)C1 2029651528 YGIQLVUYBCARFE-NSHDSACASA-N 268.788 2.477 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H](C(F)F)C1CC1 2029895753 GINRIKZEDKCDSD-SECBINFHSA-N 256.252 2.423 10 10 CECE C[C@@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@@H](CN)C2 2159185646 PINYWMOKZDEODZ-ZDEQEGDKSA-N 276.380 2.361 10 10 CECE CC[C@]1(C(=O)N(C)[C@@H](C)c2ccccc2O)CCNC1 62896477 LVNTTWDZNSNXDT-LRDDRELGSA-N 276.380 2.301 10 10 CECE COc1ccc(N(CCCN)C[C@@H]2CC[C@H](C)O2)cc1 300149279 OTVDNSIDDAVGMP-BBRMVZONSA-N 278.396 2.418 10 10 CECE NCc1ccc(N2C[C@@H](O)CC23CCC3)c(Cl)c1 2038053884 LUKPEYYAGVNAFT-NSHDSACASA-N 266.772 2.292 10 10 CECE C[C@H]1C[C@H](CNCc2cc(F)cc(F)c2O)CO1 2040309393 GHDCHTOAXLPGHQ-DTWKUNHWSA-N 257.280 2.185 10 10 CECE C[C@@H](CN[C@H](C)c1ccc(F)cc1O)N1CCC1 2041319468 UPYIHFDQALLCEV-WDEREUQCSA-N 252.333 2.276 10 10 CECE Cc1cccc(CNC[C@@H]2CCc3nccn3C2)c1O 2159894207 BYFIWVIMKNGEMD-ZDUSSCGKSA-N 271.364 2.249 10 10 CECE CN1CCc2cc(CNC[C@H](O)C(C)(C)C)ccc21 305189921 GFMADFGRXUONAK-HNNXBMFYSA-N 262.397 2.176 10 10 CECE CCN1CCCN(CCCOc2ccc(N)cc2)CC1 307773702 HNIFIESCHZBWPH-UHFFFAOYSA-N 277.412 2.065 10 10 CECE CO[C@H](COc1ccc(N2CCNCC2)cc1)C(C)C 312576474 TZKNZADQRLBJLQ-MRXNPFEDSA-N 278.396 2.146 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CCOCCOC)cc1 313563063 ULDOFLXYSKAYLJ-AWEZNQCLSA-N 280.412 2.456 10 10 CECE CN(CCCc1cnn(C)c1)Cc1ccc(N)cc1 314078090 XUOREFOSJUTYAE-UHFFFAOYSA-N 258.369 2.067 10 10 CECE CC(C)N1CC[C@H](N(C)CCOc2ccc(N)cc2)C1 2160028774 MOHUOAGQJORVND-HNNXBMFYSA-N 277.412 2.062 10 10 CECE C[C@@H]1CC[C@H]1N(C)[C@H](CN)c1ccc2c(c1)CCN2C 2161924280 NBEZYDUESTUBPH-SRCQZFHVSA-N 273.424 2.409 10 10 CECE CN1CC[C@H]2[C@@H](CCN2Cc2ccc(F)c(F)c2O)C1 2170935630 FHHYFPBZICQRAN-GWCFXTLKSA-N 282.334 2.196 10 10 CECE C[C@H](O)c1ccc(N2C[C@@]3(F)CCC[C@]3(CO)C2)cc1 2176646975 MWYVXYPJVPJDCF-MAZHCROVSA-N 279.355 2.431 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CCC[C@H]3C3CC3)cc21 706623289 QSCDEZNUTRRMDQ-ZFWWWQNUSA-N 271.364 2.042 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H]3CN(C)C[C@H]3C2)cc1 706997550 YCTPUYVCARTIIL-OFQRWUPVSA-N 259.397 2.094 10 10 CECE CCN[C@@H](C)c1ccc(N2CCCC[C@@H]2C(N)=O)cc1 688961577 VDFLERZQNGVGQX-SWLSCSKDSA-N 275.396 2.201 10 10 CECE CNCc1ccc(OC)c(CN2CC[C@@H]3C[C@H]3C2)c1 699257586 SDQLLDGCGSXOTD-KGLIPLIRSA-N 260.381 2.256 10 10 CECE CCCN(c1cc2c(cc1N)OCCO2)[C@@H]1CCOC1 380837166 WCDGMVMPRSFARA-LLVKDONJSA-N 278.352 2.045 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 381980889 IXONNJGIUJGIQT-SLEUVZQESA-N 273.380 2.328 10 10 CECE COCCNCc1ccc(N2C[C@H](F)[C@@H](F)C2)c(F)c1 714700800 VCOBLTRFNLNSJA-STQMWFEESA-N 288.313 2.058 10 10 CECE O=C1Nc2cc(N3CC(F)(C4CC4)C3)c(Cl)cc2[C@H]1O 2172058926 PHGMBFBRNRDARM-GFCCVEGCSA-N 296.729 2.264 10 10 CECE CN(C)C1CCC(NCc2cccc(F)c2O)CC1 715550599 BONOLNZNFYOEOI-UHFFFAOYSA-N 266.360 2.494 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CCCCC23OCCO3)c1 715663273 OJRUHAODUOIXHR-OAHLLOKOSA-N 277.364 2.476 10 10 CECE CCCNCc1ccc(N2CC(O)C2)c(C(F)(F)F)c1 384087245 ASEVWXUOCMSPQM-UHFFFAOYSA-N 288.313 2.386 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2ncccn2)cc1O 718959239 JXPWRRCWWHLLSY-LLVKDONJSA-N 272.352 2.099 10 10 CECE NCc1ccc(N2CCC[C@](O)(C(F)(F)F)C2)cc1 718906369 SGJSFIBYDRZZCQ-GFCCVEGCSA-N 274.286 2.039 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC23CCOCC3)c1 387367728 XBJJRPVDZOPYGB-CQSZACIVSA-N 263.337 2.060 10 10 CECE C[C@@H](NCc1ccc(O)c(O)c1)[C@@H]1CCCOC1 389042629 ZRIUXIWGVXESHB-ZYHUDNBSSA-N 251.326 2.003 10 10 CECE CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(CCc2ccc(N)cc2)[C@H]31 394282207 HCNZVDGBHZIPEH-XSIBGMEISA-N 272.392 2.167 10 10 CECE COc1cc(CN[C@H](C)c2c(O)cccc2O)sn1 399132695 PSWWBGKWDGIYKV-MRVPVSSYSA-N 280.349 2.414 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3C[C@@]34CC[C@H]4N)ccc21 2172518418 IOQQSYWVDKJQPJ-ORQFMDKSSA-N 272.392 2.230 10 10 CECE CN1CCc2cc([C@H](N)[C@](C)(O)CCC(F)F)ccc21 2177869055 BZCXJRYXCKAIOA-LSDHHAIUSA-N 284.350 2.475 10 10 CECE CC[C@@H](O)c1ccc(N2CCOC[C@]2(C)COC)cc1 2168255982 FOMRTZBNVRMWRJ-CVEARBPZSA-N 279.380 2.372 10 10 CECE COC[C@@]1(C)COCCN1c1ccc([C@H](C)N)cc1F 2168252834 BLTIKWORZNJFMS-NHYWBVRUSA-N 282.359 2.087 10 10 CECE CN1CCc2cc([C@H](O)[C@](C)(N)CC(F)(F)F)ccc21 2175097469 MGONAFBKZKUFJP-QWHCGFSZSA-N 288.313 2.382 10 10 CECE Nc1ccc(CCCOc2cccnc2C(=O)O)cc1 2179590518 FAEGTONCCQJSFW-UHFFFAOYSA-N 272.304 2.374 10 10 CECE CC(C)(C)c1ocnc1[C@@H](O)[C@@H](N)c1ccccc1O 2178416911 GDYNKJIOPDGSSN-AAEUAGOBSA-N 276.336 2.411 10 10 CECE CC[C@@H](C)S(=O)(=O)N[C@H](C)c1ccccc1O 1260746883 WUTURISTARUBPK-NXEZZACHSA-N 257.355 2.171 10 10 CECE Cc1ccc(Cn2ncc(N)c2C(F)F)c(O)c1 2079036637 ZKNKAAVUNUMTIX-UHFFFAOYSA-N 253.252 2.465 10 10 CECE CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc([C@H](C)N)c(Cl)c1 2192286950 UHARRLUYGRMJQE-XDTLVQLUSA-N 293.798 2.169 10 10 CECE C[C@@H](NC(=O)[C@@H]1C[C@@H]2CC[C@H](C1)N2)c1ccccc1O 2192628181 XLUKUFKCRYWXKL-FVCCEPFGSA-N 274.364 2.100 10 10 CECE CN(Cc1cccc(Cl)c1O)[C@@H]1CC(=O)N2CCC[C@@H]12 2188462889 CKLQEESNGFBMOZ-QWHCGFSZSA-N 294.782 2.241 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)C[C@@H](C)O1 2188576514 HVLPQMSEZOKCTG-ZWNOBZJWSA-N 280.324 2.091 10 10 CECE CS[C@H]1CCC[C@H]1N(C)C(=O)c1cc(O)c(O)c(O)c1 2188874759 KPXBIPOIVMUIHY-SKDRFNHKSA-N 297.376 2.160 10 10 CECE CCC[C@H](COC)[C@H](NN)c1ccc2c(c1)CCN2C 2193471207 KAZMRXJRUVCJTH-GDBMZVCRSA-N 277.412 2.246 10 10 CECE CCN1CCc2cc([C@]3(O)CCNCC[C@H]3C)ccc21 2196996252 CPMIUSRLCSDNMI-DYVFJYSZSA-N 274.408 2.276 10 10 CECE CSc1ncc(CNC[C@H]2OCCOC2(C)C)s1 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C[C@@H](NCc1cc(C(N)=O)co1)c1ccc(F)cc1O 187734185 DUCMHCPMZJYJGE-MRVPVSSYSA-N 278.283 2.074 10 10 CECE CC(C)N[C@](C)(C(=O)O)c1ccc(N(C)C)cc1 37902562 XJQZEQZNWQERJN-AWEZNQCLSA-N 250.342 2.050 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H]2C[C@H]1CN2C(C)C 2131062860 BZLYVELZADGRMP-GJZGRUSLSA-N 260.381 2.159 10 10 CECE CC(C)CN1CCN(C(=O)CCc2ccc(N)cc2)CC1 40330629 IMJSCSJTYZTDBC-UHFFFAOYSA-N 289.423 2.002 10 10 CECE Oc1ccc([C@H](O)C(F)(F)Br)cc1O 225674318 QPJIZYCBBVRLBQ-ZETCQYMHSA-N 269.041 2.119 10 10 CECE CCNC(=O)c1cccc(NCc2cccc(O)c2O)c1 41116951 BFNRWRAVRGVTEF-UHFFFAOYSA-N 286.331 2.460 10 10 CECE CCCCN(CC(N)=O)c1ccc(/C=C\C(=O)O)cc1C 220116697 ONKXVQPLIGKLLH-VURMDHGXSA-N 290.363 2.185 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@@H](CCCN3C)C2)cc1O 220911168 NRSBWKNITXGHCB-HEHGZKQESA-N 289.423 2.332 10 10 CECE C[C@H](CO)CSCCCOc1ccc(N)cc1 97458963 KYWQJKKANOATQO-LLVKDONJSA-N 255.383 2.399 10 10 CECE COc1ccc([C@H](C)NCC2(C)COC2)c(O)c1 94721828 ZBEVKEZNKQOODB-JTQLQIEISA-N 251.326 2.088 10 10 CECE COc1cc(Br)c(O)c([C@@H](N)CF)c1 238450479 XLURDLWQMSRQSJ-QMMMGPOBSA-N 264.094 2.133 10 10 CECE C[C@@H]1C[C@@H]1NC(=O)/C=C\c1ccc(N2CCOCC2)cc1 255536599 QUMXMCYDLKEUDK-WGXYTZMTSA-N 286.375 2.061 10 10 CECE CC(C)(C)OC(=O)NC[C@]1(c2ccccc2O)CCCN1 258146740 LDXCCQJLGCOJDS-INIZCTEOSA-N 292.379 2.496 10 10 CECE C[C@@H](C(=O)O)c1cc(O)c(O)cc1Br 257827265 HTLNOLRCLKNSPI-SCSAIBSYSA-N 261.071 2.048 10 10 CECE CC[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@]2(CCOC2)O1 376635523 WYFYEAXGEKGHOA-GDBMZVCRSA-N 295.354 2.301 10 10 CECE CC(=O)C(=O)COC(=O)c1cncc(-c2ccccc2)c1 808526155 LJVGBCVZPNGLHZ-UHFFFAOYSA-N 283.283 2.064 10 10 CECE CCc1nnc(C[C@H](O)c2ccc(N(C)C)cc2)s1 702683621 ATFDPVCIPVCRBS-LBPRGKRZSA-N 277.393 2.443 10 10 CECE COc1ccnc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)c1 2167210573 XHNWMMMKCSNKNV-SNVBAGLBSA-N 275.312 2.395 10 10 CECE CNCc1ccc(N(C)Cc2cnccn2)c(C)c1 700060096 PSAZULMKVWOZPV-UHFFFAOYSA-N 256.353 2.141 10 10 CECE CN(Cc1c(Cl)cnn1C)C(=O)Nc1ccc(N)cc1 2168143607 ZGHJCXAQAXRNLA-UHFFFAOYSA-N 293.758 2.320 10 10 CECE CNCc1ccc(N(C)CC2=CCCOC2)cc1C 723172461 VYSZPYUQCYZIPD-UHFFFAOYSA-N 260.381 2.497 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCOC2(C)C)c1 296429082 LTCPAOWVUVONPQ-HZMBPMFUSA-N 293.363 2.397 10 10 CECE CO[C@H]1C[C@@](O)(c2ccc3c(c2)CCN3C)C12CCC2 2163061242 GYLMAUMNXOHSIO-DOTOQJQBSA-N 273.376 2.456 10 10 CECE C[C@@H]1OC2(C)CC1([C@H](NN)c1ccc(N(C)C)cc1)C2 2163110231 HAMBULAPHQQJHY-AMZBTWFVSA-N 275.396 2.215 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@](C)(O)C3(F)CC3)ccc21 2163131931 WJXHSQTULDWFCD-HUUCEWRRSA-N 278.371 2.322 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)[C@]3(C)CC3(C)C)ccc21 2163141435 UQSCCVJHBMQGKJ-UXLLHSPISA-N 274.408 2.476 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)[C@@H]1CC[C@H]2C[C@H]21 2165543989 RCEVMCPLWZMPHN-BAESOJJISA-N 273.380 2.326 10 10 CECE COC[C@@H]1CCN1Cc1cccc(Br)c1O 816637056 PTRVPCFBESWIKQ-JTQLQIEISA-N 286.169 2.375 10 10 CECE CCCc1ncc(CNC(=O)NCc2ccccc2O)o1 836635597 DYBQQCVMBINIFT-UHFFFAOYSA-N 289.335 2.332 10 10 CECE CCCN(CC(N)=O)Cc1c(O)cc(C)cc1Cl 840950501 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C[C@@H]1C[C@H](C(=O)O)N[C@@H](c2ccc(N(C)C)cc2)C1 2120207565 DLAJWSIEFPUOGD-ZLKJLUDKSA-N 262.353 2.266 10 10 CECE COc1ccc(N2CC[C@H](O)[C@@H]2C(C)(C)C)c(N)c1 2128672968 ZSHGDQLQUVUKHG-UONOGXRCSA-N 264.369 2.263 10 10 CECE CN(C)c1ccc2c(c1)CCN2C[C@@H]1OCC[C@@H]1F 2122527068 FHGMQOMNBCJHSV-ZFWWWQNUSA-N 264.344 2.242 10 10 CECE CC(C)CNCc1ccc(N(C)[C@H]2C[C@H](O)C2)cc1 2122886091 JIOSYYVWHIEAJT-WKILWMFISA-N 262.397 2.392 10 10 CECE NC(=O)C[C@H]1CCCCN1c1ccc(CO)c(Cl)c1 2126889418 HUTXXNXVSPFCRM-LLVKDONJSA-N 282.771 2.067 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](O)CC3(C)C)ccc21 2128313474 TZWUYKXKSXDENB-DZGCQCFKSA-N 260.381 2.243 10 10 CECE O[C@@H]1CCc2cc(N3CCO[C@H]4CCC[C@H]43)ccc21 2128317803 RNAGHVWLHOKNDO-OAGGEKHMSA-N 259.349 2.424 10 10 CECE CCO[C@H]1C=CCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128323622 VQNVYROQBLUERV-HOCLYGCPSA-N 259.349 2.448 10 10 CECE C[C@]1(F)CN(CCN=[N+]=[N-])C[C@@]1(C)Br 1905098882 UIIGBCYWUSMNHN-SFYZADRCSA-N 265.130 2.494 10 10 CECE COCC(CN[C@@H](C)c1cc(F)ccc1O)COC 1910262323 AVGAJTJMDRCNKB-JTQLQIEISA-N 271.332 2.091 10 10 CECE COCC(COC)CN(C)Cc1cccc(C)c1O 1910205290 RJUNDANOTXPVRU-UHFFFAOYSA-N 267.369 2.041 10 10 CECE [N-]=[N+]=N[C@H]1CCN(CCCN2C(=O)c3ccccc3C2=O)C1 1912160512 XCMKUCRJHUPSPN-NSHDSACASA-N 299.334 2.057 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2ccc(Cl)cn2)C1 1912191162 NYYAKKKTROFCQQ-QMMMGPOBSA-N 251.677 2.260 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(Cc2nnc(-c3ccco3)o2)C1 1912187770 JNUTVBIJAXSRCA-MRVPVSSYSA-N 260.257 2.214 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)[C@@H]2CCCO2)C1 1912167322 JSJNVVZNBCDLOM-MNOVXSKESA-N 252.318 2.104 10 10 CECE CC[C@H](CCOC)C(=O)N1CC[C@H](CN=[N+]=[N-])C1 1912195145 DBBCWSAGSAMUKT-GHMZBOCLSA-N 254.334 2.208 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CCC[C@@H]2CSC[C@H]21 1912186642 BETQUWURAHCLPD-WZRBSPASSA-N 298.412 2.351 10 10 CECE CC(C)[C@H](NC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 1447964116 MFOVDAMSBCQWHP-LBPRGKRZSA-N 291.269 2.343 10 10 CECE CCc1cccc(CN[C@@H](CCO)C(F)F)c1O 1918517159 GNIRDVLUCJCXRA-NSHDSACASA-N 259.296 2.060 10 10 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10 CECE CCc1ncc2c(n1)CN(Cc1ccc(OC)cc1O)CC2 128315646 OKFKNYODPRXYPY-UHFFFAOYSA-N 299.374 2.312 10 10 CECE Cc1ccc(O)c(/C=C2\C(=O)NN(c3ccccc3)C2=O)c1 33385765 ACKWOVUTCDERGO-GXDHUFHOSA-N 294.310 2.162 10 10 CECE CN(Cc1ccncc1)Cc1cc([N+](=O)[O-])ccc1O 183746200 PDJIKCDDFQUFAE-UHFFFAOYSA-N 273.292 2.327 10 10 CECE CN(C)c1ccc([C@]2(N)C[C@H]2C(=O)OC(C)(C)C)cc1 1952741631 HNTMAQKWVJFICE-XJKSGUPXSA-N 276.380 2.268 10 10 CECE CN1CCc2cc([C@@H]3[C@@H](N)CCCCN3C)ccc21 226473997 HYICWMRPFAWILD-GOEBONIOSA-N 259.397 2.163 10 10 CECE [N-]=[N+]=NCCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1 42012402 JETGVOYBIBRORH-SNAWJCMRSA-N 261.241 2.035 10 10 CECE COc1ccc([C@@H](C)NCCC[C@@H](C)O)c(O)c1 228028721 YPECOOPAWUZRBX-GHMZBOCLSA-N 253.342 2.212 10 10 CECE O=C1N[C@H](c2cc(Br)cc(F)c2O)CO1 95718700 PXGYGVDQPVWORR-ZETCQYMHSA-N 276.061 2.075 10 10 CECE Cc1cc(Cl)cc(CN2CCOC[C@]23CCOC3)c1O 195018128 BIAILPJBCUKDMQ-OAHLLOKOSA-N 297.782 2.345 10 10 CECE CC[C@@H]1OCC[C@@H]1CNCc1ccc(O)cc1O 233915609 XCWZYBNGOUCSRY-RISCZKNCSA-N 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CC1(C)C[C@H](C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)CO1 2103138500 YHCYIEFLUIRUOP-MNOVXSKESA-N 266.345 2.350 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1CC[C@@H](O)CC1 2103881493 CJGGYBIALFCLKW-BETUJISGSA-N 263.341 2.036 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2CC[C@@H](O)CC2)cc1O 2103909465 OWQTVHSSWHVFMT-GMXVVIOVSA-N 265.353 2.185 10 10 CECE CCCc1ocnc1CNCc1cccc(O)c1O 2104109252 YHWTTZLZZOGGOX-UHFFFAOYSA-N 262.309 2.328 10 10 CECE C[C@H]1CC[C@@H](CC(=O)N(C)Cc2ccc(N)cc2)O1 2104801914 LICKRPACTWEDRU-FZMZJTMJSA-N 262.353 2.185 10 10 CECE Cc1ncoc1CN(C)CCOc1ccc(N)cc1 2105598640 KHPOFRZGDJGNCI-UHFFFAOYSA-N 261.325 2.076 10 10 CECE Cc1ncoc1CN(C)c1ccc([C@@H](C)N)c(O)c1 2105600773 XTGDYNOWNJWYMM-SECBINFHSA-N 261.325 2.345 10 10 CECE COc1ccc(N(C)[C@H]2C[C@H]3CN[C@@H](C3)C2)c(F)c1 2106362934 QNOHWZONYOADII-SRVKXCTJSA-N 264.344 2.411 10 10 CECE COc1ccc(N2C[C@H]3[C@@H](N)CCC[C@H]3C2)cc1F 2106345507 NTJCGSZUJAOLCX-SUHUHFCYSA-N 264.344 2.398 10 10 CECE CCN1CCc2cc([C@]3(N)COCC[C@H]3C)ccc21 2106788382 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COc1ccc(O)c([C@H](C)N(CCN)CC(C)C)c1 2090731778 FGCCATVHQGYWEF-LBPRGKRZSA-N 266.385 2.379 10 10 CECE CO[C@H]1CCCC[C@H]1NCCc1ccc(O)c(O)c1 2091746781 GWKAITVPZPXGRB-DOMZBBRYSA-N 265.353 2.188 10 10 CECE CCCNCc1ccc(N2CCN(C)[C@@H]3C[C@@H]32)cc1 2112079921 VNVHZENKCNNWMB-CVEARBPZSA-N 259.397 2.079 10 10 CECE Cc1ccc(O)c(CN(C)Cc2ccc(N)cc2)n1 2092476678 YXLBGZWMUQKYBV-UHFFFAOYSA-N 257.337 2.310 10 10 CECE CN(Cc1ccc(N)cc1)c1ccc([N+](=O)[O-])cn1 2092475559 OJPZTFHKJUVIME-UHFFFAOYSA-N 258.281 2.208 10 10 CECE Nc1ccc(CNCc2cnn3c2CCCC3)cc1 2092531421 ISIILEHIVPCZDG-UHFFFAOYSA-N 256.353 2.091 10 10 CECE CNCc1ccc(N2CCN(C)CC2(C)C)c(C)c1 2094039576 XFZOHJBBFNASPM-UHFFFAOYSA-N 261.413 2.245 10 10 CECE CC[C@H](CCOC)C(=O)N(C)Cc1ccc(N)cc1 2095650995 DNFCGVUEIJXOLB-CYBMUJFWSA-N 264.369 2.290 10 10 CECE O=C(NC[C@@H]1CC12CCCC2)c1cccc(O)c1O 2097358795 NIRHPGUFWYDOPI-JTQLQIEISA-N 261.321 2.408 10 10 CECE CN1CCC[C@@]1(C)CN[C@@H]1CCc2cccc(O)c21 2098720721 FXBVTMNJSMGGSQ-CJNGLKHVSA-N 260.381 2.453 10 10 CECE C[C@@H](c1cncn1C)N(C)c1ccc(CN)cc1F 2099524265 PQIHHHMCPBGXNR-JTQLQIEISA-N 262.332 2.215 10 10 CECE CC[C@@H]1CC[C@H](CN(C)C(=O)Cc2ccc(N)cc2)O1 2201392174 QIMYHEHNGIRIDS-HUUCEWRRSA-N 276.380 2.227 10 10 CECE CCC1(N(C)c2cc3c(cc2F)[C@@H](O)C(=O)N3)CC1 2112843996 ZXCIAKZHYNGPEV-GFCCVEGCSA-N 264.300 2.190 10 10 CECE CC[C@H](C)N1CC(N[C@@H](C)c2c(O)cccc2O)C1 2113005760 MCHJUEQAIREIGC-QWRGUYRKSA-N 264.369 2.231 10 10 CECE CNCc1ccc(N2CC[C@@H]3CCO[C@@H]3C2)cc1OC 2204544707 FXQIMMDQCMMBNC-MLGOLLRUSA-N 276.380 2.030 10 10 CECE CCn1cc(CN(C)c2ccc(CO)c(OC)c2)cn1 2204559460 PIKIOUYGOLPCBX-UHFFFAOYSA-N 275.352 2.040 10 10 CECE CC[C@H](O)[C@@H]1CCCCN1c1ccc(CO)c(OC)c1 2204545767 SYURYGLDSGJMMV-GJZGRUSLSA-N 279.380 2.317 10 10 CECE CCOc1[nH]c(=NCc2cccc(C)c2O)ccc1N 2204606028 QQIZBTIUZIXNJU-UHFFFAOYSA-N 273.336 2.111 10 10 CECE CSc1ncc(CNc2[nH]c(=N)ccc2[N+](=O)[O-])s1 2269304154 PXQHAAWJMQPLPF-UHFFFAOYSA-N 297.365 2.193 10 10 CECE COc1ncc(COc2ccc(C)nc2N)s1 2217112564 LTDAAWAIMWBGIN-UHFFFAOYSA-N 251.311 2.016 10 10 CECE CC[C@H](C)NC(=O)[C@H](C)NCc1cnc(SC)s1 2208472662 CZEGSHXTRUIRTC-IUCAKERBSA-N 287.454 2.258 10 10 CECE CO[C@]12CC[C@@H]1CN(c1ccc3c(c1)CC[C@@H]3O)C2 2230479479 SQAGRVUFWHEFGJ-KCXAZCMYSA-N 259.349 2.281 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@@H](OC(F)F)C1 2230658436 HDWGGXHKIGDKAH-DTWKUNHWSA-N 273.279 2.472 10 10 CECE CNC[C@@H]1CN(c2ccc(OC)c(C(C)C)c2)CCO1 2233168420 JWBRQMPPIKKAFS-CQSZACIVSA-N 278.396 2.243 10 10 CECE CN1C[C@@H]2CCC[C@H](C1)N2c1ccc2c(c1)CC[C@H]2O 2234727891 FXJQRNLLLWMYKX-HLLBOEOZSA-N 272.392 2.339 10 10 CECE Oc1ccccc1CN=c1nc[nH]n1-c1ccccc1 2234895337 QWCDOBBSCDPGKM-UHFFFAOYSA-N 266.304 2.007 10 10 CECE COc1ccc(N2CC3(CCC(O)CC3)C2)c(OC)c1 2235123384 YROMGHALGACWSH-UHFFFAOYSA-N 277.364 2.445 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccccc1C(=O)O 2225792446 NHKYLCOGVWSTNJ-UHFFFAOYSA-N 262.269 2.205 10 10 CECE COc1ccc(N2CCC[C@H](OC)CC2)c(C(=O)O)c1 2235959277 XEGAYKAVNLFULI-NSHDSACASA-N 279.336 2.399 10 10 CECE COc1ccc(N2C[C@@H](C)C[C@H](OC)C2)c(C(=O)O)c1 2235951049 BQQQWESUAFTOCS-JQWIXIFHSA-N 279.336 2.255 10 10 CECE CC[C@@H](COC)N(C)c1ccc(OC)cc1C[C@H](C)N 2235969933 KNEFCBRSHPASAE-JSGCOSHPSA-N 280.412 2.446 10 10 CECE CCNCc1cc(OC)ccc1N(CC)C[C@H](O)CC 2235953924 HYJIDPVDMMUZOC-CQSZACIVSA-N 280.412 2.402 10 10 CECE CCc1cccc(CNC[C@H]2CO[C@H]3C[C@@H]2C3)c1O 2226344090 SQZPKEBAILTXCF-SOUVJXGZSA-N 261.365 2.469 10 10 CECE OC[C@@H]1C[C@H]2CC[C@H]1N2c1ccc2c(c1)CCCO2 2226674116 XUBKTUVATOJDNM-GZBFAFLISA-N 259.349 2.361 10 10 CECE OC[C@@H]1CCCN(c2ccc3c(c2)OC(F)(F)O3)C1 2226699193 KIQIZDGVZNKXEA-SECBINFHSA-N 271.263 2.217 10 10 CECE CCC[C@H]1CN(c2ccc3c(c2)CCO3)C[C@H]1CO 2226745095 IKUADYHBTFLTRK-KBPBESRZSA-N 261.365 2.466 10 10 CECE CCC[C@]1(O)CCN(c2ccc(OC)cc2C=O)C1 2227693745 AGWISQWNZXWBRT-HNNXBMFYSA-N 263.337 2.249 10 10 CECE COc1ccc(N2CCC[C@@H](O)C2(C)C)c(C=O)c1 2227689918 JEBFELIBLGINMJ-CQSZACIVSA-N 263.337 2.247 10 10 CECE Nc1cc(NS(=O)(=O)c2ccccc2Cl)ccc1O 2227844273 SPOISKOTZXMULY-UHFFFAOYSA-N 298.751 2.429 10 10 CECE O=c1c2c(ccn1C[C@]13CCCC[C@@H]1C3)CCNC2 2228665997 PQZPLRZIVKPYTF-CZUORRHYSA-N 258.365 2.074 10 10 CECE CN(Cc1ccccc1O)[C@@H]1CCCCC12CNC2 2228954035 JHVVXGWVOMOKEQ-OAHLLOKOSA-N 260.381 2.356 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)[C@H]1CS(=O)(=O)C1(C)C 2240740789 GLIIMCDZDFGXEK-RISCZKNCSA-N 296.436 2.027 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)cc2C)CC[C@H]1OC 2240835218 HUJPRVZXARMJRS-MAZHCROVSA-N 278.396 2.255 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CCCC(=O)N(C)C 2240842184 PWWSQXGJZYPFMJ-CYBMUJFWSA-N 278.396 2.353 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)CCc1cnn(C)c1 2240839052 BCVZSMGKZKVIFL-ZDUSSCGKSA-N 272.396 2.427 10 10 CECE CNCc1ccc(N(C)Cc2nncs2)c(C)c1 2255272435 APTIXGFXQVSTJT-UHFFFAOYSA-N 262.382 2.202 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)O)c(C)c2)C[C@H]1F 2257464576 NBPCGJAKKVVUIA-GDLCADMTSA-N 253.317 2.221 10 10 CECE CSc1ncc(CNC[C@@H]2CC[C@@H](CO)S2)s1 2249506946 ITKHDAIDXGFSCQ-IUCAKERBSA-N 290.479 2.211 10 10 CECE Nc1ccc(CCOc2ccnc3c2CCO3)cc1 2270812357 XTQBDQKEVJDXHM-UHFFFAOYSA-N 256.305 2.220 10 10 CECE CCO[C@@]1(Cn2ccc3cc(N)ccc32)CCOC1 2271581230 ICNBCAXUCZMFOY-OAHLLOKOSA-N 260.337 2.419 10 10 CECE C[C@H](NC(=O)c1ccc(O)c(O)c1)[C@H]1CC12CCC2 2268384462 CXQPFCOIQRHZND-GXSJLCMTSA-N 261.321 2.406 10 10 CECE CSc1ncc(CNCc2ccn3cnnc3c2)s1 2269096276 RXUBUMLWAAOCIS-UHFFFAOYSA-N 291.405 2.198 10 10 CECE CCN(c1ccc(OC)c2c1CCC2)[C@H]1CCNC1 2269114595 NCOKSKJKCGIETA-LBPRGKRZSA-N 260.381 2.372 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@H](F)C2)c2c1CCC2 2269161608 HKLWKNIBQOJWBO-TZMCWYRMSA-N 265.328 2.093 10 10 CECE Cc1cc(N2C[C@H](O)CC3(CC3)C2)ccc1[C@@H](C)O 2269671853 BFYVXNPWCDDJFQ-TZMCWYRMSA-N 261.365 2.400 10 10 CECE CCN(CCN1CCCC1)c1ccc(OC)cc1CO 2279836417 QGXZMRLTIOQRTO-UHFFFAOYSA-N 278.396 2.110 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@@](=O)C[C@H]1CC1(C)C 2279953589 XPFWLOMJVGKTHT-HZNYWTHISA-N 294.420 2.391 10 10 CECE CC1CC2(C1)CC(NC(=O)c1cc(O)c(O)c(O)c1)C2 2280032940 GKGZMSACFSNDMJ-UHFFFAOYSA-N 277.320 2.112 10 10 CECE Oc1ccc(CNc2cccc3nc[nH]c23)c(O)c1O 2284273370 NRUXYUAVJPQUET-UHFFFAOYSA-N 271.276 2.292 10 10 CECE COc1ccc(N(CCO)C[C@H](C)O)c2ccccc12 2294612696 ZBJPGJOUTSIJGZ-LBPRGKRZSA-N 275.348 2.028 10 10 CECE Cc1cc(N(C)[C@H]2CCCCNC2=O)ccc1[C@@H](C)N 2285142300 YOWSCMZQUWMSJH-DOMZBBRYSA-N 275.396 2.120 10 10 CECE CCN(CC(=O)NC(C)C)c1ccc([C@H](C)N)c(C)c1 2285135221 NSIFCTDSKAORFS-ZDUSSCGKSA-N 277.412 2.366 10 10 CECE Cc1cc(N2CCOC(C)(C)[C@H]2CO)ccc1[C@H](C)O 2285160347 KEGPGOOYRGORNP-SWLSCSKDSA-N 279.380 2.024 10 10 CECE Cc1cc(N(C)[C@@H]2CCN(C)C(=O)C2)ccc1[C@@H](C)N 2285148603 CNEJLFRTNCZWST-TZMCWYRMSA-N 275.396 2.072 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CC[C@]3(CO)C2)cc1C 2285121383 LQOCMYPUXNVRMN-JKIFEVAISA-N 274.408 2.484 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1C[C@@H](CC(=O)O)C[C@H]1C 2285649666 GUHGRCFJPZQYCB-OUAUKWLOSA-N 279.336 2.344 10 10 CECE CNC(=O)[C@@H]1CCN([C@@H](C)c2cc(Cl)c(C)cc2O)C1 2286441058 AVBWNJCTRAVJCR-WDEREUQCSA-N 296.798 2.483 10 10 CECE CC[C@H](N)CN(CC)c1c(OC)cc(OC)cc1OC 2287147364 ZKVCADKNVFQWBV-NSHDSACASA-N 282.384 2.276 10 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Nc1ccc(CCCN2CC3(CC3)C[C@@H]2C(=O)O)cc1 2179711611 YQWJMQHRZUIALX-CQSZACIVSA-N 274.364 2.141 10 10 CECE COc1ccc(N2CC[C@@H]2CNC2CC2)c(OC)c1 710203529 IWDIZLKINWFNLB-GFCCVEGCSA-N 262.353 2.035 10 10 CECE Oc1c(F)cc(F)cc1CN1CCO[C@H]2CCC[C@H]21 708402909 XSLCGUGSBQSJKF-OLZOCXBDSA-N 269.291 2.424 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@@]1(C)CCOC1 687373662 SRAXTBXWSMOGSO-INIZCTEOSA-N 276.380 2.434 10 10 CECE CCN1CCc2cc([C@](C)(N)c3ccnn3C)ccc21 2163060864 DOSNQLZSOZGFEB-INIZCTEOSA-N 270.380 2.025 10 10 CECE CNCc1ccc(N(C)C[C@H](C)CO)cc1C(F)(F)F 688325546 IEFKTJNJWMGGRQ-JTQLQIEISA-N 290.329 2.489 10 10 CECE CO[C@@H](CN[C@H](C)c1c(O)cccc1O)C(C)C 381894622 KJGKWZPGAASXDM-MFKMUULPSA-N 253.342 2.419 10 10 CECE CCN(CCCOc1ccc(N)cc1)[C@H]1CCN(C)C1 693418070 BDBZRRHGWKHYSX-HNNXBMFYSA-N 277.412 2.064 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@H](SC)C3)ccc21 383173293 JRLZDMRLOQPDHF-FZMZJTMJSA-N 291.420 2.231 10 10 CECE COc1ccc(O)c(CN[C@H]2CCCC3(C2)OCCO3)c1 715599727 YWXQEOVHWIAZKQ-ZDUSSCGKSA-N 293.363 2.176 10 10 CECE Cc1cc(N2CC(O)(C3CC3)C2)ccc1CNC(C)C 384075310 WCUWZSIKKMUQJO-UHFFFAOYSA-N 274.408 2.454 10 10 CECE CCN1CC[C@@H](N[C@H](C)c2ccc(OC)cc2O)C1 389282429 UZIBYYXCJMRDLT-VXGBXAGGSA-N 264.369 2.146 10 10 CECE CCC(=O)NCCN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 392985191 IFNPPXKABAWGEG-RYUDHWBXSA-N 276.380 2.365 10 10 CECE COc1ccc(CNCc2nn(C)cc2C)cc1C 723512178 IWCISTAOWMGAET-UHFFFAOYSA-N 259.353 2.335 10 10 CECE CN1[C@H]2CC[C@H]1CN(c1ccc(CN)c(Cl)c1)C2 723922971 MVVNLUQVOXZVTI-STQMWFEESA-N 265.788 2.082 10 10 CECE CCN(CCn1nc(C)cc1C)c1ccc(CN)cc1 395725597 WWRRQOVPMLFDCB-UHFFFAOYSA-N 272.396 2.485 10 10 CECE CN1CCCc2cc(CNCCOC(F)F)ccc21 398175983 ACNKGJCUXPGODD-UHFFFAOYSA-N 270.323 2.398 10 10 CECE COc1ccc([C@@H](C)NCc2csnn2)c(O)c1 398294709 QZQDVEOOZKQMTO-MRVPVSSYSA-N 265.338 2.103 10 10 CECE CCNCc1ccc(N2C3COCC2COC3)c(Cl)c1 399767597 JXYBZPKHKQKRJU-UHFFFAOYSA-N 296.798 2.054 10 10 CECE COC1(C(F)(F)C(=O)NCC2(CN=[N+]=[N-])CC2)CCC1 2174351339 KPLVWPWDVOCSBU-UHFFFAOYSA-N 288.298 2.398 10 10 CECE 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260.381 2.309 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@H]2O[C@H]3CC[C@H]2C3)CC1 2352539088 MZVASFPFTPADEV-BJDJZHNGSA-N 264.329 2.245 10 10 CECE CO[C@H]1CC[C@@H]2CN(c3ccc([C@H](C)O)c(O)c3)C[C@@H]21 2353931866 HBUQJKVSWUKRSQ-VAECKANCSA-N 277.364 2.307 10 10 CECE CC(C)[C@@](O)(C(F)F)[C@@H](N)c1ccc(N(C)C)cc1 1893287139 BTTDCHWNOHKXLC-JSGCOSHPSA-N 272.339 2.405 10 10 CECE Nc1ccc(N[C@H](O)C(Cl)(Cl)Cl)cc1 306389168 WOSXLOXRVBKXAK-SSDOTTSWSA-N 255.532 2.369 10 10 CECE CC[C@H](N[C@@H](CC)c1ccccc1O)C(=O)OC 310875134 SHGAZOBKRKVRPV-RYUDHWBXSA-N 251.326 2.385 10 10 CECE O=C(N[C@@H]1C[C@@H]2[C@H]3CC[C@H](C3)[C@H]12)c1cccc(O)c1O 2357251790 YCUMBVSMANIOMI-BVPDVSAISA-N 273.332 2.262 10 10 CECE CC[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(N(C)C)cc1 180594485 LBYVNPKXPARENL-HOCLYGCPSA-N 299.422 2.400 10 10 CECE Cc1csc(CNCc2ccc(O)cc2O)n1 38090722 SKCBNPSMDCYZBN-UHFFFAOYSA-N 250.323 2.153 10 10 CECE COC[C@H]1CCN(c2ccc(/C=C\C(=O)O)cc2F)C1 211982691 NSYIIISBDNSRAD-FHMRSRPSSA-N 279.311 2.396 10 10 CECE CCOC(=O)[C@H](CCSCC)NCCCN=[N+]=[N-] 132705957 DWKSOCNZRRESSN-JTQLQIEISA-N 274.390 2.351 10 10 CECE COc1ccc(CN2CCC[C@H](CCC(=O)O)C2)c(O)c1 86809147 VBKICEKJTOWVMV-GFCCVEGCSA-N 293.363 2.478 10 10 CECE C[C@@H]1CCCC[C@H]1OC(=O)[C@H](N)Cc1ccc(O)c(O)c1 48633786 PRXDZLUBZDFSMG-IXPVHAAZSA-N 293.363 2.090 10 10 CECE CCN(Cc1cc(F)ccc1O)C[C@H]1CCCN1 233466696 CRONPJKWYKWZMD-CYBMUJFWSA-N 252.333 2.105 10 10 CECE C[C@@](F)(CO)c1cc(O)c(O)cc1Br 257844563 POUHSUHHGOCZFC-SECBINFHSA-N 265.078 2.037 10 10 CECE CN(C)c1ccc(CN(C(=O)c2ccnnc2)C2CC2)cc1 270455095 PWLDROHEMPFCGO-UHFFFAOYSA-N 296.374 2.347 10 10 CECE COc1ccc(O)c(CN2CC=C(c3ccnn3C)CC2)c1 289072619 AIYXIXJDLRKBTD-UHFFFAOYSA-N 299.374 2.424 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CNCC34CC4)ccc21 2163064974 ZPXIXYAMPJXFGL-GOEBONIOSA-N 272.392 2.102 10 10 CECE CN1CCc2cc([C@@H](O)C[C@@H]3CC4(CC4)CN3)ccc21 2163066355 LGTUDQGQBRHIAR-ZBFHGGJFSA-N 272.392 2.245 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CC[C@@H](C)CN3)ccc21 2163070899 JSJBLUHICXATSA-PVUWLOKVSA-N 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260.341 2.197 10 10 CECE CC[C@@]1(O)CCCN(c2ccc(CNC)cc2F)C1 710197508 GAQBIAWAUZLGIG-OAHLLOKOSA-N 266.360 2.286 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1CNC(=O)c1cccc(O)c1O 717053313 SVSYWAZBMYIRTR-LSKIRQOJSA-N 261.321 2.120 10 10 CECE CC1(C)CO[C@H](CNCc2ccc(O)cc2O)C1 717284975 MSWNUSLCWAOTBH-LBPRGKRZSA-N 251.326 2.003 10 10 CECE CCCOc1ccc(CN2C[C@H]3COC[C@@H]3C2)c(O)c1 718143330 BGXUSSDWBTYHBT-KBPBESRZSA-N 277.364 2.259 10 10 CECE C[C@H]1CCC[C@](O)(CNCc2cccc(O)c2O)C1 87051441 TZMXRKDPXLXNRK-XHDPSFHLSA-N 265.353 2.129 10 10 CECE CN(CC1C[C@H]2C[C@@H]2C1)C(=O)COc1ccc(N)cc1 698058733 MQICQRAZHLDDOW-STQMWFEESA-N 274.364 2.152 10 10 CECE CN(CCS(=O)(=O)C1CCCCC1)c1ccc(N)cc1 699916876 BTBBDIWXCZVIFZ-UHFFFAOYSA-N 296.436 2.453 10 10 CECE CC(C)Oc1ccc([C@@H](NCCN=[N+]=[N-])C(=O)O)cc1 90256334 RFHLJQCNRWOJFL-GFCCVEGCSA-N 278.312 2.499 10 10 CECE C[C@@H]1CN([C@@H](C)C(=O)Nc2ccc(N)cc2)C[C@@H]1C 92080935 YFQUYIGXKGOIOP-TUAOUCFPSA-N 261.369 2.184 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1nc2c(o1)CCCC2 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2.195 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@H](O)c1cnns1 2134098207 BCAVYSHIFNFMSJ-QWHCGFSZSA-N 279.365 2.018 10 10 CECE C[C@H]1[C@@H](O)CCN1c1ccc([C@@H](C)O)cc1Cl 1914407150 VQOKUVIYZQLEAG-RWEMILLDSA-N 255.745 2.353 10 10 CECE O=C(O)C=Cc1ccc(N2CC(OC(F)F)C2)cc1 1911944716 TXQPPKWCDBZDAX-UHFFFAOYSA-N 269.247 2.212 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@@H](O)c2ccccc2)C1 1912185093 LTRWSMCAWMSJGD-AAEUAGOBSA-N 274.324 2.269 10 10 CECE CCOC(=O)[C@@H](C)CN1CCC[C@@H](CN=[N+]=[N-])C1 1912188057 LTWUVXSGBLEMDK-QWRGUYRKSA-N 254.334 2.208 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(Cc2nnc3n2CCCC3)C1 1912177746 HJDZECNJGCXMKQ-LLVKDONJSA-N 275.360 2.137 10 10 CECE CN(C)CC(C)(C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1912209210 ZKPJZRFUCJFFPI-NSHDSACASA-N 267.377 2.123 10 10 CECE [N-]=[N+]=NCC1CCN([C@H]2CCO[C@@]3(CCOC3)C2)CC1 1912211318 VLUHSJOEDXYLLK-KBPBESRZSA-N 280.372 2.347 10 10 CECE CP1(=O)CCN(c2ccc3c(c2)CC[C@@H](N)C3)CC1 2134914814 PYVZZKWWYMDZSS-CQSZACIVSA-N 278.336 2.316 10 10 CECE 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C[C@H](c1cc(O)ccc1O)N1CC[C@H]2C[C@]1(C(=O)O)C2 2192560198 GOKOMZGNDNNSLB-FCHSOHFDSA-N 277.320 2.098 10 10 CECE Oc1ccc(CNc2cncc(Cl)n2)cc1O 1158994643 RIXDZWDKNZEJBJ-UHFFFAOYSA-N 251.673 2.153 10 10 CECE Cc1cc(CN)ccc1N(C)[C@H]1C2CCN(CC2)[C@@H]1C 2192777788 DLESCBBIXGZRCI-CXAGYDPISA-N 273.424 2.373 10 10 CECE CCN(CC)c1ccc([C@]2(O)CC[C@H]3CO[C@H]2O3)cc1 2196490042 IKTSBEPUAOHPHF-HRCADAONSA-N 277.364 2.256 10 10 CECE Nc1ccc(CC[C@H](O)CCCO[C@H]2CCOC2)cc1 2196475596 BVXDOPJHTUFAHW-CVEARBPZSA-N 279.380 2.148 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@@H]1CC(=O)N2CCC[C@@H]12 2188488388 XGLZKCFWORZLNV-UONOGXRCSA-N 294.782 2.032 10 10 CECE CN(C)c1ccc([C@@H](O)C(=O)CC[C@H]2CCOC2)cc1 2196559229 BOSPLWNTHGNQCW-BLLLJJGKSA-N 277.364 2.172 10 10 CECE CC[C@@H]1CC[C@@H](NC(=O)c2cc(O)c(O)c(O)c2)[C@H]1C 2188874943 MHRKZQJYWRZUKD-IQJOONFLSA-N 279.336 2.358 10 10 CECE NC[C@H]1C[C@@]2(CCN2c2ccc3c(c2)OC(F)(F)O3)C1 2182208276 SFRNBRMASXYSRS-GMZHKTEUSA-N 282.290 2.326 10 10 CECE 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267.712 2.273 10 10 CECE COc1ccc(O)c(CN[C@H](c2nccn2C)C2CC2)c1 183327095 WIRBGYJBCQJOTF-HNNXBMFYSA-N 287.363 2.375 10 10 CECE CCN1C[C@@H]2C[C@H]1CN2[C@@H](C)c1ccc(F)cc1O 2131023877 MHFAHVZNJWLCEW-DRZSPHRISA-N 264.344 2.371 10 10 CECE C[C@H](NC[C@@H]1CCCOC1)c1cc(O)ccc1O 38043932 RAOPGNCPOCJAMT-QWRGUYRKSA-N 251.326 2.175 10 10 CECE Nc1ccc(OCCN2CCCSCC2)cc1 42443263 LPUOALKFORPBSO-UHFFFAOYSA-N 252.383 2.087 10 10 CECE C[C@H](NC[C@@H](O)C(F)F)c1ccc(N(C)C)cc1 224449030 TZJKTZSXXDQCMA-JOYOIKCWSA-N 258.312 2.029 10 10 CECE CC1(CNCc2ccc(O)cc2O)CCOCC1 227835551 HRSLKNUHBCENAS-UHFFFAOYSA-N 251.326 2.004 10 10 CECE CS[C@H]1CCC[C@H]1NC(=O)c1cccc(O)c1O 229412843 HGKYLVOKKFNWEB-KOLCDFICSA-N 267.350 2.112 10 10 CECE CC[C@@H](C)N(CC(=O)O)Cc1cc(C)ccc1O 86752763 UHPGZYTVKDLMFM-LLVKDONJSA-N 251.326 2.386 10 10 CECE CC[C@H]1CO[C@@H](C)CN1[C@@H](CN)c1ccc(N(C)C)cc1 48914652 QWXFNSXLBZGFGG-QRTARXTBSA-N 291.439 2.252 10 10 CECE CN(C)c1ccc([C@@H](CC[C@H]2CCCO2)NN)cc1 97746976 KGEOCQWRCGYRQC-HUUCEWRRSA-N 263.385 2.216 10 10 CECE C[C@H](c1ccc(O)cc1O)N(CC(=O)O)C(C)(C)C 92450955 QYRBJPMQDKZHSW-SECBINFHSA-N 267.325 2.344 10 10 CECE CCN(CCN=[N+]=[N-])CCC(=O)N1CCCCCC1 2337779180 HUHBRDQATGUBPB-UHFFFAOYSA-N 267.377 2.411 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C(=O)C12CC(C1)C2 625916311 QJPMDSJDCBEQGY-UHFFFAOYSA-N 272.348 2.278 10 10 CECE CCN1CCc2cc([C@H](O)C[C@H]3CSCCN3)ccc21 2163068733 KYHQVMWXTQFXKP-GOEBONIOSA-N 292.448 2.198 10 10 CECE CN1CCc2cc(N3CC[C@@](CN)(C4CC4)C3)ccc21 2163072794 CPUWFEYFALDARX-KRWDZBQOSA-N 271.408 2.244 10 10 CECE NCCOCC[C@H](O)c1ccc(N2CCCCC2)cc1 2163113391 LASRMGAILWKUTJ-INIZCTEOSA-N 278.396 2.076 10 10 CECE Cc1ncc([C@@H](N)c2ccc3c(c2)CCCN3C)cn1 2163129707 ABGIPQZIYGZRLF-INIZCTEOSA-N 268.364 2.216 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H](O)CC(C)(C)OC 2163139053 UQOSOCRBVVIQDA-GJZGRUSLSA-N 280.412 2.189 10 10 CECE CN1CCc2cc([C@@H](Cc3ccccc3)NN)ccc21 2163138882 RRKMPCQBMLZBKV-MRXNPFEDSA-N 267.376 2.426 10 10 CECE CCN1CCc2cc([C@H](N)[C@H](O)c3cncs3)ccc21 2163141678 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C[C@@H](NC(=O)/C=C/c1ccncn1)c1ccccc1O 1648889621 FDZDKNFDIJVYSR-XUIVZRPNSA-N 269.304 2.073 10 10 CECE O=C(CCc1ccccc1F)NCc1ccc(O)cc1O 1570460696 AOHMFIJUYLDYIS-UHFFFAOYSA-N 289.306 2.486 10 10 CECE CCOc1cc(CNC)ccc1N1CCC(C(=O)O)CC1 212707980 SMGAHHPUBKIKLW-UHFFFAOYSA-N 292.379 2.106 10 10 CECE CCOC[C@@H]1CCN(c2ccc(CO)c(OC)c2)C1 2139682796 MKHBFELGYLJKPQ-GFCCVEGCSA-N 265.353 2.050 10 10 CECE COc1cc(N(C[C@H](C)OC)C(C)C)ccc1CO 2139684809 NICYOBMLHNAFOM-LBPRGKRZSA-N 267.369 2.437 10 10 CECE C[C@H]1CN(Cc2ccc(F)cc2O)C[C@]1(C)C(=O)O 2139769868 ZRWPBRBSWISDDH-XPTSAGLGSA-N 267.300 2.074 10 10 CECE Oc1ccc(CNCC2CCSCC2)cc1O 166316798 DMYUMXVPAFMCDH-UHFFFAOYSA-N 253.367 2.331 10 10 CECE Cc1ccc(O)c(CNCCC(=O)NC2CCCC2)c1 113326685 VNEKUKZSAOGTHH-UHFFFAOYSA-N 276.380 2.239 10 10 CECE NC(=O)[C@@H](Cc1ccc(N)cc1)c1ccccc1F 20227992 DLZRPVCJAXLCTR-ZDUSSCGKSA-N 258.296 2.220 10 10 CECE CC[C@@H]1C[C@@]1(N)[C@@H](O)c1ccc2c(c1)CCN2CC 2141315625 NWFBXWHDESGYJN-KBMXLJTQSA-N 260.381 2.230 10 10 CECE 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286.169 2.015 10 10 CECE CC1(C[C@](O)(CN)CSc2nccs2)CC1 1995474985 YITDDRTVFVGXRF-NSHDSACASA-N 258.412 2.115 10 10 CECE Nc1ccc(N2CCN(Cc3cncs3)C2=O)cc1 165365766 WWEDTQBIGUILKC-UHFFFAOYSA-N 274.349 2.168 10 10 CECE C[C@H](O)c1ccc(N2CC=C[C@@H]2CO)c(Cl)c1 2007531949 QTCAHEGMMAAKNA-GXSJLCMTSA-N 253.729 2.130 10 10 CECE COc1ccc(N(C)[C@H](CN)c2nn(C)cc2Cl)cc1 2153832781 PUVUREFNLSQFAT-CYBMUJFWSA-N 294.786 2.218 10 10 CECE C[C@H](c1cc(F)ccc1O)N(C)C[C@@H]1COCCCO1 2153986803 RGGOCNSRUFXJGH-DGCLKSJQSA-N 283.343 2.330 10 10 CECE Oc1ccc(CNC[C@@H](F)C(F)(F)F)cc1O 2009551210 FTZHLDNPPAKAQC-SECBINFHSA-N 253.195 2.088 10 10 CECE OCc1ccc(N2CCC=C[C@H]2CO)cc1Br 2011251052 LAJXUGLFBPMITP-LBPRGKRZSA-N 298.180 2.069 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@H]1CCCCO1 48946776 NZAOUHBQXSXDRI-OAHLLOKOSA-N 264.369 2.149 10 10 CECE COc1ccc(N2C[C@H]3CC[C@]3(N)C2)cc1Cl 2024012581 IWDZMFMYOQGRKK-RNCFNFMXSA-N 252.745 2.276 10 10 CECE CO[C@](C)(CNCc1ccc(F)cc1O)C1CC1 294059662 XRGRASDSDRABAR-CQSZACIVSA-N 253.317 2.436 10 10 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273.336 2.174 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@@H]1[C@@H]2CCCO[C@@H]21 2176455266 OWFBDVHEHWAYTM-XHSDSOJGSA-N 276.380 2.004 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O)cc1 2170632372 NLULDUKSRDMYOS-FRRDWIJNSA-N 298.452 2.225 10 10 CECE CCCN(c1ccc([C@@H](C)NC)cc1)[C@@H]1CCNC1=O 2171232389 ALNBGQNNOMWBLW-IUODEOHRSA-N 275.396 2.072 10 10 CECE Oc1c(CNc2cccn3cnnc23)ccc(F)c1F 2177074670 VFSJOSAUHLFLPY-UHFFFAOYSA-N 276.246 2.325 10 10 CECE CC(C)[C@H]1CNC(=O)CN1c1ccc([C@@H](C)N)cc1Cl 2181163483 SNTLQXYTJLTBQQ-QMTHXVAHSA-N 295.814 2.321 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2nnccc2C)c1 2192721307 MKWBFYAWYLGLLA-LLVKDONJSA-N 273.336 2.350 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@@H]1C[C@@H]2CCC[C@@H]21 2188770210 KAYVIVMKPUPRQM-WCFLWFBJSA-N 275.348 2.401 10 10 CECE C[C@@H](Cc1cccs1)NC(=O)c1cc(O)c(O)c(O)c1 2188875227 OZDBLSCCCZSVGR-QMMMGPOBSA-N 293.344 2.226 10 10 CECE CO[C@@H](c1noc(-c2sccc2O)n1)[C@H]1CCOC1 2093890589 JHWAYOQLETVQQQ-IONNQARKSA-N 282.321 2.228 10 10 CECE 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CC(C)(C)[C@H]1[C@@H](O)CCN1c1c(F)cc(CN)cc1F 2185115844 ZZXTVNZCRWVVTI-GXTWGEPZSA-N 284.350 2.409 10 10 CECE C[C@@H](N)c1ccc(N2CC([C@@H](F)CO)C2)cc1Cl 2048044319 IEYDYPSMXBWQDK-OQPBUACISA-N 272.751 2.126 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3C(N(C)C)[C@@H]3C2)c(F)c1 2194514125 PMTYCGUBJOQFGF-JMJZKYOTSA-N 282.334 2.014 10 10 CECE CC1(C)C[C@H](O)CCN1c1ccc(CN)cc1F 2050621670 POIXRCPKXQVZPE-LLVKDONJSA-N 252.333 2.024 10 10 CECE CC[C@@H](O)c1ccc(N2CC[S@](=O)C[C@H]2C)cc1 2051909615 SVFUHOMPFNWMQU-OMPKRAJASA-N 267.394 2.087 10 10 CECE Cc1cc(OC[C@H](C)F)ccc1N1CCNCC1 2056767724 VFDRBVMGMXUFBO-LBPRGKRZSA-N 252.333 2.141 10 10 CECE CC(C)NCc1cc(F)c(N2C[C@@H]3COC[C@H]32)c(F)c1 2186369381 DNBVIIAGHNDGCY-BXUZGUMPSA-N 282.334 2.298 10 10 CECE CN[C@@H](c1ccccc1O)[C@](C)(O)CCC(F)F 2057731852 UTBOIBNECCKZCC-QWHCGFSZSA-N 259.296 2.449 10 10 CECE CCCOc1cc(N(C)CC2CCNCC2)ccc1N 2191551888 ICBMFRXJHZCUAM-UHFFFAOYSA-N 277.412 2.493 10 10 CECE CC[C@@H](C)NC(=O)[C@@H](C)N1CCC[C@H]1CN=[N+]=[N-] 2059060447 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Cc1ccc(O)c2c1[C@H](C)C[C@H]2N(O)CC(=O)O 2081094381 UZICZUXQURRXBO-RKDXNWHRSA-N 251.282 2.025 10 10 CECE Oc1cccc(CN[C@H]2COC[C@@H]2CC2CC2)c1O 2101890486 PEYJYOITDNBDQM-STQMWFEESA-N 263.337 2.003 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)O 2201095592 GGMBDVUHSRFVRH-QSDJMHMYSA-N 277.320 2.096 10 10 CECE CCN1CCC[C@H](N(C)c2ccc(OC)cc2N)C1 2102502883 WOUMTKGVLJFYMA-LBPRGKRZSA-N 263.385 2.198 10 10 CECE COCCc1nsc(CN2CCC[C@H](N=[N+]=[N-])C2)n1 2102681755 SBHJJWNAUIADQW-VIFPVBQESA-N 282.373 2.002 10 10 CECE CN(c1ccc(CN)cc1Cl)[C@H]1CCN(C2CC2)C1 2103770928 XORMGSIVQUJMRY-ZDUSSCGKSA-N 279.815 2.472 10 10 CECE C[C@@H]1CC[C@H](CN)N(Cc2ccc(F)cc2O)C1 2084070201 LZIBYKSOFZYJDG-ZWNOBZJWSA-N 252.333 2.091 10 10 CECE CN1[C@H]2CC[C@@H]1C[C@@H](NCc1c(O)cccc1F)C2 2104478175 ZBRGTOSYAMOGML-CNDDSTCGSA-N 264.344 2.246 10 10 CECE [N-]=[N+]=NCCN[C@H](C(N)=O)c1cc2sccc2s1 2084704570 ITWFNXVTWPHZSG-VIFPVBQESA-N 281.366 2.389 10 10 CECE CN(C)c1ccc([C@H](N)C23CCCN2CCC3)cc1 2106798955 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CO[C@@H]1CCO[C@@H](CNCc2cccc(Cl)c2O)C1 2097909503 SROOCUIYILPCRO-VXGBXAGGSA-N 285.771 2.329 10 10 CECE CN[C@H](C)c1ccc(N2CC=C(CO)CC2)c(F)c1 2114549131 KQZNSGATGAAEAQ-LLVKDONJSA-N 264.344 2.235 10 10 CECE COc1ccc(O)c(CN[C@@H](C)[C@@]23CC[C@@H](CO2)C3)c1 2201984358 HJHVXVSJCMCIJG-OZVIIMIRSA-N 277.364 2.448 10 10 CECE CNC(=O)N1CCN([C@H](C)c2ccc(Cl)cc2O)CC1 2203364026 NBRWXRVAMAPYOG-SNVBAGLBSA-N 297.786 2.064 10 10 CECE CCCNCc1ccc(N(CC)C[C@@H](C)O)cc1OC 2204554723 TUARNGDDFZNUIO-CYBMUJFWSA-N 280.412 2.402 10 10 CECE COc1cc(N2C[C@@H]3CC[C@@H](OC)[C@H]3C2)ccc1CN 2204553796 IFRMGVUCSGBQTR-AEGPPILISA-N 276.380 2.015 10 10 CECE Cc1cccc(CNC(=O)CC[C@@H]2CC[C@@H](N)C2)c1O 2204626067 PYHBHXMLITYEQL-GXTWGEPZSA-N 276.380 2.224 10 10 CECE N[C@H](c1ccccc1O)C1(O)CC2(C[C@H]2C(F)(F)F)C1 2205155890 QAMZTHBYENLANC-OKZRHMCRSA-N 287.281 2.486 10 10 CECE COc1cc(N2[C@H](CO)CCC23CCC3)ccc1CN 2205683824 KAVZHHPHHLTENB-AWEZNQCLSA-N 276.380 2.038 10 10 CECE COc1ccc(N2CC(O)(C(C)C)C2)c2c1CCC2 2269182269 VCMVULLFXKHGPT-UHFFFAOYSA-N 261.365 2.391 10 10 CECE Cc1cc(N(C)Cc2cncn2C)ccc1[C@H](C)N 2269661633 HGSUZTQHKCUAMH-LBPRGKRZSA-N 258.369 2.385 10 10 CECE OC[C@]12CCC[C@@]1(CNCc1ccc(F)c(F)c1O)C2 2208153109 KNERHPVQNLRFDR-LSDHHAIUSA-N 283.318 2.313 10 10 CECE CCOc1cccc(CN[C@@H]2[C@@H]3[C@H]4C[C@@H]5[C@H]([C@H]43)[C@@H]52)c1O 2208384745 BVYCXXIUULWPBK-ZSZHGXAVSA-N 271.360 2.391 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)C12CCC(CC1)O2 2218736582 ADNPZAFHYAIOAT-QLWZBITOSA-N 250.302 2.046 10 10 CECE COc1ccc(N2CCC[C@](C)(CO)C2)cc1F 2219606691 BRMVXUNKCQETCE-AWEZNQCLSA-N 253.317 2.433 10 10 CECE CCC1(CN2CCc3cc([C@@H](C)N)ccc32)COC1 2271535951 DFKGHGMWPUHMHJ-GFCCVEGCSA-N 260.381 2.495 10 10 CECE C[C@@H](O)CN(c1ccc([C@@H](C)N)c(O)c1)C(C)(C)C 2272451925 HEYDURLWDIRSFU-GHMZBOCLSA-N 266.385 2.398 10 10 CECE COc1ccnc(C)c1NCc1ccc(O)cc1O 2230121361 WLBFPNFPSDTUJL-UHFFFAOYSA-N 260.293 2.422 10 10 CECE COc1ccc(N2CC[C@H]3C[C@@]3(F)C2)c(CCN)c1 2230345321 CHIOGJGPONHHHH-SWLSCSKDSA-N 264.344 2.135 10 10 CECE COc1ccc(N(C)[C@H]2CS[C@H](C)C2)c(CN)c1 2220410665 ZGXRBPXFDMBDNB-ZYHUDNBSSA-N 266.410 2.484 10 10 CECE NCc1ccc(N2[C@H](CO)C[C@@H]3CCCC[C@H]32)cc1 2231990813 XLGBBZXIDIBIHU-CWRNSKLLSA-N 260.381 2.275 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc([C@H](C)O)cc1C 2232096018 LYOHYWCAMULJIV-AEGPPILISA-N 260.381 2.331 10 10 CECE COC[C@@]12C[C@H]1CN(c1ccc([C@@H](C)N)cc1C)C2 2232106439 MESWEVIWWXYXDI-INWMFGNUSA-N 260.381 2.487 10 10 CECE NCc1ccc(N2CC[C@@H]3[C@H]2C[C@]3(O)C(F)(F)F)cc1 2233764432 GESVQSMQPAOCOS-JHJVBQTASA-N 286.297 2.037 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]3C2)c(F)c1 2224668159 DCDYXFYBRLMNEG-ZFVXVEAMSA-N 264.344 2.053 10 10 CECE COc1ccc(N2CCCC[C@@]23CCOC3)c(CN)c1 2235958268 JSAPLRPYKJYLHO-INIZCTEOSA-N 276.380 2.303 10 10 CECE COc1ccc(N(C)C(C)(C)CO)c(CNC(C)C)c1 2235967697 JLJSOAFMXLNMAW-UHFFFAOYSA-N 280.412 2.400 10 10 CECE COc1ccc(N2CC[C@H]([C@@H]3CCCO3)C2)c(CO)c1 2236000775 BNUUSAXUQPVBMI-LRDDRELGSA-N 277.364 2.193 10 10 CECE COc1ccc(N(C)C2(CO)CCCCC2)c(CO)c1 2236000769 BMVDIJNJXRYPGP-UHFFFAOYSA-N 279.380 2.319 10 10 CECE OC[C@H]1CC(F)(F)CN1c1ccc2c(c1)CCCO2 2226669956 JSZINGMXUKXECA-GFCCVEGCSA-N 269.291 2.218 10 10 CECE OC1([C@H]2CCCN(c3ccc4c(c3)CCO4)C2)CC1 2226752365 KKGGZWBMNSPXOX-ZDUSSCGKSA-N 259.349 2.363 10 10 CECE O[C@@H]1CCC2(CC2)N(c2ccc3c(c2)CC[C@H]3O)C1 2227479148 YKVQDALEYCZJQU-UKRRQHHQSA-N 259.349 2.160 10 10 CECE C[C@H]1CCC[C@@H](S(=O)(=O)Nc2ccc(O)c(N)c2)C1 2227843244 PIFDFPDZHBBZTQ-GXSJLCMTSA-N 284.381 2.295 10 10 CECE Nc1ccc(CCCNCC23COCC(C2)C3)cc1 2228108795 JWKOFGKHBMTPII-UHFFFAOYSA-N 260.381 2.218 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@]3(OC)C2)c(C(=O)O)c1 2238692778 OMDALQLQAITUMS-ZUZCIYMTSA-N 277.320 2.009 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1CC[C@@H]2C[C@]2(F)C1 2238604647 ZMAZALKGTDWCFY-HFAKWTLXSA-N 277.343 2.030 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)[C@@H]1C[C@@H]2C[C@@H]2C1 2238935947 AGYMLVPYIAZLSK-FJJYHAOUSA-N 273.380 2.326 10 10 CECE CO[C@]12CC[C@@H]1CN(c1ccc(C[C@H](C)N)c(C)c1)C2 2239094831 XLMRSQKICSEAIC-LXZKKBNFSA-N 274.408 2.500 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCS(=O)(=O)[C@H](C)[C@@H]1C 2240841630 JMTDMDGCBZBKQQ-RWMBFGLXSA-N 297.420 2.060 10 10 CECE Cc1cc([C@H](C)O)ccc1N1[C@H]2CC[C@H]1[C@H](F)[C@H](O)C2 2240831508 XTAHULDBNXWPSY-QJXWRWMASA-N 279.355 2.488 10 10 CECE Nc1ccc(CC(=O)NCCCSC(F)F)cc1 2253459925 UBKRQTKOXOMJKU-UHFFFAOYSA-N 274.336 2.273 10 10 CECE COc1c(C(=O)NCCN=[N+]=[N-])csc1Cl 2243745842 SYNXPFIMGZMQKJ-UHFFFAOYSA-N 260.706 2.450 10 10 CECE CSc1ncc(CNCC(C)(C)[C@@H](C)N)s1 2243857049 RJYIHLOXFPLTRQ-MRVPVSSYSA-N 259.444 2.328 10 10 CECE COc1c(F)cc(N2C[C@H](C)[C@H](CN)C2)cc1F 2256195781 BRXILWHMYMYZNJ-DTWKUNHWSA-N 256.296 2.004 10 10 CECE CC(C)=CC[C@@H](O)c1ccc(N2CCNCC2)cc1 2270556131 BNZWHZBRQAZJDH-MRXNPFEDSA-N 260.381 2.486 10 10 CECE COc1cccc(CNC[C@@]2(C)CCC[C@H]2O)c1O 2271301866 PUYVKUXICKPCLK-UKRRQHHQSA-N 265.353 2.042 10 10 CECE CCc1nn[nH]c1CN[C@@H](C)c1cc(F)ccc1O 2274593413 UVCCYLXNPMUIFM-QMMMGPOBSA-N 264.304 2.063 10 10 CECE CC(C)c1nsc(CNCc2cccc(O)c2O)n1 2274679998 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CC[C@@]1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])CCCO1 2312333558 PULXQUCIXXCZGH-SCVCMEIPSA-N 252.318 2.293 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H]2[C@@H](C1)C2(F)F 2315986090 AMPPAEINUBKALF-PSVAKVPMSA-N 258.272 2.437 10 10 CECE CCN(CCN=[N+]=[N-])CC1(C(=O)OC)CCCC1 2315986543 FICXDRXXMCRFKD-UHFFFAOYSA-N 254.334 2.352 10 10 CECE COCCNCc1ccc(N2CCSC2)cc1C 2320268833 UHVPUZDUKBSMOI-UHFFFAOYSA-N 266.410 2.242 10 10 CECE O=C(NCc1ccccc1O)[C@H]1CC[C@@H]2[C@H]1C2(F)F 2329188526 QRBUBGYQBCVEMZ-UMNHJUIQSA-N 267.275 2.300 10 10 CECE CN1N=C(C(F)(F)F)C(=Cc2ccc([N+](=O)[O-])cc2)C1=O 2332148498 UHKSZXMJYVEHPR-UHFFFAOYSA-N 299.208 2.369 10 10 CECE CSc1ncc(CN[C@](C)(C(=O)O)[C@H]2C[C@H]2C)s1 2326013418 QZJWBBYJVZAVMZ-FDOIEUKUSA-N 286.422 2.454 10 10 CECE CSc1cc(N2CCOC3(CC3)C2)ccc1CN 2328543312 NJQKRYUOIPWXPN-UHFFFAOYSA-N 264.394 2.236 10 10 CECE O=C(NC[C@@H]1C[C@H]2C=C[C@@H]1C2)c1ccc(O)c(O)c1 2330552833 GUOAVSOMPLPCQK-UMNHJUIQSA-N 259.305 2.040 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)cc1Cl 2330983253 CIMQBUCGVQBZOP-GMXABZIVSA-N 280.799 2.409 10 10 CECE CN[C@@H](C)c1cc(F)c(N2C[C@@H]3COC[C@@H]32)c(F)c1 2332370398 BBZBHTOJUCFJOA-PLMOITTCSA-N 268.307 2.080 10 10 CECE Nc1ccc(NC(=O)CO[C@H]2CCC[C@@H]3C[C@H]23)cc1 2333324669 NSSYONCYNLYFAN-SWHYSGLUSA-N 260.337 2.413 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1[C@H]2CC[C@H](C2)[C@@H]1CO 2333979486 YYXKRLOQIFEXJC-UYHMYPTGSA-N 261.365 2.398 10 10 CECE CN(CCCCN=[N+]=[N-])C[C@H]1COC2(CCC2)CO1 2338473680 MGDRRHSZGARAEZ-LBPRGKRZSA-N 268.361 2.347 10 10 CECE C[C@H]1CCN(c2ccc(CN)c(C3CC3)c2)C[C@@H]1O 2339143284 IVQVFYLTAIWUFT-ZBEGNZNMSA-N 260.381 2.230 10 10 CECE Cn1cc(NCc2ccc(N)cc2)c(OC(F)F)n1 2339373589 CIQHQESCJBDQDO-UHFFFAOYSA-N 268.267 2.216 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2CCCc1ccc(N)cc1 2340773898 HFLLKMFTIMPBGD-CWRNSKLLSA-N 260.381 2.311 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCN3CC[C@H]2C3)c1C 2340855318 FMPZZUPRXQCMFS-KGLIPLIRSA-N 260.381 2.251 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC3(CC[C@@H]3O)C2)c1C 2341062172 SFSGPYFKSYUNFN-DOMZBBRYSA-N 260.381 2.284 10 10 CECE Cc1cccc(CN2C[C@H]3C[C@H]2C[C@H]3N(C)C)c1O 2341128482 VDRJRQIFLSOVPZ-QLFBSQMISA-N 260.381 2.225 10 10 CECE C[C@H](NC[C@@]1(O)C[C@H]1C(F)(F)F)c1ccccc1O 2344264099 BHLMJELTQYVFOJ-AXTRIDKLSA-N 275.270 2.356 10 10 CECE COc1ccc(N2CC[C@@H](N)C2(C)C)c2c1CCC2 2352343728 QOVYXUBZRCDTFB-OAHLLOKOSA-N 260.381 2.500 10 10 CECE CSc1cc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)ccc1CN 2353857563 VPBPBSYDQXOEGM-OSMZGAPFSA-N 278.421 2.217 10 10 CECE CC1(C)[C@@H](O)[C@@H]2CCN(c3ccc(CN)c(F)c3F)[C@@H]21 2355696594 YJSRGKHSAIAKDO-IIMNLJJBSA-N 282.334 2.019 10 10 CECE CSc1ncc(CNC[C@]2(F)CCOC2)s1 2208790205 HDTPEBORNUQPBP-SNVBAGLBSA-N 262.375 2.083 10 10 CECE [N-]=[N+]=NCCNC(=O)COc1cccc(Cl)c1 51018792 DTUUJNHZKPOWAA-UHFFFAOYSA-N 254.677 2.145 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3Cc4ccccc4C3)ccc21 106800599 SRDDQIIQYVYJOI-INIZCTEOSA-N 279.343 2.419 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC[C@@H]1[C@@H]1CCCN1 51357036 IRYCZDQVVLSUTP-TUKIKUTGSA-N 276.380 2.375 10 10 CECE Cc1ccc(NC(=O)Cc2ccc(N)cc2)cc1C(=O)O 110988365 INIMWBBQRMFLJF-UHFFFAOYSA-N 284.315 2.457 10 10 CECE C[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 301621168 XWWPOYBSKYMSTG-SECBINFHSA-N 291.307 2.162 10 10 CECE N=C(NCc1ccc(N2CC=CC2)cc1)N1CCCC1 172674703 JLQGVYHDQYLBOE-UHFFFAOYSA-N 270.380 2.183 10 10 CECE COC[C@](C)(CN(C)c1ccc([C@H](C)N)cc1)OC 1894309809 YWSQOECWKLSPDJ-WFASDCNBSA-N 266.385 2.194 10 10 CECE COc1ccc(CNCc2ncccc2F)c(O)c1 126150185 PYHFYTWMBNWDHP-UHFFFAOYSA-N 262.284 2.225 10 10 CECE COc1ccc(C(C)(C)N)c(O)c1Br 218051993 YGKTWNFXYBTEMA-UHFFFAOYSA-N 260.131 2.357 10 10 CECE CC(C)Cn1c(S)nnc1-c1cccc(O)c1O 126607953 UUKBIYRTTGWAPN-UHFFFAOYSA-N 265.338 2.301 10 10 CECE CC[C@@H](NCCCn1ccnn1)c1ccc(N(C)C)cc1 184269687 HVLOCOHMQRJKRW-MRXNPFEDSA-N 287.411 2.475 10 10 CECE CC(C)N(Cc1ccc(N)cc1)c1cc(C(N)=O)ccn1 37671760 NMPBALCLUHEJID-UHFFFAOYSA-N 284.363 2.178 10 10 CECE C[C@H](NCc1cc(C(N)=O)co1)c1ccc(F)c(F)c1O 187925882 ZFXQXKAJTOOYJZ-ZETCQYMHSA-N 296.273 2.213 10 10 CECE Cc1ccc(NC(=O)Nc2cc(O)c(O)c(O)c2)nc1 217278998 BKHXEYXFDCKMJJ-UHFFFAOYSA-N 275.264 2.151 10 10 CECE CN(C(=O)Cn1cnc2c1CCCC2)c1ccc(N)cc1 216755123 MWCKDHVIHGOALA-UHFFFAOYSA-N 284.363 2.007 10 10 CECE N=C1N=C(S)NC(=O)/C1=C/C=C/c1ccccc1 40176435 OOUDNHIRGSXCJE-DAAQNPAKSA-N 257.318 2.019 10 10 CECE COc1ccc(CNCc2cccc3c2OCO3)c(O)c1 40906863 XFKHUCPOEXYTIU-UHFFFAOYSA-N 287.315 2.419 10 10 CECE N[C@@H]1CCCN(c2ccc(OC[C@@H]3CCCO3)cc2F)C1 226901017 XLZGNKDJDHTKGB-OCCSQVGLSA-N 294.370 2.311 10 10 CECE CN(C)c1ccc(/C=C/C(=O)NCc2ccc[nH]2)cc1 41530359 GOSBGBIBNNDJEH-JXMROGBWSA-N 269.348 2.410 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1cncs1 233480380 RGLISPBGBZNJOD-UHFFFAOYSA-N 261.350 2.388 10 10 CECE CN[C@H](CO)c1cc(Br)c(C)c(C)c1O 238358137 CMPGRVTWVLVGDZ-SNVBAGLBSA-N 274.158 2.024 10 10 CECE CCc1ccc(C[C@H](NN)c2ccc(N(C)C)cc2)nc1 97764498 FLYJCFQWQQFUNE-KRWDZBQOSA-N 284.407 2.457 10 10 CECE O=C(O)CC1CCN(c2ccc3c(c2)CCO3)CC1 606594302 DVJXCHHZZDDUDG-UHFFFAOYSA-N 261.321 2.313 10 10 CECE CC(C)(N)Cc1cc(Br)cc(O)c1O 258449390 RFRLYTRYSJJRTR-UHFFFAOYSA-N 260.131 2.140 10 10 CECE CC(C)(C)OC(=O)NC1([C@@H](N)c2ccccc2O)CC1 259188385 FANDKVBNOMZMLR-LBPRGKRZSA-N 278.352 2.449 10 10 CECE CC(C)[C@H]1C[C@H]1C(=O)NCCc1ccc(O)c(O)c1 184959917 RFDVXLZJMDFBGZ-VXGBXAGGSA-N 263.337 2.049 10 10 CECE NC(=O)c1ccccc1[C@H]1CNc2ccccc2N1 616680771 OXOJRTDCWKNAIL-CQSZACIVSA-N 253.305 2.364 10 10 CECE Cc1ccc(O)c(CN2CCCC[C@@H]2[C@@H]2CNC(=O)C2)c1 367547145 RDLMCRHBKVBAIQ-DZGCQCFKSA-N 288.391 2.191 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1CCc2nc[nH]c2C1 368220347 FLPPKHIVEULOIV-VIFPVBQESA-N 277.755 2.416 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2CCn3ccnc3C2)cc1 2165226453 FRQYTXCEXUULGA-BBRMVZONSA-N 271.364 2.245 10 10 CECE CCc1nc([C@@H](NN)c2ccc3c(c2)CCN3C)cs1 2163140385 IPMRLYTVNJRRPV-HNNXBMFYSA-N 288.420 2.251 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)c1occc1C(=O)O 2164152736 UMHNHKZETSAQKW-ZDUSSCGKSA-N 274.320 2.353 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3COCCC3(F)F)ccc21 2166689509 ZCOCYGHJDSCMME-OCCSQVGLSA-N 283.318 2.384 10 10 CECE Nc1ccc(COCc2ccc3nncn3c2)cc1 2131277086 ZHNRKUZJPVQBCL-UHFFFAOYSA-N 254.293 2.028 10 10 CECE CO[C@@H]1C[C@@H]1C[C@H](N)c1ccc2c(c1)CCCN2C 2131651281 OFQMSWVATXMRII-OFQRWUPVSA-N 260.381 2.494 10 10 CECE COC[C@H]1CN(C/C=C\c2ccc(N(C)C)cc2)CCO1 835025136 FZEZSSYXYAWTBE-VGOKWCNXSA-N 290.407 2.113 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@@H]1CNCCC1(F)F 841080987 RPNJERXFSOHMAM-CQSZACIVSA-N 283.366 2.148 10 10 CECE COc1cccc([C@H](C)Nc2cn(C)nc2OC)c1O 846166904 PPWAIUXRLUUCJQ-VIFPVBQESA-N 277.324 2.316 10 10 CECE Cc1ccc(C(=O)N2CCO[C@@H](C3CCC3)C2)c(O)c1O 840492024 QTPMAKLFDLKPQH-CYBMUJFWSA-N 291.347 2.047 10 10 CECE COc1ccc(N(C)C[C@@H](OC)[C@H]2CCOC2)cc1OC 851734568 HYZMGGRVBWBEES-BLLLJJGKSA-N 295.379 2.192 10 10 CECE C[C@H](O)CC(C)(C)CNC(=O)NCc1c(O)cccc1F 920308570 AIDAJBAYZHDGDX-JTQLQIEISA-N 298.358 2.128 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(CC)on1 935943802 FEMZIFCZCZOEJL-UHFFFAOYSA-N 295.335 2.358 10 10 CECE COCCNC[C@H]1CCN1c1ccc(OC)c(Cl)c1 696344500 BCZIOXSIIVXMLW-GFCCVEGCSA-N 284.787 2.163 10 10 CECE COc1cc(O)c(CNCCOCC2CCC2)cc1OC 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2.448 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3CO[C@@H](C3)C2)c(F)c1 2095977604 JCLVGNZQFHPSEL-GVXVVHGQSA-N 264.344 2.331 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@]2(C)CO)cc1O 2097237079 IQIOVOVGJLSWFZ-IAQYHMDHSA-N 264.369 2.024 10 10 CECE CC(C)SC1CN(c2ccc(CO)cc2[N+](=O)[O-])C1 2097624420 SSDFQJIRNJHMGS-UHFFFAOYSA-N 282.365 2.417 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@]3(C[C@@H](O)CO3)C2)cc1Cl 2201766249 ANKABEZPLBRMHR-HCKVZZMMSA-N 297.782 2.123 10 10 CECE CN1CCN(Cc2ccc(N)cc2)c2cccnc21 2114742944 WPYVTTLBERDALV-UHFFFAOYSA-N 254.337 2.120 10 10 CECE CC=CC[C@@H](N)C(=O)N(C)[C@H](C)c1ccccc1O 2120768263 OULYKLADBVISGG-DGCLKSJQSA-N 262.353 2.205 10 10 CECE CC[C@@H]1COC[C@H]1N(C)c1ccc(CNC)c(OC)c1 2204536048 LFTLHSHHIIBEPD-IUODEOHRSA-N 278.396 2.276 10 10 CECE COc1cc(N(C)C[C@@H]2CCCCN2C)ccc1CO 2204541000 GJVFIRPKXUGLFW-HNNXBMFYSA-N 278.396 2.108 10 10 CECE COc1cc(N2C[C@H](N(C)C)CC2(C)C)ccc1CN 2204540732 CGFJHPOPWZNAEH-CQSZACIVSA-N 277.412 2.073 10 10 CECE COc1n[nH]cc1CN[C@H](C)c1cc(C)ccc1O 2268599117 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2232105865 XMKLDTWWSVQTRZ-ZDUSSCGKSA-N 259.353 2.381 10 10 CECE COc1ccc(O)c(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])c1 2234168737 MAXRGYGKVXEEGD-WDEREUQCSA-N 276.296 2.362 10 10 CECE CCN1CCc2cc(N3CCC4(CC(O)C4)C3)ccc21 2235035711 JEZBICDPPOEVRI-UHFFFAOYSA-N 272.392 2.420 10 10 CECE CN1CCc2cc(N3C[C@@H](CO)C4(CCC4)C3)ccc21 2235115649 PPGUHBSMYYTLEF-AWEZNQCLSA-N 272.392 2.278 10 10 CECE CCOC(=O)[C@H]1CCCN1c1ccc(OC)cc1C=O 2235983391 OAYJFVXDZDJFOF-CQSZACIVSA-N 277.320 2.040 10 10 CECE CCCOc1ccc(N2C[C@@H](C)O[C@@H](CO)C2)cc1 2226757798 RMBAUCGXTIEYJQ-IUODEOHRSA-N 265.353 2.061 10 10 CECE COCCNC[C@@H]1C[C@H]1COc1ccc(N(C)C)cc1 2237680964 ULYSIOFCZJGGOI-KBPBESRZSA-N 278.396 2.004 10 10 CECE COc1ccc(N(C)[C@H]2COCC[C@@H]2C)c(C=O)c1 2227696560 OEAPLSOJWGFRBJ-NHYWBVRUSA-N 263.337 2.369 10 10 CECE COCCNCc1cc(OC)ccc1N(C)C(C)C 2227674004 SYINKYQIFBUVID-UHFFFAOYSA-N 266.385 2.276 10 10 CECE CO[C@H]1CC[C@H]1COC(=O)CCc1ccc(N)cc1 2227935929 JGGVVYMMJAPYAU-JSGCOSHPSA-N 263.337 2.170 10 10 CECE CNC(=O)[C@@H]1CCCCN1c1ccc([C@@H](C)O)cc1C 2240832163 ZLEHNBWVQLCVTP-DOMZBBRYSA-N 276.380 2.153 10 10 CECE CSc1ncc(CNC[C@@]2(C)CC[C@H](N)C2)s1 2248743506 JYCAWZYPPXLQOW-CABZTGNLSA-N 271.455 2.472 10 10 CECE COc1cc(OC)c(N(C)[C@@H]2CCC[C@H]2O)cc1OC 2289448905 VSOMGNMENKZLAL-ZYHUDNBSSA-N 281.352 2.062 10 10 CECE CCc1nsc(CNCc2cccc(OC)c2O)n1 2273038940 KTALRPRQCLWAJB-UHFFFAOYSA-N 279.365 2.105 10 10 CECE CC1(C)CC([S@](=O)CC(=O)Nc2ccc(N)cc2)C1 2273299701 QFIACSPUAYGYTJ-LJQANCHMSA-N 280.393 2.145 10 10 CECE COc1ccc(N(C)[C@H]2CCN(C(C)C)C2=O)cc1 2264361247 GJZHAZQDQFDWRK-AWEZNQCLSA-N 262.353 2.141 10 10 CECE Cc1cc(N2CCN(C)C3(CC3)C2)ccc1[C@H](C)O 2269675505 VTUXCYIBRFVJHG-ZDUSSCGKSA-N 260.381 2.333 10 10 CECE COc1ccc(N2CCC[C@@H]3CCNC[C@@H]32)cc1OC 2290212427 HDRBIKVGARACMG-OCCSQVGLSA-N 276.380 2.282 10 10 CECE CN(C)c1ccc(C=CC(=O)O[C@@H]2C=CCOC2)cc1 2285667739 NHUGYGPYHBIEQT-OAHLLOKOSA-N 273.332 2.264 10 10 CECE COc1cc(OC)c(N2C[C@@H](O)CC2(C)C)c(OC)c1 2287068617 JBKVRQWZVSHUDO-JTQLQIEISA-N 281.352 2.062 10 10 CECE C[C@@]1(CNCc2cccc(F)c2O)CC=CCO1 2317894552 YVEFFJTWKFIAMI-AWEZNQCLSA-N 251.301 2.356 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@H]2NCc1cccc(F)c1O 2329224503 VYTTVNHBCGGFOL-HBJVGIJOSA-N 265.328 2.434 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@]12C[C@@H](OC)[C@@H]1C2 2329486625 GSCYLUTXRBWSRS-FZKCQIBNSA-N 260.381 2.438 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@@H]2C[C@@H](C(=O)O)[C@@H]2C1 2330520234 HCQPMMYZGSRKMG-YRRQLQLVSA-N 261.321 2.106 10 10 CECE CCCc1nnsc1CNCCc1ccc(N)cc1 2335823329 FVCJCOWJSWNCFG-UHFFFAOYSA-N 276.409 2.405 10 10 CECE COc1ccc(N2CC[C@@](F)(C(F)F)C2)c(CO)c1 2337746049 XZLYPMZNGNELAD-ZDUSSCGKSA-N 275.270 2.371 10 10 CECE CC(=O)N(C)CCN(C)c1ccc([C@@H](C)N)c(Cl)c1 2339458430 CQWZNSXDDJKPHZ-SNVBAGLBSA-N 283.803 2.274 10 10 CECE Cc1c([C@H](C)N)ccc(N2CCOC[C@H]2CF)c1C 2340861084 FPCSARUJLXGWPH-QWHCGFSZSA-N 266.360 2.498 10 10 CECE Oc1cccc2c1[C@H](NC[C@]1(O)CCCSC1)CC2 2343692622 HBPYUGBBIDIRCR-IUODEOHRSA-N 279.405 2.227 10 10 CECE CCNCc1ccc(N2CC[C@H](O)[C@@H](C)[C@@H]2C)cc1 2344574190 KSEDRFLWNMXCAQ-XEZPLFJOSA-N 262.397 2.392 10 10 CECE CSc1cc(N2CCN(C)[C@H]3CC[C@@H]32)ccc1CN 2353855186 GXNRJAWFRQWZJT-KBPBESRZSA-N 277.437 2.150 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3C[C@H]4C=C[C@@H]3C4)c(Cl)cc21 2354469441 KHAYDTWGNBPPTP-ATEUNZGCSA-N 289.766 2.317 10 10 CECE COCCNCc1ccc(N2CC=C(C)C2)c(F)c1 1893059254 NHWPCXMHPMHNNN-UHFFFAOYSA-N 264.344 2.328 10 10 CECE CO[C@@]1(C)CCN(c2ccc([C@@H](C)N)cc2F)C1 311008463 JPCCTCMSUKYIPH-YGRLFVJLSA-N 252.333 2.461 10 10 CECE Cc1ccc(/C=C/C=C2C(=O)OC(C)(C)OC2=O)o1 59379680 KGCTUBIRNPPJLR-SNAWJCMRSA-N 262.261 2.364 10 10 CECE C[C@H](NCc1nnc2ccccn12)c1ccc(F)cc1O 62745268 MOBPGISAEOOXGD-JTQLQIEISA-N 286.310 2.425 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H]1C[C@@H]2[C@@H]1[C@@H]1CC[C@H]2O1 2356958502 JAPDPNWEMUPFQN-AMMHQNNLSA-N 276.355 2.287 10 10 CECE O=C1Nc2cc(N3CC[C@H]4C=C[C@@H]3C4)c(Cl)cc2[C@H]1O 2357579631 MIZZYWBAJJTUTC-RFXMVYNHSA-N 290.750 2.480 10 10 CECE CC(C)N(Cc1ccc(N)cc1)c1ncnc2nc[nH]c12 37671713 GOZJEIYHJBODDY-UHFFFAOYSA-N 282.351 2.350 10 10 CECE CC(=O)N(C(=O)N/C=C/C1CC1)c1ccc(N)cc1 218969312 JBKIEGJCLYKWSI-CMDGGOBGSA-N 259.309 2.255 10 10 CECE COc1ccc([C@@H](C)N[C@@H](C)CN2CCCC2=O)c(O)c1 37782977 NAHAPIGIRLJMDH-NWDGAFQWSA-N 292.379 2.062 10 10 CECE CCCN[C@H](C)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 222114269 GEKJXFNMEGSQLZ-UKRRQHHQSA-N 289.423 2.449 10 10 CECE COc1ccc(N2CCN(C(=O)C(C)C)CC2)cc1OC 41379553 HUOGFHFZCYVZRS-UHFFFAOYSA-N 292.379 2.008 10 10 CECE C[C@@H]1CN[C@](C)(C2CC2)CN1c1ccc2c(c1)OCCO2 86181429 RUTKMVXLOIOKFG-PXAZEXFGSA-N 288.391 2.425 10 10 CECE CC(C)C[S@@](=O)CCC(=O)Nc1ccc(N)cc1 40969722 KADGSNIBWIGDRM-GOSISDBHSA-N 268.382 2.002 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3N)[C@@H](C)C1 225730580 SEKARZHGRHYRKT-PKFCDNJMSA-N 259.353 2.263 10 10 CECE CC[C@@H](N)c1ccc(N(CCO)CC(F)F)cc1 233889096 CSIMPVNOCJGDNP-GFCCVEGCSA-N 258.312 2.160 10 10 CECE CC[C@H](O)[C@H](N)c1cc(Cl)cc(Cl)c1O 95805965 WRGMYHVSOPVPGL-DTWKUNHWSA-N 250.125 2.470 10 10 CECE Cc1cc(N2CC[C@@H](C)[C@H]2CO)ccc1CNC1CC1 299951473 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2.278 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3[C@@H](N)[C@@H]4CCC[C@H]34)ccc21 2355359832 LPBLDQCKBXUIOM-KUHBDSFDSA-N 272.392 2.086 10 10 CECE CC[C@@H](c1cc(Br)ccc1O)N(C)CCN 54416780 ZOZAQRJSRMNZQL-NSHDSACASA-N 287.201 2.496 10 10 CECE CCN1CCc2nc3sc(C(=O)OC)c(N)c3cc2C1 20289961 WMVVCBTYIDSAQY-UHFFFAOYSA-N 291.376 2.043 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C(=O)C1=COCCC1 173193707 MOUHBBUIVWEJRD-UHFFFAOYSA-N 288.347 2.172 10 10 CECE CC(C)(C)OC(=O)[C@H]1C[C@]1(N)c1c(O)cccc1F 1952771960 GJHZIJVNNQKQTE-XLKFXECMSA-N 267.300 2.047 10 10 CECE COc1ccc(CN[C@@H]2C[C@H]3C[C@H](OC)[C@H]3C2)c(O)c1 2357044899 UBZBDZPSMUJLED-LMWOUKEDSA-N 277.364 2.304 10 10 CECE Cc1cc(CNCc2cccc(C)c2O)nc(N(C)C)n1 187976319 PVVWAKZTVVWIQK-UHFFFAOYSA-N 286.379 2.155 10 10 CECE COCCN(Cc1cccc(OC)c1O)C(C)C 211656798 GSKLEIODOGRKKI-UHFFFAOYSA-N 253.342 2.258 10 10 CECE CC[C@H](CO)N(C)c1ccc(CN)cc1Br 379176981 QVAGGSXDNPQHJD-SNVBAGLBSA-N 287.201 2.115 10 10 CECE [N-]=[N+]=NC[C@@H](Nc1cccc(Br)c1)C(N)=O 85621905 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AYGWLSZPRHVLLU-VKHMYHEASA-N 279.061 2.188 10 10 CECE Nc1oncc1-c1ccc(Br)c(O)c1O 258551798 RCJRDMNOYMBCLK-UHFFFAOYSA-N 271.070 2.098 10 10 CECE CN(C)c1ccc(CN2C(=O)C(Cl)=C(Cl)C2=O)cc1 146612159 SPIHYTVTOYRMCH-UHFFFAOYSA-N 299.157 2.311 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)[C@H](C)OC)c1 276138364 NADAONSQBZDQHE-AXFHLTTASA-N 281.352 2.253 10 10 CECE Cc1cc(Cl)cc(CNCCN2CCCOCC2)c1O 289489874 RKZAZSMLGHIDCV-UHFFFAOYSA-N 298.814 2.166 10 10 CECE Cc1cc(C)c([C@@H](C)N[C@@H]2CCC(=O)N(C)C2)c(O)c1 284142252 OUXQRIKYEVZOCE-CHWSQXEVSA-N 276.380 2.280 10 10 CECE CC(=O)C(=O)COC(=O)c1oc2c(C)cccc2c1C 808507864 JISNNZSFRGTIKK-UHFFFAOYSA-N 274.272 2.365 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@]4(C)CCO[C@H]43)ccc21 2163062689 NDIGLTPOHUKDPJ-IXDOHACOSA-N 272.392 2.422 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@]12COC[C@@H]1C2(F)F 2163068351 GZESYLPLEFXXIL-MJBXVCDLSA-N 282.334 2.295 10 10 CECE CCN1CCc2cc([C@H](O)c3cncnc3C)ccc21 2163075248 BCMKSHKPBFNEDD-INIZCTEOSA-N 269.348 2.249 10 10 CECE Nc1cccnc1[C@@H](O)c1ccc(N2CCCC2)cc1 2163113844 PJMLFDMKRGBCGZ-INIZCTEOSA-N 269.348 2.346 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)[C@@H]1CC12CC2 2163141639 WNYVPWMZXLFGGM-NUEKZKHPSA-N 272.392 2.100 10 10 CECE CNCc1ccc(N(C)C2C[C@@H](OC)[C@H](OC)C2)cc1 2166103717 WJSNRFBRHYSBDY-HZPDHXFCSA-N 278.396 2.035 10 10 CECE CCOc1cccc(CN[C@H](CC)[C@H](O)C(F)F)c1O 295114505 VMIRZGOQLDXSBO-MFKMUULPSA-N 289.322 2.285 10 10 CECE C[C@H](N[C@@H]1CCNC[C@H]1C)c1ccc(N(C)C)cc1 817972401 WVJRJMVXTJUGLR-DVOMOZLQSA-N 261.413 2.401 10 10 CECE CCc1nsc(SCC(=O)Nc2ccc(N)cc2)n1 129917941 CJVIJKOHTBSURX-UHFFFAOYSA-N 294.405 2.414 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](O)C[C@@H]1N=[N+]=[N-] 725369921 NVZOTGKZUFFERQ-YIZRAAEISA-N 256.306 2.103 10 10 CECE CNC(=O)[C@H](C)CN(C)c1ccc([C@H](C)N)cc1Cl 723200380 CHRXRYORQGEBRK-ZJUUUORDSA-N 283.803 2.178 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC(NC(C)=O)C2)cc1 723183782 YHJMABAOWOHZCF-LBPRGKRZSA-N 275.396 2.072 10 10 CECE Cc1cc(O)c(CN2CC(CCO)C2)cc1Cl 826112800 DLFAMKYATUUALK-UHFFFAOYSA-N 255.745 2.168 10 10 CECE CC[C@H](N[C@H]1COCC[C@@H]1OC)c1ccccc1O 724874438 VSUWSLYTUGFRPD-YDHLFZDLSA-N 265.353 2.237 10 10 CECE COC(=O)[C@H]1C[C@H](NC/C=C/c2ccc(N(C)C)cc2)C1 827812733 WNCSTBSCBIDXKB-LEOKVQLJSA-N 288.391 2.307 10 10 CECE COCC[C@](C)(O)CNC/C=C/c1ccc(N(C)C)cc1 835040508 QFJJCKOHKOMUMD-RTRPANQVSA-N 292.423 2.143 10 10 CECE Cc1cc(O)c(CN2CCNC(=O)CC2)cc1C(C)C 913090557 OQLGMVQHEKFPFK-UHFFFAOYSA-N 276.380 2.146 10 10 CECE C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(=O)O 843040102 FXFSJWIZINEBBU-DGCLKSJQSA-N 294.370 2.434 10 10 CECE CCc1cccc(CN[C@H](CC)[C@@H](O)C(F)F)c1O 848916710 WZPWTFZLKMPMFP-DGCLKSJQSA-N 273.323 2.449 10 10 CECE CO[C@]1(CO)CCCN(Cc2ccc(N(C)C)c(C)c2)C1 852408504 BJNNDRYUKXMFMY-QGZVFWFLSA-N 292.423 2.034 10 10 CECE Cc1ccncc1CCNC(=O)NCCc1ccc(N)cc1 851662825 LERUNOFPGRUQQM-UHFFFAOYSA-N 298.390 2.057 10 10 CECE COCCN(CCF)Cc1cc2c(cc1O)CCC2 853548610 IOSWVLQDCFOWIB-UHFFFAOYSA-N 267.344 2.299 10 10 CECE COC[C@H](C)OC(=O)CSCc1ccc(N)cc1 58238257 KARUCQXHGHMHBU-JTQLQIEISA-N 269.366 2.080 10 10 CECE COc1ccc(N2CC[C@H](NC3CC3)C2)cc1F 71199050 HWBSQJZOIWHPAU-NSHDSACASA-N 250.317 2.165 10 10 CECE O=C(OCCOc1ccc(F)cc1)c1cccc(O)c1O 776281571 HQJPQMPKAXVWBC-UHFFFAOYSA-N 292.262 2.473 10 10 CECE C[C@@H]1C[C@@]2(CC[C@@H](CNCc3ccccc3O)O2)CO1 886334686 ZZBJTLSHZZXHLI-INWMFGNUSA-N 277.364 2.208 10 10 CECE CCOc1cc(N2CCCCC2)ccc1[C@H](N)CO 72199380 RIBLXHOZXZXQLZ-CQSZACIVSA-N 264.369 2.068 10 10 CECE COc1ccc2c(c1)NC1(CCNCC1)CN2C(C)C 76934485 ULHOZQRZLCRXDQ-UHFFFAOYSA-N 275.396 2.458 10 10 CECE CC(=O)C(=O)COC(=O)c1cscc1C(F)F 885600543 ZLWCTLFGOPMBSF-UHFFFAOYSA-N 262.233 2.001 10 10 CECE CC1CC(CN(C)c2ccc3c(c2)NC(=O)[C@H]3N)C1 700877951 CQSSRFYKSARVAV-FDZGAKKTSA-N 259.353 2.121 10 10 CECE CC(C)(NC(=O)c1cccc(O)c1O)C1CCOCC1 787812731 QVBRKLZWEVFHSJ-UHFFFAOYSA-N 279.336 2.033 10 10 CECE CC1(C)C[C@@H]1c1nnc([C@H](N)c2ccc(O)c(O)c2)o1 83543882 LEUPBTFNVNLTHA-LDYMZIIASA-N 275.308 2.042 10 10 CECE Cc1cncc(/C=C/C(=O)N2C[C@H](C)Cn3nccc32)c1 893889817 FDIFYJJNXQMZAI-OOPCZODUSA-N 282.347 2.283 10 10 CECE CO[C@@H]1CCC[C@H]1NC(=O)NCc1cccc(Cl)c1O 895188499 OOEWGXGRAFCQIK-VXGBXAGGSA-N 298.770 2.412 10 10 CECE C[C@H]1CN(Cc2ccc(F)c(F)c2O)CCCO1 703592379 IDJVZYLKMLCJGU-VIFPVBQESA-N 257.280 2.281 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H]2CNC[C@]2(C)C1 703547960 NAAMZLSQNJTEIY-UEKVPHQBSA-N 264.344 2.134 10 10 CECE COCC1(CNCc2cc(C)cc(OC)c2O)CC1 895185574 AHKBCOGLWQRPBK-UHFFFAOYSA-N 265.353 2.225 10 10 CECE COc1cccc(CN[C@@H](C)c2csnn2)c1O 398410504 LLWBWNYIYBSFRY-QMMMGPOBSA-N 265.338 2.103 10 10 CECE OCc1ccc(N2CC[C@@H]3COC[C@H]3C2)c(Cl)c1 702081604 LYEUKOPUCXKJMK-VXGBXAGGSA-N 267.756 2.305 10 10 CECE C[C@@H]1CCCC[C@@H]1N(CC(N)=O)Cc1ccc(N)cc1 704852323 VNDXKRNDOHHGBY-DOMZBBRYSA-N 275.396 2.135 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)c(F)c1 718155322 NFAKEKDCWXTADH-LFIDFRPQSA-N 276.355 2.459 10 10 CECE Cc1cc(N2[C@H]3CC[C@H]2[C@@H](C)[C@H](O)C3)ccc1CN 686176952 GSXPUBIIHYVDFX-IPOQPSJVSA-N 260.381 2.192 10 10 CECE Nc1ccc(OCCC(=O)O[C@H]2CCCCO2)cc1 686652005 OBHZREKMOFIBIQ-AWEZNQCLSA-N 265.309 2.108 10 10 CECE COc1ccc(O)c(CN2CCC[C@@](C)(C(=O)O)C2)c1 86783693 ONEMLAAUWQIJLL-OAHLLOKOSA-N 279.336 2.088 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCc2ccccc21 90257342 UNQRFVJPTPTBEC-AWEZNQCLSA-N 274.324 2.291 10 10 CECE CCNCc1cc(F)c(N2C[C@@H]3CC[C@H](C2)O3)c(F)c1 90906726 HIGSXDGOMMLGKW-TXEJJXNPSA-N 282.334 2.442 10 10 CECE C[C@@H]1CN(C(=O)CCOc2ccc(N)cc2)C[C@H]1C 92081545 NCSXNGZAYKVZHM-VXGBXAGGSA-N 262.353 2.152 10 10 CECE Cc1ccc(O)c(CNC(=O)Cn2ncc3ccccc32)c1 1301046587 GBWQMXSXTHVURG-UHFFFAOYSA-N 295.342 2.367 10 10 CECE Nc1ccc(OCCOCCOC(F)(F)F)cc1 2253927489 DCOILKXVCAMIJQ-UHFFFAOYSA-N 265.231 2.201 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)CCOCC(F)(F)F)CC1 2117724086 IEKAFBDLBMJBNI-UHFFFAOYSA-N 280.250 2.162 10 10 CECE Cc1ocnc1CCN[C@H](C)c1cc(O)ccc1O 2128994584 CKFWGADRMMLRSI-SECBINFHSA-N 262.309 2.288 10 10 CECE CCNC(=O)C(C)(C)NCc1ccc(Cl)cc1O 1659966467 XSRROVPRAULFHS-UHFFFAOYSA-N 270.760 2.050 10 10 CECE CC1(C)[C@@H](O)CCN1c1ccc2c(c1)CCC[C@@H]2O 2128273747 XOPFWFZQZXWFIS-GJZGRUSLSA-N 261.365 2.406 10 10 CECE CC[C@]1(O)CCCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128322042 LYWKHZMSMOWRIQ-HOTGVXAUSA-N 261.365 2.408 10 10 CECE CCC[C@@]1(O)CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128329383 URMOVKMRVFOERO-JKSUJKDBSA-N 260.381 2.374 10 10 CECE CCN(CCCN(C)C)c1ccc2c(c1)CC[C@H]2O 2128317602 FURQWGHOAPFZCW-MRXNPFEDSA-N 262.397 2.444 10 10 CECE C[C@@H](O)[C@H]1CCCCN1c1ccc2c(c1)CC[C@H]2O 2128322182 PPTFZSQUGTYULW-HFBAOOFYSA-N 261.365 2.406 10 10 CECE C[C@H](O)c1ccc(N2CC3(CC(CO)C3)C2)c(F)c1 2129961554 IIXMCMQIAJUMKC-JTQLQIEISA-N 265.328 2.088 10 10 CECE CCN1[C@@H](C)CN(Cc2cccc(F)c2O)C[C@H]1C 2130387873 ULNUWWQYVZCAHM-TXEJJXNPSA-N 266.360 2.446 10 10 CECE Oc1c(F)cccc1CN[C@@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12 2132229950 BCRRKTHHJADWIJ-BTXBGFNFSA-N 263.312 2.187 10 10 CECE CO[C@H]1C[C@H](CF)N(c2ccc3c(c2)CC[C@H]3O)C1 2133710434 TVSPVEMEWMHSNB-VNHYZAJKSA-N 265.328 2.229 10 10 CECE COC[C@H]1C[C@@H]1CN(C)Cc1ccc(N(C)C)cc1 2133558134 YCLVDTWJXMMUOB-HUUCEWRRSA-N 262.397 2.467 10 10 CECE C[C@H]1C[C@@H](N(C)c2ccc(CO)cc2[N+](=O)[O-])CS1 2132953496 PRDDCUPMZCMAOW-GXSJLCMTSA-N 282.365 2.417 10 10 CECE CC[C@H](C)CC[C@@H](O)CC(=O)NCc1cccc(O)c1O 1348048836 XLPYYQPYLMCIPS-WCQYABFASA-N 295.379 2.291 10 10 CECE CO[C@@H]1C[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C12CCC2 2133839433 BRFBIQGLVCHXDH-OUAUKWLOSA-N 264.329 2.103 10 10 CECE CN1CC[C@H](CN(C)c2ccc(C=CC(=O)O)cc2)C1 1911938735 DVRAIOFOYFZFIH-AWEZNQCLSA-N 274.364 2.172 10 10 CECE CCN(CC(=O)NC)c1ccc(C=CC(=O)O)c(Cl)c1 1912033958 MSSWFFPSOIYDGU-UHFFFAOYSA-N 296.754 2.010 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2ccc(Br)nc2)C1 1912153364 BIAXFBWISLFZNK-MRVPVSSYSA-N 296.128 2.369 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)COc2cccc(F)c2)C1 1912164308 VPLXERXKDNPURC-SNVBAGLBSA-N 264.260 2.116 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)COC2CCC2)C1 1912173588 OFFDETOVEYXMLU-LLVKDONJSA-N 266.345 2.495 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCCCC1(F)F 1912196046 JCXPPBFJLIMEOE-SECBINFHSA-N 262.260 2.309 10 10 CECE CC[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1912169008 YLYGSFBZTFMAFU-SRVKXCTJSA-N 266.345 2.350 10 10 CECE COC1(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)CCCC1 1912203002 NXRQBBCNYMFFPN-SNVBAGLBSA-N 252.318 2.104 10 10 CECE CCOC(=O)C1(NCCCN=[N+]=[N-])CC(CCOC)C1 1912209757 CALFRZAEABNAGJ-UHFFFAOYSA-N 284.360 2.025 10 10 CECE CC1(OCC(=O)N2CC(N=[N+]=[N-])C2)CCCCC1 1912200620 JRVXHVJTQSKGLY-UHFFFAOYSA-N 252.318 2.247 10 10 CECE CCC=C1CCN(c2ccc3c(c2)NC(=O)[C@@H]3NC)C1 1915337698 ABJHSJYVIDYLGM-OAHLLOKOSA-N 271.364 2.446 10 10 CECE CC[C@@H](C)N(CC)C[C@@H](O)COc1ccc(N)cc1 222073763 GKZPNCXZGFBYAL-TZMCWYRMSA-N 266.385 2.129 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NC[C@@H]2CCCCO2)cc1 1442658459 MZTVHPHYTYNWCE-LBPRGKRZSA-N 290.323 2.148 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](C)S[C@H](C)C3)ccc21 226670926 BWRGLOULUKGJEM-RBZYPMLTSA-N 291.420 2.229 10 10 CECE O=C(NCc1c(O)cccc1F)c1cc2cccn2cn1 1456026502 ANYUHWYUMWXYPZ-UHFFFAOYSA-N 285.278 2.109 10 10 CECE 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CCN(CC)c1ccc([C@@H]2NN=C3CCNC[C@@H]32)cc1 169971603 YHKMTIXLBIJSLH-HOCLYGCPSA-N 272.396 2.143 10 10 CECE Nc1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1 158131006 YFSQDHHUROPSQO-UHFFFAOYSA-N 290.363 2.105 10 10 CECE OCc1ccc(N2CC3(CSC3)C2)c(Cl)c1 1937078381 DIBZZZOSMMQJAB-UHFFFAOYSA-N 255.770 2.386 10 10 CECE CN(C)c1ccc(Cn2nccc2NC(=O)C2CC2)cc1 154171166 NGLRCRITNTWUBY-UHFFFAOYSA-N 284.363 2.346 10 10 CECE CNCC(C)(C)N(C)c1c(C)cc(OC)cc1OC 258897196 RNCGTBPJNVPSLK-UHFFFAOYSA-N 266.385 2.446 10 10 CECE CC[C@H](CO)CN(C)c1ccc2c(c1)CCC(=O)N2 258883060 CHWBWAFBWAVWLJ-NSHDSACASA-N 262.353 2.026 10 10 CECE CCCN1C(=O)Cc2cc(N(CC)CCC(=O)O)ccc21 259469390 NOQMMGKUOGIFLT-UHFFFAOYSA-N 290.363 2.287 10 10 CECE CC[C@H]1CN(C)CCCN1c1ccc(CNC)cc1F 234149863 YKRRLDKDLUCZHJ-AWEZNQCLSA-N 279.403 2.466 10 10 CECE C[C@@H]1CN(Cc2ccc(Cl)cc2O)CC[C@H]1N 1942498087 UIZNNNXYAVCJON-BXKDBHETSA-N 254.761 2.215 10 10 CECE C[C@@H]1SCCC[C@@]1(O)[C@@H](N)c1ccccc1O 1943692040 WJEXVAYIEVNTEQ-XDTLVQLUSA-N 253.367 2.039 10 10 CECE 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C[C@H](O)c1ccc(N(C)C[C@@H]2[C@@H]3CCCO[C@@H]32)cc1O 2176432579 RRXGZDBKMCKOOV-BWPSIRRCSA-N 277.364 2.307 10 10 CECE CCOc1ccc(N2CCC(F)(CN)CC2)cc1 1145180203 SGGMOZXRPNVWNS-UHFFFAOYSA-N 252.333 2.353 10 10 CECE Cc1cc(CO)ccc1N(C)[C@H]1C2CCN(CC2)[C@H]1C 2192784336 INVJTURALJERKG-SUMWQHHRSA-N 274.408 2.406 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](c3nncs3)C2)cc1O 2196551924 PEMDPTJKXXYJKX-UWVGGRQHSA-N 291.376 2.291 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3CNCC34CCC4)ccc21 2196678207 IDKRSYBSCBZFKN-GOEBONIOSA-N 271.408 2.068 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCC(=O)N(C)C)c(F)c1 2188487138 RVGRGSJCCRICFG-NSHDSACASA-N 281.375 2.021 10 10 CECE CCc1cc(N2CCNCC2)ccc1O[C@@H](C)COC 2197493912 JHERHQCAXUGWDI-ZDUSSCGKSA-N 278.396 2.072 10 10 CECE Cc1cc(N(C)[C@@H]2CO[C@H]3C[C@@H]2C3)ccc1C[C@@H](C)N 2183095576 CICWVIPRDGTJSM-QIJZBDPFSA-N 274.408 2.498 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCNC[C@@H]1CC(F)F 2183408977 USXASZBZXUOTJC-UWVGGRQHSA-N 286.322 2.088 10 10 CECE COc1cccc(O)c1CNC[C@@H]1C[C@@]12CCCOC2 2198115299 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CCN1CCc2cc([C@H](O)C34CCN(CC3)C4)ccc21 2198764913 FSXRWHUXLPPUAN-INIZCTEOSA-N 272.392 2.198 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@@H](CCO)C(F)F)cc1 2058237924 VEKSGAGCBLQXNR-SKDRFNHKSA-N 259.296 2.192 10 10 CECE COc1ccc(N(CCO)C(C)(C)C)cc1OC 2219645909 UZKBBXBXNNQSTG-UHFFFAOYSA-N 253.342 2.301 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@H]1CC[C@H]1C1CC1 2191825050 GSIWKGNUEKGPQE-STQMWFEESA-N 275.348 2.401 10 10 CECE C[C@@H](N)c1ccc(N2CCC=C[C@H]2CO)cc1Cl 2061978867 XLSYYZTYZJERII-PWSUYJOCSA-N 266.772 2.487 10 10 CECE N=S1(=O)CC2(CN(c3ccc4c(c3)CCC4)C2)C1 2062661605 SSKGOLUWKWJZIH-UHFFFAOYSA-N 262.378 2.042 10 10 CECE Oc1ccccc1CNCC(F)(F)[C@@H]1CCOC1 2065510995 QUMOVRWFRALNIG-LLVKDONJSA-N 257.280 2.154 10 10 CECE CCOCc1nnc(CN(C)CCCN=[N+]=[N-])s1 2067281052 PQGIFHBRDTUTGA-UHFFFAOYSA-N 270.362 2.207 10 10 CECE CCCN1C[C@@H]2C[C@H]1CN2Cc1cccc(OC)c1O 2187558143 WAMOBBFBNBRZRB-KBPBESRZSA-N 276.380 2.069 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@H]2CN3C)cc1C 2187595646 UBZUYFYGTWJALC-IRXDYDNUSA-N 273.424 2.387 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CC[C@@H]1C1CC1 2071806984 XLJYAORJZMGENG-ZYHUDNBSSA-N 252.318 2.008 10 10 CECE C[C@H](c1ccccc1O)N(C)c1nc(=N)[nH]c(Cl)c1N 2192570844 WMZFIQBLQCGLIE-SSDOTTSWSA-N 293.758 2.028 10 10 CECE CN(CCCN)c1ccc(OCC(F)(F)F)cc1 2073886012 NHQSFGGBJIDXLO-UHFFFAOYSA-N 262.275 2.413 10 10 CECE CC1(C)C[C@](C)(C(=O)O)CN1Cc1ccc(O)cc1O 2199614406 ZCQJPQKQGHGXHN-HNNXBMFYSA-N 279.336 2.173 10 10 CECE C[C@@H](N[C@H]1C[C@H](CCO)C1)c1cc(F)ccc1O 2078436823 CFJQIQFPLPXIFC-CKYFFXLPSA-N 253.317 2.343 10 10 CECE CC(C)NCc1ccc(N2C[C@H](CO)C[C@@H]2C)cc1 2100305157 LMVPMBGDZJAXDK-DZGCQCFKSA-N 262.397 2.392 10 10 CECE CC[C@@H]1CC[C@@H](CNCc2ccc(O)cc2O)O1 2081664239 VLHAAZZXUVQONC-OLZOCXBDSA-N 251.326 2.145 10 10 CECE C[C@@]1(O)CCC[C@H](NCc2cc(F)cc(F)c2O)C1 2102076041 YHZYCDOOTSGPSW-SMDDNHRTSA-N 271.307 2.454 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@]23CC[S@](=O)C3)cc1 2102246929 PBLIFQGALMPTRZ-YFROIQMUSA-N 278.421 2.198 10 10 CECE CC(=O)c1ccc(O)c(CN2CC(OC(C)C)C2)c1 2102488660 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CN1CCc2cc([C@H](NN)[C@@]3(C)CC3(F)F)ccc21 2106862335 SWZILDQCHBGVAB-QWHCGFSZSA-N 267.323 2.229 10 10 CECE C[C@@H]1NCC[C@@H]1[C@@H](O)c1ccc2c(c1)CCCN2C 2106832410 ZXNDMDWEJXRYEH-PJODQICGSA-N 260.381 2.100 10 10 CECE CN(C)c1ccc([C@H](N)[C@]2(O)CC[C@H]3CC[C@H]32)cc1 2106856926 GCIBXUPCAWYCNI-FWYOQMDTSA-N 260.381 2.304 10 10 CECE CN1CCCc2cc([C@@]3(O)CCC[C@H](N)C3)ccc21 2106830645 IMMCABYLNXFOJB-GOEBONIOSA-N 260.381 2.158 10 10 CECE C[C@@](O)(c1ccc(N2CCCC2)cc1)[C@@H]1CCCN1 2106824824 CUZNJZTVHAJCOI-JKSUJKDBSA-N 260.381 2.246 10 10 CECE C[C@@H]1OC[C@](O)(c2ccc3c(c2)CCCN3C)[C@H]1C 2106827096 ZQFJHUAGEHKGCN-MQIPJXDCSA-N 261.365 2.311 10 10 CECE C[C@@H]1OCCO[C@H]1CN(C)c1ccc(CN)c(Cl)c1 2087376029 YMCMZOYWTPZWRX-HZMBPMFUSA-N 284.787 2.039 10 10 CECE Cc1nonc1CN(c1ccc(CN)cc1)C1CC1 2087494048 ZJAWQYNDZGHXIT-UHFFFAOYSA-N 258.325 2.006 10 10 CECE c1cc(N2CCNCC2)ccc1OC1C[C@@H]2C[C@H]2C1 2107709285 SWNSYDDBOFVOQE-STQMWFEESA-N 258.365 2.274 10 10 CECE C[C@@H](N[C@H]1CCCN(C)CC1)c1c(O)cccc1O 2088294262 KSHFYLCCOHADTJ-NEPJUHHUSA-N 264.369 2.233 10 10 CECE CN[C@@H](c1ccccc1O)[C@H]1CCn2nccc2C1 2108981597 GGWSYHHTLWROJB-XHDPSFHLSA-N 257.337 2.112 10 10 CECE COCC[C@H](COC)N(C)c1ccc(CO)cc1Cl 2109710386 ZCFJOVBAFWUNJP-GFCCVEGCSA-N 287.787 2.320 10 10 CECE CNCc1ccc(N(C)Cc2cnn(C)c2Cl)cc1 2109847951 CVBIVLXFRJTQOQ-UHFFFAOYSA-N 278.787 2.429 10 10 CECE CCN[C@H](c1ccccc1O)[C@H]1CCCCS1(=O)=O 2090040349 ORFMCSDRUNBOGO-ZIAGYGMSSA-N 283.393 2.010 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@@]3(CO)C2)cc1Cl 2090113327 GSKOGKNJTXPWJG-WFASDCNBSA-N 280.799 2.268 10 10 CECE CCCNCc1ccc(N(CCO)[C@H]2C[C@H]2C)cc1 2110794298 KAHQHGNSZACLHF-CJNGLKHVSA-N 262.397 2.393 10 10 CECE CN[C@@H](c1ccccc1O)[C@@](C)(O)c1nc(C)cs1 2091865657 AQCZAQLKLFTALW-GXTWGEPZSA-N 278.377 2.325 10 10 CECE CN1CCCN(Cc2cc(F)cc(F)c2O)CCC1 2096281845 IWNFNJRGKJQVQQ-UHFFFAOYSA-N 270.323 2.198 10 10 CECE Cc1cc(N2CC[C@@H]([C@@H]3CCCO3)C2)ccc1CO 2096732690 OADGNCGYLFCUAH-CJNGLKHVSA-N 261.365 2.493 10 10 CECE CN1[C@H]2CC[C@H](NCc3ccc(N)cc3)C[C@H]1CC2 2097922833 HMNZSXHTYLFXEF-HRCADAONSA-N 259.397 2.374 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](O)CC2(C)C)cc1O 2098603611 VOZXNKRIRBQJLT-JQWIXIFHSA-N 264.369 2.022 10 10 CECE Cc1csc(=O)n1CCN1CCC[C@H](N=[N+]=[N-])CC1 2099334122 UEVZYUCEGOSOEF-NSHDSACASA-N 281.385 2.383 10 10 CECE CCCN(C[C@H](O)COC(C)C)c1ccc(N)cc1 2099502615 NVQTVJHLTQTGFO-HNNXBMFYSA-N 266.385 2.271 10 10 CECE Cc1nccn1C[C@H](C)CN1CC[C@H](CN=[N+]=[N-])C1 2113338887 ACROZRMHGIUWIR-DGCLKSJQSA-N 262.361 2.460 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1 2113392911 ZUADCBBABUADHX-MFKMUULPSA-N 264.304 2.491 10 10 CECE CCN(CCOc1ccc(N)cc1)C[C@H]1CCOC1 2113611387 ZLGJYSKKZVGZOH-CYBMUJFWSA-N 264.369 2.006 10 10 CECE C[C@H](N)c1ccc(N(C)CCCn2ccnc2)cc1 2113770811 YKLBIMSFIHYHMW-ZDUSSCGKSA-N 258.369 2.429 10 10 CECE CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@H]1N(C)C 2114070345 PVCGBURIHTYURM-UKRRQHHQSA-N 262.397 2.473 10 10 CECE CCCNCc1ccc(N2CC[C@H]3C[C@@]3(O)C2)cc1 2114562373 YSEHNTDPCYVZTL-GOEBONIOSA-N 260.381 2.147 10 10 CECE Cc1cc(N2CC[C@H]3CN(C)CC[C@@H]32)ccc1CO 2114505755 XJCMUXOZOHOHKV-BBRMVZONSA-N 260.381 2.018 10 10 CECE COc1ccc(N2CCC[C@]3(CCOC3)C2)c(N)c1 2114700869 RGACPZDIRQZXLY-HNNXBMFYSA-N 262.353 2.284 10 10 CECE Cc1c(CN2CC=C[C@H]2C(=O)O)n(C)c2ccccc12 2201088868 XDEDNKCIVLIWOS-AWEZNQCLSA-N 270.332 2.312 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])[C@]1(C)CC1(F)F 2116115445 ISDAEXQEIDNOJS-UWVGGRQHSA-N 276.287 2.253 10 10 CECE C[C@@H]1OCC[C@H]1CN(C)CCOc1ccc(N)cc1 2121142442 LWXJZAUOTQCSIK-STQMWFEESA-N 264.369 2.004 10 10 CECE COc1cc(N(C)C2CC(O)C2)ccc1CNC(C)C 2204541191 JDRKUYZZVIHQHN-UHFFFAOYSA-N 278.396 2.153 10 10 CECE CCCNCc1ccc(N(CCO)C2CC2)cc1OC 2204549845 KSXDQEBSQTUGSR-UHFFFAOYSA-N 278.396 2.156 10 10 CECE CCC[C@@H]1CN(c2ccc3c(c2)CC[C@H]3N)C[C@H]1CO 2205802853 YFMFCWYHNYKUFS-JKIFEVAISA-N 274.408 2.477 10 10 CECE COc1ccc(N2CC=C[C@@]2(C)CO)cc1Cl 2215673415 XAWVPYDQSQXDBK-ZDUSSCGKSA-N 253.729 2.476 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@H]1OC[C@H]2CCC[C@@H]21 2218099918 LYGFAUAIOSKQMQ-OUAUKWLOSA-N 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2.039 10 10 CECE C[C@@H](NCc1ccc(F)c(F)c1O)c1ccn(C)n1 877585645 LASIENJIPCWFLP-MRVPVSSYSA-N 267.279 2.255 10 10 CECE CN(C)c1ccc(CN[C@@H]2[C@H]3CCN[C@H]3C2(C)C)cc1 1875706297 YOADMGANZXHWPV-ARFHVFGLSA-N 273.424 2.229 10 10 CECE NCC12CC(CN1Cc1ccc(Br)cc1O)C2 1946761326 BEDNEDPGHFORKG-UHFFFAOYSA-N 297.196 2.078 10 10 CECE COC(=O)C1(C)CC(N[C@@H](C)c2ccccc2O)C1 1877579185 USIGQFMEQAZBFL-NLTNOIMHSA-N 263.337 2.385 10 10 CECE Cc1cc(O)nc(N[C@H](C)c2cc(O)ccc2O)n1 1877936892 ODMPJGZGLZZODE-MRVPVSSYSA-N 261.281 2.075 10 10 CECE CC(C)C1(O)CN(c2c(F)cc([C@@H](C)O)cc2F)C1 1880483055 UWGXVSBSSJCDQI-SECBINFHSA-N 271.307 2.225 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H](CO)C[C@@H]2C)c(F)c1 1880922941 CECISWKZMLMEGZ-GUBZILKMSA-N 270.323 2.192 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCC[C@@H]2[C@@H](C)O)c(F)c1 1880927669 LNEAVQRXIZIXSY-JRKPZEMJSA-N 270.323 2.334 10 10 CECE C[C@H](N)c1cc(F)c(N2CCN(C)[C@H](C)C2)c(F)c1 1880927499 MNHNRLBMNUOYNG-ZJUUUORDSA-N 269.339 2.125 10 10 CECE CCC[C@H](C(=O)O)N(C)Cc1cc(F)ccc1O 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10 10 CECE CS[C@H]1COC[C@@H]1NCc1ccc(Cl)cc1O 2026371387 MPRWXCMVTYHZOU-JQWIXIFHSA-N 273.785 2.266 10 10 CECE Nc1ccc(CCC(=O)OCc2cscn2)cc1 2026926551 QWJAMKZDTCAAEV-UHFFFAOYSA-N 262.334 2.401 10 10 CECE Oc1cccc(Cl)c1CN1CCC[C@H]2NCC[C@@H]21 2027168924 WLSLEGHYCRAXQB-OLZOCXBDSA-N 266.772 2.372 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](O)C[C@H](C)C2)c(F)c1 2159545190 BWILAFPPPPHGEM-CMPLNLGQSA-N 284.350 2.281 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@]2(C)C[C@H]1CO2 2028069567 NVEMEEBQLRWJMZ-NURSFMCSSA-N 251.301 2.456 10 10 CECE C[C@]1(CNCc2cccc(O)c2O)CCCCO1 2028306264 KXIJWTZKUSVYQW-CQSZACIVSA-N 251.326 2.147 10 10 CECE C[C@H](NCCc1ccon1)c1cc(F)ccc1O 2029989015 HLSKIDATBSSXLY-VIFPVBQESA-N 250.273 2.413 10 10 CECE CCC[C@]1(O)CCN(c2ccc(CO)cc2F)C1 2033344938 WEZWEYUATOHNMO-AWEZNQCLSA-N 253.317 2.059 10 10 CECE C[C@H](N)c1ccc(N2CCN(CC(F)(F)F)CC2)cc1 61941569 AEXZKZRAHJFLNP-NSHDSACASA-N 287.329 2.391 10 10 CECE CCN([C@H](C)CN(C)C)[C@H](C)c1c(O)cccc1O 300438934 CQQVYGIBMSYDNM-VXGBXAGGSA-N 266.385 2.431 10 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2161052911 ROCZUWKUGLOQBF-GHMZBOCLSA-N 298.412 2.351 10 10 CECE CCN(c1ccc([C@@H](C)NC)c(Cl)c1)[C@@H]1CCNC1=O 2171241949 AGJIAVSSLGFJEY-QMTHXVAHSA-N 295.814 2.335 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@H]1CCOC(C)(C)C1 2161556462 XCURNQHNVPGQRX-GLQYFDAESA-N 279.380 2.219 10 10 CECE Oc1ccc(Cl)cc1CNCc1cccn2cnnc12 2177073667 HWNXRSUXJVDDLP-UHFFFAOYSA-N 288.738 2.378 10 10 CECE CCN(C)[C@H]1CCCN(c2ccc([C@@H](C)O)c(O)c2)C1 2171335666 IEAOOBXNSPTGBM-OCCSQVGLSA-N 278.396 2.366 10 10 CECE COc1ccc(O)c(CNC[C@]2(O)CCC[C@H](C)C2)c1 87048671 DVIORYLINHIDBK-LRDDRELGSA-N 279.380 2.432 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H]2CC[C@H]1[C@H](N)C2 700888453 ZDBIMFUDBXPHDZ-QOBDMFJFSA-N 264.344 2.404 10 10 CECE O=C1Nc2cc(N3CCC[C@@H](CCF)C3)ccc2[C@H]1O 701924307 MHZFTCLLCFMKMY-IINYFYTJSA-N 278.327 2.248 10 10 CECE COCC(COC)N(C)[C@H](C)c1ccc(OC)cc1O 702061264 ZEENIZUGPIMQEB-LLVKDONJSA-N 283.368 2.055 10 10 CECE CO[C@H]1CCN(C(=O)c2ccc(O)c(O)c2)C(C)(C)C1 2171949564 XFRAFMJSNJEZAO-NSHDSACASA-N 279.336 2.127 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@H]1COC[C@H]1C 705139137 HKVKXAGMBADECF-DOMZBBRYSA-N 276.380 2.290 10 10 CECE C[C@H]1CCCN(CCCc2ccc(N)cc2)[C@@H]1C(=O)O 2179664297 PJVLCESZIPNPRS-WFASDCNBSA-N 276.380 2.387 10 10 CECE CCNCc1ccc(N2CC(n3cccn3)C2)c(C)c1 707670625 VMCMHJMGPYZQOV-UHFFFAOYSA-N 270.380 2.362 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC34CCCC4)ccc21 707675913 JBCJCERVKFZFJV-CYBMUJFWSA-N 257.337 2.161 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1Cl 709849026 JGELKTVWEKVRMJ-HONMWMINSA-N 280.799 2.409 10 10 CECE CNCc1ccc(OC)c(CO[C@H]2COC(C)(C)C2)c1 2172341622 RXHXSVXMMMXQJJ-CQSZACIVSA-N 279.380 2.499 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2CN(C)C3)cc1C 687245415 XYGYGRGIVKSNEC-IRXDYDNUSA-N 273.424 2.387 10 10 CECE CO[C@@H]1CC[C@@H](C)N(c2c(F)cc(CN)cc2F)C1 687205451 PBPDWUMFEADJNF-MWLCHTKSSA-N 270.323 2.427 10 10 CECE CCN1CCc2cc([C@H](O)c3nccnc3C)ccc21 2163074472 SLCXOTJYJZQMLG-INIZCTEOSA-N 269.348 2.249 10 10 CECE C[C@@H]1CCN(CCC(=O)Nc2ccc(N)cc2)CCS1 379505574 ISSRSHVOUWROCY-GFCCVEGCSA-N 293.436 2.425 10 10 CECE CCOC[C@H](O)CN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 381866484 UZRVPLFNQKPFJZ-YNEHKIRRSA-N 279.380 2.236 10 10 CECE Cc1cc(NS(=O)(=O)CC(F)(F)F)ccc1O 695093437 NWXKYMOPQUKXAI-UHFFFAOYSA-N 269.244 2.005 10 10 CECE CCNCc1ccc(N2CCC[C@@H](O)[C@@H]2C)c(F)c1 384897142 VNZYESSXVZMFNK-XHDPSFHLSA-N 266.360 2.285 10 10 CECE COCOCCCNCc1ccc(OC)c(C)c1 717641185 VVCPXQOXNMONTN-UHFFFAOYSA-N 253.342 2.104 10 10 CECE COc1ccc(N(C)[C@H](CN)[C@@H](OC)C(C)C)cc1 386147671 RNFALRANQOKLIV-CABCVRRESA-N 266.385 2.130 10 10 CECE CCN1CC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1 389189385 UJPSZRUAMBTOCP-DZGCQCFKSA-N 261.413 2.497 10 10 CECE CCC[C@@H](CNC(=O)CCc1ccc(N)cc1)OC 393502307 ZDXSOWAJCCOSAC-AWEZNQCLSA-N 264.369 2.133 10 10 CECE C[C@H](NCCCOC(F)F)c1ccc(O)cc1O 398144611 WZWDAVOQUYBCDL-QMMMGPOBSA-N 261.268 2.378 10 10 CECE CN(CCCCCC(=O)O)Cc1ccccc1O 737990107 QKHUTPVTLMUSSQ-UHFFFAOYSA-N 251.326 2.469 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1ncoc1C(F)F 2167836651 JDTUKNCKGCXRNT-GXSJLCMTSA-N 284.262 2.312 10 10 CECE CNCc1cn(-c2ccc(O)c(O)c2)nc1C1CCC1 2069766024 PJQYBAKMISHSIY-UHFFFAOYSA-N 273.336 2.270 10 10 CECE CN1CCCc2cc([C@H](O)[C@H]3[C@H]4C[C@H](N)C[C@H]43)ccc21 2169195105 QGYYHQKJZKPBLP-QZLJAVCYSA-N 272.392 2.086 10 10 CECE COc1ccc(O)c([C@H](C)NC2CN(C3CCC3)C2)c1 2169253965 GQLOQEXDWUUWOV-NSHDSACASA-N 276.380 2.288 10 10 CECE CCOc1cccc(CN[C@H](CO)CC(C)(F)F)c1O 2169536237 UHTOYJIOCYDVQR-NSHDSACASA-N 289.322 2.287 10 10 CECE CCNC(=O)[C@H]1CCCN1c1ccc([C@H](O)CC)cc1 2169608921 KUXFQODVJURNTF-HUUCEWRRSA-N 276.380 2.235 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@H]1[C@@H]2CCO[C@@H]21 2176428827 KZACXAYDCQJDOI-LLLHUVSDSA-N 272.392 2.364 10 10 CECE COCCN(c1ccc([C@H](C)O)c(O)c1)[C@H]1CCSC1 2170157667 SYIOGUHKWVHPRJ-AAEUAGOBSA-N 297.420 2.404 10 10 CECE CC(C)[C@H]1CN(C)CCN1c1ccc([C@@H](C)O)c(O)c1 2170570681 LHLLMYPOQXHQIG-IUODEOHRSA-N 278.396 2.222 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCS[C@H]4CCC[C@@H]43)ccc21 2170530381 UECJKCLJCWGWDJ-IHRRRGAJSA-N 289.404 2.113 10 10 CECE Cc1cccc(O)c1CN(C)C[C@H]1COC(C)(C)CO1 2176705350 JXDHWNWNJZQTQT-ZDUSSCGKSA-N 279.380 2.326 10 10 CECE Oc1cccc(F)c1CN1CC[C@@]2(CCCO2)C1 1137832699 DSDPTQXYXJOCKC-AWEZNQCLSA-N 251.301 2.286 10 10 CECE C[C@@H]1CC(C)(C)CN1C[C@H](O)COc1ccc(N)cc1 2170900914 SUIDQIGIENLNBI-OCCSQVGLSA-N 278.396 2.129 10 10 CECE C[C@@H]1C[C@H]2CN(c3cc(Cl)c(CN)cc3F)CCN2C1 2181271247 DQAFILIXHURERE-PWSUYJOCSA-N 297.805 2.468 10 10 CECE CN(c1ccc(CO)c([N+](=O)[O-])c1)[C@@H]1[C@H]2C[C@@H]2[C@H]2C[C@H]21 2188575775 JRBZOLSCCXMMGF-NTASLKFISA-N 274.320 2.178 10 10 CECE CN[C@@H](C)c1ccc(N2CCNC(=O)C23CC3)cc1Cl 2188549719 YRYDZEMXYJMKRP-JTQLQIEISA-N 293.798 2.089 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)C12CC(C1)[C@H](C(F)(F)F)O2 2193095536 SNWVEEBOJYIXDN-CCNFQMFXSA-N 292.261 2.255 10 10 CECE Cc1cc(CO)ccc1N(C)[C@@H]1C[C@H]2[C@@H]1[C@H]1CC[C@H]2O1 2188724684 VZUAQIGIBCEMKW-NHMWIVBRSA-N 273.376 2.489 10 10 CECE CCC[C@H]1C[C@H](NC(=O)c2ccc(O)c(O)c2)CCO1 2182910792 CSASAFQYPMQBED-NEPJUHHUSA-N 279.336 2.175 10 10 CECE 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C[C@@H](O)c1ccc(N2CC[C@H]2CN(C)C)c(F)c1 2042653695 SJYVRTVYNJVWBU-PWSUYJOCSA-N 252.333 2.019 10 10 CECE CNC1(C)CCN(c2ccc(OC)c(F)c2)CC1 2044296758 MEEHRIXHGGFUSD-UHFFFAOYSA-N 252.333 2.413 10 10 CECE COc1ccc(N2CCC[C@@H]3CNC[C@H]32)cc1F 2044500218 AFSYADHDCWXTRE-ZWNOBZJWSA-N 250.317 2.023 10 10 CECE CCN1CCc2cc([C@H](NN)C(F)(F)Cl)ccc21 2044751451 ARVWTAVJQGQHQF-NSHDSACASA-N 275.730 2.405 10 10 CECE C[C@@H]1CCS[C@@H]1[C@@H](NN)c1ccc(N(C)C)cc1 2044733018 HADFMDSBDZHSMB-SWHYSGLUSA-N 265.426 2.399 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H](CO)C(C)(C)C2)c(F)c1 2194687403 FEPJMJKYBMANRD-GXSJLCMTSA-N 284.350 2.439 10 10 CECE CCn1nc(C(=O)N(C)Cc2ccc(N)cc2)cc1C 2185729747 MJQVVSNICOGQDO-UHFFFAOYSA-N 272.352 2.066 10 10 CECE C[C@@H](O)c1ccc(N2CC(N3CCSCC3)C2)c(F)c1 2191166194 CRFHMUVSLYNOLW-LLVKDONJSA-N 296.411 2.116 10 10 CECE C[C@H](NC[C@@H]1[C@@H]2CCO[C@@H]21)c1ccc(F)cc1O 2056389412 QZCSKUUAEJPZHP-VVHPZPEWSA-N 251.301 2.217 10 10 CECE CCCN(C[C@@H]1CCCNC1)c1ccc(OC)cc1N 2191582565 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2.008 10 10 CECE CCOc1ccc(O)c(CNC[C@@H](OC)C(F)(F)F)c1 733329617 HXVBPRWMOIGZGV-GFCCVEGCSA-N 293.285 2.458 10 10 CECE Oc1ccc(F)cc1CN1CC2(CCOCC2)C1 839140948 KWFHKMLZTYRLPP-UHFFFAOYSA-N 251.301 2.144 10 10 CECE CN(C)c1ccc(/C=C\CN2CC[C@H](CO)C2)cc1 835028854 UFGYLHMIHKXBRE-JZIMQPMSSA-N 260.381 2.080 10 10 CECE [N-]=[N+]=NCCNC(=O)C1CC(OCc2ccccc2)C1 1954475412 ULGJCBUFMCNJBY-UHFFFAOYSA-N 274.324 2.408 10 10 CECE COc1ccc(CNCCSC(F)F)c(O)c1 2212834664 ZQQAUPKVCMQZPU-UHFFFAOYSA-N 263.309 2.446 10 10 CECE Cc1cc(N(C)C)ccc1CNC[C@@H]1CCC[C@H]1O 840951771 JVPAQHFYLXWPEO-GOEBONIOSA-N 262.397 2.312 10 10 CECE C[C@@H]1CNCC[C@@H]1NCc1c(O)cccc1Cl 841064007 NVYSOWMIYUMBHZ-SKDRFNHKSA-N 254.761 2.133 10 10 CECE CC(C)O[C@@]1(CNCc2ccc3c(c2)CCO3)CCOC1 922610767 DMRARUCOJFDERN-QGZVFWFLSA-N 291.391 2.295 10 10 CECE Cc1cc(CCN[C@H]2CCc3cccc(O)c32)nn1C 926908692 GLSIZYLQCGCINT-AWEZNQCLSA-N 271.364 2.254 10 10 CECE COC(=O)C1=CC[C@H](N[C@@H](C)c2ccccc2O)C1 858472083 FRZNOMHHKPBIAT-JQWIXIFHSA-N 261.321 2.305 10 10 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CCON(CCN)Cc1c(O)ccc2ccccc12 1922324333 NPSQTRWHIJDOEO-UHFFFAOYSA-N 260.337 2.258 10 10 CECE CN1CCCc2c1ccc1c2C[C@H](C(=O)O)CCO1 211907852 CCJJGKUQAGXNLA-SNVBAGLBSA-N 261.321 2.095 10 10 CECE O=[N+]([O-])c1cccnc1NCc1c(O)cccc1F 1472881892 CJURYIOYOHUJEF-UHFFFAOYSA-N 263.228 2.447 10 10 CECE CNCc1ccc(N(C)C[C@]23CO[C@](C)(C2)C3)cc1 2138115884 DCCXYLKZCNUQBZ-IYBDPMFKSA-N 260.381 2.411 10 10 CECE O=C(Cc1ccsc1)NCc1cc(O)ccc1O 1643879492 RZJPLRVUVXDAKL-UHFFFAOYSA-N 263.318 2.018 10 10 CECE CCCN1CCO[C@@H](c2noc(-c3sccc3O)n2)C1 123083051 CCPPHKCVNYKQLS-SNVBAGLBSA-N 295.364 2.287 10 10 CECE COc1cc(N2CCOC(C)(C)[C@H]2C)ccc1CN 2139685485 GBUZUMHDLUYURW-LLVKDONJSA-N 264.369 2.158 10 10 CECE Cc1cccc(CN2C[C@H]3CCCN3C[C@@H]2C)c1O 124601967 QGTJLRLAUNXNIG-DZGCQCFKSA-N 260.381 2.369 10 10 CECE COc1cccc2c(=O)c3c(O)c(O)c(O)cc3oc12 14764102 ZKDXDGJSBPWWEM-UHFFFAOYSA-N 274.228 2.072 10 10 CECE Cc1cccc(CNCC(=O)OC(C)(C)C)c1O 158820880 LCWFCMDNJNWSFA-UHFFFAOYSA-N 251.326 2.132 10 10 CECE CN(Cc1cccc(F)c1O)C[C@H]1CCCOC1 160237475 AUBCQKHYZGKETD-LLVKDONJSA-N 253.317 2.390 10 10 CECE CNCc1ccc(N(C)CCCN(C)C)c(Cl)c1 164034126 MKBKZXDUHGNHLB-UHFFFAOYSA-N 269.820 2.447 10 10 CECE COc1cc(N2C[C@@H](C)C[C@H](OC)C2)ccc1CN 2140965093 NQLYLKMVWWNVGF-FZMZJTMJSA-N 264.369 2.015 10 10 CECE COc1cc(N)c(N(C)[C@@H](C)CSC)cc1OC 167173368 AIJVRDHUVNOWFO-VIFPVBQESA-N 270.398 2.474 10 10 CECE C[C@@H](CCO)N[C@@H](C)c1ccc(N2CCC(O)CC2)cc1 151912788 RZFWIPJYKRNOGF-KBPBESRZSA-N 292.423 2.069 10 10 CECE CC[C@@H](N[C@H](C)Cn1cncn1)c1ccccc1O 155435156 FDHDLQSIZWWIDL-DGCLKSJQSA-N 260.341 2.113 10 10 CECE COc1cc(CN2C[C@@H](C)O[C@H](C)C2)c(O)cc1C 159457199 LQMVCLNHHRRQCI-VXGBXAGGSA-N 265.353 2.318 10 10 CECE CC(C)[C@H](CN)CN(C)c1ccc2c(c1)OCCO2 259048692 RWWBMAJCTZQLRG-GFCCVEGCSA-N 264.369 2.125 10 10 CECE C[C@@H](N[C@H](C)c1c(O)cccc1O)C(=O)NC(C)(C)C 235224155 NKHSBJCWOWLESN-NXEZZACHSA-N 280.368 2.052 10 10 CECE COc1nn(C)cc1CN[C@H](C)c1cc(F)ccc1O 903337665 KYYQPGQVFNBPGC-SECBINFHSA-N 279.315 2.124 10 10 CECE CN(C)c1ccc2c(c1)OCCN2CCOC(F)F 851882428 XKXXNAGFRSQVDD-UHFFFAOYSA-N 272.295 2.191 10 10 CECE CCCOc1cc(N2CC[C@@H](C)[C@@H](N)C2)ccc1N 1876333843 UFIJIYBVOJTSSI-RISCZKNCSA-N 263.385 2.231 10 10 CECE CN(Cc1ccccc1O)c1ccnc2nccn12 1877525664 YBLWNZOJTHHHNG-UHFFFAOYSA-N 254.293 2.071 10 10 CECE C[C@@H]1CCC[C@@]1(C)NC(=O)c1cc(O)c(O)c(O)c1 1878799350 PPAWFBPMTIRVGP-XLKFXECMSA-N 265.309 2.112 10 10 CECE C[C@H]1[C@@H](C)[C@@H](N(C)c2ccc(CN)cc2)CCN1C 1879236059 CUKDEJXTZFNECV-WWGRRREGSA-N 261.413 2.310 10 10 CECE c1cc2c(cc1CNC[C@]13CCOC[C@@H]1C3)CCO2 1880194229 BENDQERLYCXKKA-GOEBONIOSA-N 259.349 2.138 10 10 CECE COC12CC(C1)N(c1c(F)cc([C@@H](C)O)cc1F)C2 1880490679 QKQFGFFRXKNPTI-CCMBEOLZSA-N 269.291 2.386 10 10 CECE COC1(COC(=O)Nc2ccc(N)cc2)CCC1 2254981012 YOCZJGXEROXVJF-UHFFFAOYSA-N 250.298 2.386 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]3C3CC3)ccc21 2144904420 PUJUENRENRHNHS-CABCVRRESA-N 271.364 2.278 10 10 CECE Oc1cc(C(F)(F)F)ccc1[C@@H]1COCCCN1 1952305317 XLYXCAWDMRUEFT-JTQLQIEISA-N 261.243 2.462 10 10 CECE c1cc2c(cc1CNCC13CC(CO1)C3)CCCO2 1965969498 PUFPQPRYIHFFKB-UHFFFAOYSA-N 259.349 2.280 10 10 CECE C[C@@H](NC[C@H](CO)C(F)(F)F)c1ccc(F)cc1O 1967500667 LIRYDXDFGRORPC-HTQZYQBOSA-N 281.249 2.353 10 10 CECE CC1(C)OCC[C@@H]1CNCc1ccc(F)cc1O 1967794579 RHAOSVJWIBFFGT-LLVKDONJSA-N 253.317 2.436 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1CCCc2nccn21 1967905847 KUWBLZMSMVEABX-ZDUSSCGKSA-N 275.327 2.395 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CN(Cc2c(O)cccc2F)C1 1968182237 UKIIKZIZLHYTIO-VHSXEESVSA-N 267.300 2.074 10 10 CECE O=C(O)[C@H]1C=CCN(Cc2c(O)cccc2Cl)C1 1968223882 PKMRFYQWTNDJLD-VIFPVBQESA-N 267.712 2.118 10 10 CECE CN(C)c1ccc(CNCc2c(Cl)ncn2C)cc1 1968438654 MIXXSBHGXVSDMR-UHFFFAOYSA-N 278.787 2.429 10 10 CECE C[C@@H]1CN([C@H](CN)c2ccc(N(C)C)cc2)CCS1 252978386 BPJXCHYHKGRQTJ-IUODEOHRSA-N 279.453 2.190 10 10 CECE CN(C)c1ccc(CN2CCNCC(C)(C)C2)cc1 1972736577 YWLCMGIVYDWZRU-UHFFFAOYSA-N 261.413 2.184 10 10 CECE COc1cc(N)c(N(C)[C@@H]2CCOC[C@H]2C)cc1OC 2149255453 WVHRHTZJFJTYGP-ZYHUDNBSSA-N 280.368 2.147 10 10 CECE Cc1ccc(O)c(CN[C@H](C)[C@H]2CCCS(=O)(=O)C2)c1 2146111877 KHZVGWZIPOBAOF-OLZOCXBDSA-N 297.420 2.004 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)CCSC)c(Cl)cc21 167638130 JKBIEEGIFRTZJW-GFCCVEGCSA-N 299.827 2.352 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](COC)[C@@H]3C2)c(C)c1 2149552427 SBKCFWNHOPIVDP-XHSDSOJGSA-N 274.408 2.433 10 10 CECE COC(=O)C[C@@H](c1ccc(O)c(O)c1F)C1CC1 260443550 YTRVVAKMJGESOU-SECBINFHSA-N 254.257 2.294 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(F)c(C)cc1O 260886718 WBUHEKAVRPCMQB-LLVKDONJSA-N 255.289 2.183 10 10 CECE CCc1ccc(S(=O)(=O)NCc2ccccc2O)s1 158586988 WDMMOEVDUAROHC-UHFFFAOYSA-N 297.401 2.495 10 10 CECE CCOC(=O)c1ccc(O)c(O)c1C(F)(F)F 261183950 GMUZKQBQSGTTJG-UHFFFAOYSA-N 250.172 2.293 10 10 CECE CC[C@H](CCNCc1cc2c(cc1O)OCO2)COC 2152342849 VJPJZWSQMWDBCT-LLVKDONJSA-N 281.352 2.273 10 10 CECE COc1ncccc1CN[C@H](C)c1cc(O)ccc1O 37650432 KKOJMRHXRVPHPO-SNVBAGLBSA-N 274.320 2.352 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2Cc1ncccn1 162152770 YIAJTEACKIIUGD-GFCCVEGCSA-N 268.364 2.320 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3OCCO[C@H]3C2)c(Cl)c1 2151736382 GPCZQXILRRCJMO-ONERCXAPSA-N 296.798 2.354 10 10 CECE NCc1ccc(N2CCC[C@H]3OCC[C@@H]3C2)c(F)c1F 2151885989 KPTBSSGGLUORQM-DGCLKSJQSA-N 282.334 2.429 10 10 CECE COCCNCc1ccc(N2CC(C3CC3)C2)c(F)c1 2153705104 OEMGVEBANJMMHV-UHFFFAOYSA-N 278.371 2.408 10 10 CECE O=C(O)C[C@@H]1CCN1Cc1ccc(Cl)cc1O 2001240373 LSYSFIGSHAGVSK-JTQLQIEISA-N 255.701 2.095 10 10 CECE COc1cccc([S@](=O)CCOc2ccc(N)cc2)c1 40963560 CFJGFAYPTREOGW-FQEVSTJZSA-N 291.372 2.464 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@H]2CO)c(Cl)c1 2007531950 QTCAHEGMMAAKNA-KOLCDFICSA-N 253.729 2.130 10 10 CECE CC1(C)C[C@H](C(=O)O)CCN1Cc1ccc(O)c(O)c1 2155065887 SKFLWYSKAWBDCO-LLVKDONJSA-N 279.336 2.173 10 10 CECE CC(C)[C@@H](CN(C)C)NCc1ccc2c(c1)CCO2 49199332 COILUDNZFFNPBA-OAHLLOKOSA-N 262.397 2.297 10 10 CECE OCc1ccc(N2CC[C@H]3COC[C@H]32)c(Cl)c1 2021412448 KVSADJXAPWDZNO-GXFFZTMASA-N 253.729 2.057 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)C2(C)C)cc1Cl 2023138267 BIUGUVJTKSUSSC-PRHODGIISA-N 255.745 2.353 10 10 CECE CN[C@H](CC(=O)N(C)[C@H](C)c1ccccc1O)C(F)F 2156821840 VUQGOWRXAJTSEE-MWLCHTKSSA-N 286.322 2.155 10 10 CECE C[C@]1(CCO)CCN1c1ccc(CN)c(Br)c1 2025228781 VHJXXEQGVHIPJM-CYBMUJFWSA-N 299.212 2.259 10 10 CECE CN(C)c1ccc([C@H]2N[C@H](CC(F)F)CO2)cc1 2028007507 BJWKAZVGTJFTQR-MFKMUULPSA-N 256.296 2.395 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)O)cc2F)C[C@@H]1F 2029818283 KASIOXXGMBBSIS-LJUAHTATSA-N 257.280 2.052 10 10 CECE CCN[C@@H]1CCN([C@H](C)c2cc(F)ccc2O)C1 2030035746 KUMVFHKYHJAXSB-ZYHUDNBSSA-N 252.333 2.276 10 10 CECE CCN1CCC[C@H](N(CC)Cc2ccc(N)cc2)C1=O 2157357070 OUBOLMIYIHWCQQ-HNNXBMFYSA-N 275.396 2.102 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CC[C@@H](C)SC1 2031154685 RHOFRCXNRDTSBK-HONMWMINSA-N 267.394 2.299 10 10 CECE NCCc1cccc2c1ccn2COCC(F)F 2031865467 WQZOEODTLQBNRJ-UHFFFAOYSA-N 254.280 2.382 10 10 CECE CCCN(C(=O)[C@@]12C[C@@H]1[C@H](OC)C2)c1ccc(N)cc1 2157456589 OJNLLLIBWGSIAH-IIAWOOMASA-N 274.364 2.437 10 10 CECE CCCNCc1ccc(N2CC[C@H](C)[C@H]2CO)cc1 299956275 HTLJWURXJVCJRZ-XJKSGUPXSA-N 262.397 2.393 10 10 CECE Nc1ccc(CCN2CC[C@@H]3[C@@H](C2)C3(F)F)cc1 2034634798 HWIQNMDYSZZGDJ-CHWSQXEVSA-N 252.308 2.398 10 10 CECE C[C@H](N)c1ccc(N2CCS[C@@H]3CC[C@H]32)cc1O 2034726233 PPYQEAOGJOZJND-MRCXROJRSA-N 264.394 2.496 10 10 CECE CN(Cc1cc(F)ccc1O)[C@H]1CCC[C@@H](N)C1 2038475918 GQOUCWSNIPCKJT-OLZOCXBDSA-N 252.333 2.233 10 10 CECE N[C@@H]1CCCN(c2ccc(OC3CCOCC3)cc2)C1 69310950 QPHBSOAXSPYISZ-CYBMUJFWSA-N 276.380 2.172 10 10 CECE COC[C@H](C)Oc1ccc(N2CCC(N)CC2)cc1C 70378412 XTRRLROUQQGQSO-ZDUSSCGKSA-N 278.396 2.336 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1CC[C@H](C)OC1 401502696 IJEBEVKOQJRHOC-WDEREUQCSA-N 278.352 2.425 10 10 CECE Cc1cc(CN(C)CC(=O)c2ccc(O)c(O)c2)sn1 404428004 JLCFJOQROMDORD-UHFFFAOYSA-N 292.360 2.177 10 10 CECE Nc1ccc(NC(=O)NCc2ncc(C3CC3)o2)cc1 2160639375 SSFSYWRKANZMTB-UHFFFAOYSA-N 272.308 2.456 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC[C@]34CCSC4)ccc21 2158500331 OUKLLCABONOIOZ-DZGCQCFKSA-N 289.404 2.114 10 10 CECE CNCc1ccc(N2CC[C@H](O)C(C)(C)C2)c(C)c1 311933791 DYASGTSQHHCVAV-HNNXBMFYSA-N 262.397 2.312 10 10 CECE Cc1cccc(O)c1CN1C[C@@H]2CCC[C@@]2(C(=O)O)C1 2160786151 MRQWOLSSRJYLFV-BLLLJJGKSA-N 275.348 2.387 10 10 CECE COc1cccc(O)c1CN1CCCC[C@@]1(C)C(=O)O 2160701077 MLCZHWQZALPBKJ-HNNXBMFYSA-N 279.336 2.230 10 10 CECE CC[C@H](NCc1cc(OC)ccc1O)[C@H](O)CC 313123431 VXQSCQOWPZGCCS-QWHCGFSZSA-N 253.342 2.040 10 10 CECE CC[C@@H]1CN[C@@H](C(=O)N(C)[C@@H](C)c2ccccc2O)C1 2159279312 ZIPIZONFLYHYEF-SGMGOOAPSA-N 276.380 2.300 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[S@@](=O)CC2)cc1O 321640034 LERJTBCWPIMPTQ-MPBGBICISA-N 296.436 2.022 10 10 CECE CNCc1ccc(N2CC[C@H](CCN(C)C)C2)cc1 701425470 RDYVHTADDSEFLP-HNNXBMFYSA-N 261.413 2.184 10 10 CECE CO[C@H]1C[C@@H](N(C)c2ccc(CO)cc2C)C[C@H]1OC 2172542854 HJEJDGVVSCJVQD-RBVVOMGSSA-N 279.380 2.116 10 10 CECE CN1CCc2cc([C@H](O)[C@]3(CN)CC3(C)C)ccc21 702163932 ZEGZPFTVVMTHLX-GOEBONIOSA-N 260.381 2.087 10 10 CECE CO[C@H]1CCN(c2ccc(OC3CC3)cc2)[C@@H](CN)C1 2162648438 HCHGCQVDHWCKRO-CJNGLKHVSA-N 276.380 2.170 10 10 CECE CCN1CCc2cc([C@H](N)C3(O)C[C@H]4C[C@@H]4C3)ccc21 2163140216 HCEDYPKSUCGORJ-FMKPAKJESA-N 272.392 2.230 10 10 CECE COCCNCc1ccc(N2C[C@H](C)[C@@H]2C)c(F)c1 706738367 WFWYBFKLUBKLDO-RYUDHWBXSA-N 266.360 2.406 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CN(C)C[C@H]3C2)c(Cl)c1 706999983 OVCHGOFCNUIORU-DRZSPHRISA-N 279.815 2.358 10 10 CECE CCNCc1ccc(N(C)C[C@]23COC[C@@H]2C3)c(F)c1 689286951 UZMSTFTYXNBAEZ-XJKSGUPXSA-N 278.371 2.408 10 10 CECE COc1cccc(CN(C)[C@@H]2CCO[C@@H](C)C2)c1O 721475782 NHBAUUCNEUQFCW-WCQYABFASA-N 265.353 2.400 10 10 CECE CC(C)[C@H]1CN(C(=O)Cc2ccc(N)cc2)CCCO1 378779363 GTURZEAUXPKBBK-OAHLLOKOSA-N 276.380 2.085 10 10 CECE CC(C)(C)CS(=O)(=O)N1CCC[C@@H]1CN=[N+]=[N-] 692806572 NGUXQLLDZFDQIW-SECBINFHSA-N 260.363 2.137 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@H]2C)c(F)c1 384821053 QBBFQZQACWFYFN-YPMHNXCESA-N 266.360 2.285 10 10 CECE CO[C@@H]1CCC[C@@H]1OC(=O)CCc1ccc(N)cc1 388431259 UGACGDHYCOMPDP-KGLIPLIRSA-N 263.337 2.312 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@](C)(O)C(F)F)c1 698677046 JLOAHZSBDZMMOH-TVQRCGJNSA-N 259.296 2.367 10 10 CECE CCCC(=O)NCCNCc1cc(Cl)ccc1O 393201525 DSEHJBYADASFTJ-UHFFFAOYSA-N 270.760 2.052 10 10 CECE C[C@@H](CCN)CC(=O)N(C)[C@@H](C)c1ccccc1O 393440426 VNQRGCSSWYEGPP-RYUDHWBXSA-N 264.369 2.287 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1ccc(C)nn1 396873167 BRJCNNHLFKEUSP-UHFFFAOYSA-N 270.336 2.030 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3C[C@H](CO)[C@@H]3C2)cc1 2174307974 JQUTUXAWYZVNOR-ZMSDIMECSA-N 274.408 2.249 10 10 CECE C[C@H](N[C@@H]1CSC[C@@H]1C)c1c(O)cccc1O 397867281 DGXVZHDUSVFCDR-LPEHRKFASA-N 253.367 2.500 10 10 CECE Nc1ccc(CCCN2CC3(CO)CCC2CC3)cc1 2178887590 KIZQLODLMOCRHN-UHFFFAOYSA-N 274.408 2.438 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@H](CN)CC12CCC2 2174633878 NEJGZWREADKGKQ-VXGBXAGGSA-N 276.380 2.362 10 10 CECE C[C@H](N)c1ccc(N2CC=C[C@@H]2CO)cc1C(F)(F)F 2176345201 WWCALBQRKLVQJY-GXSJLCMTSA-N 286.297 2.462 10 10 CECE C[C@H]1CCN(CCCc2ccc(N)cc2)C[C@H]1C(=O)O 2179652323 RJYDGDFKDZEVAC-SWLSCSKDSA-N 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2.233 10 10 CECE COc1cc(C)c2c(c1)C[C@H](CCC(=O)O)CN2C 84801399 BTHVXJHDABVATF-NSHDSACASA-N 263.337 2.477 10 10 CECE COC(=O)[C@](C)(NCCN=[N+]=[N-])c1ccc(F)cc1 90256799 ZDJVRDAJCGQWLP-GFCCVEGCSA-N 266.276 2.114 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@]2(C)CNC[C@]2(C)C1 705685370 DVBGSNQQGYJNHE-HFBAOOFYSA-N 276.380 2.090 10 10 CECE COc1ccc(N(C[C@@H](C)O)C(C)C)c([N+](=O)[O-])c1 691323431 PXHOWKDDCJJXJI-SNVBAGLBSA-N 268.313 2.199 10 10 CECE Nc1ccc(NC(=O)CCCN2C[C@H]3CCC[C@@H]32)cc1 706731140 JQDKQQXIHPNXMD-DOMZBBRYSA-N 273.380 2.472 10 10 CECE CNCc1ccc(N2CC[C@]3(CCOC3)C2)cc1C 707655779 ZVMBIEOMYQYJDR-INIZCTEOSA-N 260.381 2.331 10 10 CECE CCCNCc1ccc(N(C)[C@H]2COC[C@@H]2O)c(Cl)c1 708116091 UQXRTRIGSRWXBO-GJZGRUSLSA-N 298.814 2.036 10 10 CECE CN(CCC1CCC1)C(=O)COc1ccc(N)cc1 711219591 CEYDZUBYOGYMQT-UHFFFAOYSA-N 262.353 2.296 10 10 CECE CCc1cccc(CN2C[C@@H](C)N(C)[C@H](C)C2)c1O 692130035 RXFUMILYHNJANV-CHWSQXEVSA-N 262.397 2.479 10 10 CECE CCNCc1ccc(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1 718175644 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10 10 CECE CN(Cc1ccoc1)C(=O)CCOc1ccc(N)cc1 48909337 JPUYSORSPIXSRG-UHFFFAOYSA-N 274.320 2.289 10 10 CECE CCOC(=O)[C@@H](NCC1CC1)c1cc(F)ccc1O 233675539 SNFYFHUSMXXSOF-ZDUSSCGKSA-N 267.300 2.135 10 10 CECE CCN(CCCN(C)C)c1ccc(CNC)c(C)c1 230725224 LTHIJOUFONXXPW-UHFFFAOYSA-N 263.429 2.492 10 10 CECE CCC(O)(CC)CN[C@H](C)c1c(O)cccc1O 232931173 RKFQBCYDMMCGAK-SNVBAGLBSA-N 253.342 2.300 10 10 CECE CC(C)[C@@H](O)[C@@H](N)c1c(F)ccc(Br)c1O 95804264 IKFCCBLLCHNHHI-VHSXEESVSA-N 292.148 2.311 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@H]2CNC[C@H]2C1 385895196 DZFXXBXDPYABRX-QWRGUYRKSA-N 266.772 2.087 10 10 CECE C[C@@H](N)c1ccc(I)cc1O 95782844 BOSBKPOJLRRZGB-RXMQYKEDSA-N 263.078 2.017 10 10 CECE CCNCc1ccc(OC)c(COC[C@H]2CCOC2)c1 50126144 BEIGGKYMWWBKSB-AWEZNQCLSA-N 279.380 2.358 10 10 CECE Nc1ccc(OC[C@@H](O)COCc2ccccc2)cc1 51327414 VYYMAIFIPGQHRW-HNNXBMFYSA-N 273.332 2.225 10 10 CECE C[C@@H](C(=O)O)c1ccc(Br)c(O)c1O 258317725 DKQUIFCMKVCORY-SCSAIBSYSA-N 261.071 2.048 10 10 CECE COc1ccc(N(C)[C@@H]2CCNC2)cc1Br 258956009 KRGAUCUFPLDTJS-SNVBAGLBSA-N 285.185 2.256 10 10 CECE CN(C)[C@H]1[C@@H]2CN(c3ccc4c(c3)CCCN4)C[C@@H]21 384644608 BFUGFTIAXBHORT-FOLVSLTJSA-N 257.381 2.041 10 10 CECE COC(=O)[C@@H](CF)NCc1cc(Cl)cc(Cl)c1O 809778872 YZDPQRXQTIHQDB-SECBINFHSA-N 296.125 2.300 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1cnc(OC)s1 2164083085 IKLWWEIAPPLPRA-CQSZACIVSA-N 289.404 2.453 10 10 CECE CCCN[C@H](c1cn(CCC)nn1)c1ccccc1O 2164275338 XVUZSCJQOHVPQT-HNNXBMFYSA-N 274.368 2.483 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(OC2CCCC2)cc1 808502162 ZDDRDHLJEDGSFI-UHFFFAOYSA-N 290.315 2.323 10 10 CECE FC(F)(F)[C@H]1CCNCCN1c1ccc2c(c1)CCO2 2162848917 GNADLNDSXUHCNW-CYBMUJFWSA-N 286.297 2.352 10 10 CECE CCN1CCc2cc([C@H](O)c3ccc(CN)o3)ccc21 2163072910 ZYDKYPYGSNROOJ-INIZCTEOSA-N 272.348 2.202 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3C[C@H]4CC[C@H]3NC4)ccc21 2163080122 RWEGSSJXRNSGCV-CYHLAULCSA-N 272.392 2.100 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CCC[C@H]3CN)ccc21 2163107983 RFLGZDFCKGHVHU-UXLLHSPISA-N 274.408 2.477 10 10 CECE NCC1(F)CC([C@H](O)c2ccc(N3CCCC3)cc2)C1 2163105177 DAKLCESWZIFTPG-OGVSOVDVSA-N 278.371 2.397 10 10 CECE COC[C@@H](N)C[C@H](O)c1ccc(N2CCCCC2)cc1 2163107188 NLPQKTGYPVTWNU-HOCLYGCPSA-N 278.396 2.074 10 10 CECE C[C@@H]1CSC[C@@]1(O)[C@@H](N)c1ccc(N2CCCC2)cc1 2163242067 FDBYQLZVYDFPJY-KCXAZCMYSA-N 292.448 2.401 10 10 CECE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]3C[C@H]32)cc1 822856056 FCBAEEHXYSEJIP-CMPLNLGQSA-N 272.308 2.474 10 10 CECE Cc1cc(Cl)cc(CN(C)C[C@H]2COCCO2)c1O 827140539 LFASDSPVERHSSO-ZDUSSCGKSA-N 285.771 2.201 10 10 CECE O=C(c1cc2cc(O)c(O)cc2s1)N1C[C@H]2C[C@H]2C1 912984202 NBWWIYZYAQFFIJ-DTORHVGOSA-N 275.329 2.404 10 10 CECE Cc1cccc(O)c1[C@H](NC(=O)OC(C)(C)C)C(=O)O 1954512295 SLTPZUPPWMRDEE-NSHDSACASA-N 281.308 2.351 10 10 CECE CCCCOCC(=O)N[C@@H](C)c1ccccc1O 827973647 VTYHLLOBAXOKQG-NSHDSACASA-N 251.326 2.386 10 10 CECE CCOc1ccc(O)c(CNC[C@H]2C[C@@H](OC)C2)c1 858331646 ZMQATJRAJQSTRF-VDISTLRHSA-N 265.353 2.306 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc[nH]c1 935946392 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IJENLLGCZMGQSB-GHMZBOCLSA-N 253.342 2.359 10 10 CECE CC[C@H](C[C@@H](C)O)NCc1cc(C)cc(OC)c1O 895463764 CSEBLSVMWYKGSP-DGCLKSJQSA-N 267.369 2.348 10 10 CECE CCOc1cccc([C@@H]2CN[C@@H](C(C)C)CN2C)c1O 83587050 MANBBQRVRWLRIB-KGLIPLIRSA-N 278.396 2.392 10 10 CECE Oc1cc2c(cc1O)[C@@H](c1ccc(O)c(F)c1)NCC2 83621012 KECJFYUCZVFBRF-OAHLLOKOSA-N 275.279 2.178 10 10 CECE CN[C@H]1CN(C(C)C)c2c(OC)cc(OC)cc21 84797918 YJIQCASHJBUJLQ-LBPRGKRZSA-N 250.342 2.193 10 10 CECE C[C@H](O)C[C@@H](C)CNCc1ccc(F)c(F)c1O 703309094 RONAAPGEYQRDRS-BDAKNGLRSA-N 259.296 2.167 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCCC(F)(F)CC3)ccc21 702811518 LCGGJXQLIKOJCY-GFCCVEGCSA-N 281.306 2.264 10 10 CECE C[C@@H](C(=O)NCCCCN=[N+]=[N-])N1[C@H](C)CC[C@H]1C 706393906 UYALCPAFAWOPFU-UTUOFQBUSA-N 267.377 2.454 10 10 CECE CN(C[C@@]12CCCN(CC1)C2)c1ccc(CO)cc1F 691474343 MTLYWFHBIUJLRX-MRXNPFEDSA-N 278.371 2.240 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H](CO)C(C)(C)C 689216825 FMHUZKGQLQKFJR-AWEZNQCLSA-N 278.396 2.067 10 10 CECE C[C@@H](NCC[C@H](O)C(F)(F)F)c1cc(O)ccc1O 717345077 DQSCKOMXVHVPGL-HQJQHLMTSA-N 279.258 2.062 10 10 CECE CN(CCCc1ccc(N)cc1)Cc1ncccn1 718972901 SYLFXBXDOJXDHD-UHFFFAOYSA-N 256.353 2.123 10 10 CECE NCc1ccc(N2CCO[C@@H](C3CC3)C2)c(F)c1F 694846739 PWZYCWQAXLZQJJ-GFCCVEGCSA-N 268.307 2.039 10 10 CECE CCCN1CC[C@H](CN[C@H](C)c2c(O)cccc2O)C1 692977124 QNTXETHLRYPBSK-CHWSQXEVSA-N 278.396 2.480 10 10 CECE COc1ccc(CNC(=O)NC[C@@H](C)C(C)C)c(O)c1 792990124 QMPVGXFIFVLSJQ-LLVKDONJSA-N 280.368 2.492 10 10 CECE COC(=O)C1(NCCN=[N+]=[N-])CCC2(CC2)CC1 829194248 AWAVULVUHVWIIV-UHFFFAOYSA-N 252.318 2.152 10 10 CECE COc1nccnc1N(Cc1ccc(N)cc1)C(C)C 686293206 NMHHZOAXRVGFIM-UHFFFAOYSA-N 272.352 2.482 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1CC[C@H]2[C@@H](C1)C2(F)F 1153885368 MPMMTFDNSIKOJX-JFUSQASVSA-N 297.301 2.395 10 10 CECE [N-]=[N+]=N[C@H]1CCN(CCC(=O)N2CCCCCC2)C1 2117130730 KTGNQOCXTAXJBY-LBPRGKRZSA-N 265.361 2.164 10 10 CECE Nc1ccc(CCCNC[C@H]2[C@H]3OCCC[C@H]23)cc1 2119927950 CPQOMQKPWORSGC-OAGGEKHMSA-N 260.381 2.216 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H]2[C@H](C)O)cc1O 2125825974 YXZDRSXJJMHJLC-UHIISALHSA-N 264.369 2.022 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](O)[C@@H]2C)cc1C(F)(F)F 2126118950 HHRLNEQFEWWCSL-UBJUHAIHSA-N 275.270 2.328 10 10 CECE Cc1cc(N(C)[C@@H](CCO)C(F)(F)F)ccc1CN 2121999047 VREOAPLNQBNBBZ-LBPRGKRZSA-N 276.302 2.203 10 10 CECE C[C@H]1C[C@H]1N(CCO)c1ccc2c(c1)CCC[C@@H]2N 2128279051 KNDUUHJKFUFXCS-KNXALSJPSA-N 260.381 2.230 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@H](C)[C@H](O)C3)ccc21 2128279132 LTFYCDCQBURODV-IUIKQTSFSA-N 260.381 2.100 10 10 CECE CN(c1ccc2c(c1)CCC[C@H]2O)C1(CO)CCC1 2128268658 JSRWESVWBDJXPT-OAHLLOKOSA-N 261.365 2.408 10 10 CECE CN[C@@H]1CCc2cc(N3CCC[C@H](O)CC3)ccc21 2128308844 KMKHNKVOAUIURW-GOEBONIOSA-N 260.381 2.245 10 10 CECE CC[C@H](N[C@H]1CCN(C)C(=O)C1)c1ccccc1O 2131974375 XBTGKUNSLXRCNY-AAEUAGOBSA-N 262.353 2.054 10 10 CECE CN1CCC(C)([C@@H](N)c2ccc(N(C)C)cc2)CC1 1902580121 WQCVADGNRWHUBP-HNNXBMFYSA-N 261.413 2.484 10 10 CECE Cc1ccc(CNC(=O)c2cc(O)c(O)c(O)c2)s1 2132348567 OFBXNHCFFYPTHE-UHFFFAOYSA-N 279.317 2.103 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@H]2CN3C(C)C)cc1 2131054319 RXLFLIBEEIDFOV-HOTGVXAUSA-N 259.397 2.077 10 10 CECE CC[C@H](O)c1ccc(N2C[C@@H]3CC[C@@]3(CO)C2)cc1 1903984159 PBBLUECXCLWZEC-BPUTZDHNSA-N 261.365 2.339 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H]2COC[C@@H](C2)C1 2132486087 HEUKDRAJTZRISV-WOPDTQHZSA-N 263.337 2.127 10 10 CECE C[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc(N)cc2)CS1 2132952669 KKTRMZUPISGGBY-MFKMUULPSA-N 279.409 2.033 10 10 CECE CO[C@H]1C[C@@H](CF)N(c2ccc3c(c2)CC[C@@H]3O)C1 2133710435 TVSPVEMEWMHSNB-YDHLFZDLSA-N 265.328 2.229 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](CO)C(C)(C)C2)c(F)c1 1914022143 ZRJBPQMWHQTJGL-PWSUYJOCSA-N 266.360 2.300 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2[C@H](F)[C@@H](O)C3)cc1Cl 2134105624 SSWYRCAMAQYRKW-PYJNHQTQSA-N 284.762 2.239 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](O)C23CCC3)cc1O 1914399549 WNHXTHAHUHDFJA-ABAIWWIYSA-N 276.380 2.166 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2sncc2Br)C1 1912183871 AVHLZLKFAXKAHC-UHFFFAOYSA-N 288.130 2.040 10 10 CECE [N-]=[N+]=N[C@H]1CCN(CCCOCC(F)(F)F)C1 1912161681 MFNFORJIFBHNPA-QMMMGPOBSA-N 252.240 2.340 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)C[C@@H]2CCCCO2)C1 1912180083 VVBVUBDBXUUCPV-NEPJUHHUSA-N 266.345 2.495 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(CCS[C@@H]2CCOC2)C1 1912193306 NGDFYMUBDPZKJD-GHMZBOCLSA-N 256.375 2.141 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)N1C[C@H]2CCC[C@@H]2C1 1912188748 QUJNIWDOEUNEBZ-GHMZBOCLSA-N 251.334 2.471 10 10 CECE Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC(N=[N+]=[N-])C1 1912192816 KJEMZMWSDUYJKL-UHFFFAOYSA-N 261.241 2.038 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 1912156554 OZLDVYFCVLEIMX-UHFFFAOYSA-N 281.659 2.383 10 10 CECE CCn1cc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])c(C)n1 1912211110 RYQJECQRJRUVCA-SNVBAGLBSA-N 262.317 2.126 10 10 CECE COc1cc2c(cc1OC)N(C)CC(C)(C)C(=O)N2 2134676124 MWLGKRQQIRWUAA-UHFFFAOYSA-N 264.325 2.118 10 10 CECE COc1ccc(O)c([C@H](C)N2CC(CCCN)C2)c1 2134802719 NEOCMMJGAAMWHP-NSHDSACASA-N 264.369 2.133 10 10 CECE CO[C@@H]1CCN(Cc2c(O)cccc2Cl)C[C@H]1OC 2134859399 JAHLCDUXWCGYLX-ZIAGYGMSSA-N 285.771 2.281 10 10 CECE CCNCc1ccc(OC)c(CN(CC)C2COC2)c1 1915716617 ZFNQFJPJRWBNQY-UHFFFAOYSA-N 278.396 2.025 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@]23CCOC3)c(F)c1 1915828787 SSLSNHQETGRKLF-XHDPSFHLSA-N 264.344 2.475 10 10 CECE CN(Cc1ccc(N)cc1)c1ncc(C(N)=O)cc1Cl 1917243792 WTNGSYICWGIECG-UHFFFAOYSA-N 290.754 2.053 10 10 CECE CCOCCN(CC)[C@@H](CN)c1ccc(N(C)C)cc1 111117432 MPBHSTZPGXCDTH-INIZCTEOSA-N 279.428 2.111 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@@H]1CCC[C@@H](F)C1 1452242997 MPEUWVVINUIOPP-GHMZBOCLSA-N 267.300 2.037 10 10 CECE CCCC[C@H]1C(=O)NN([C@H]2CCSC(C)(C)C2)C1=O 103093381 GSNLIJPYFGAGPK-QWRGUYRKSA-N 284.425 2.340 10 10 CECE COc1cccc(CNC[C@H]2CC[C@H](CO)CC2)c1O 1922661812 USCCCVUAYBSFMQ-JOCQHMNTSA-N 279.380 2.289 10 10 CECE CC[C@@](C)(O)C(=O)NCc1c(O)ccc2ccccc12 1472084645 BBKXUUZHUVRYIC-MRXNPFEDSA-N 273.332 2.323 10 10 CECE CCNCc1ccc(N2CC[C@@H](NC(C)=O)C2)c(Cl)c1 228305852 GHAFCIFMRVUFDG-CYBMUJFWSA-N 295.814 2.164 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@H](N)C3)c(F)c1F 2136977880 NIQYPMKJQMZVNE-AEJSXWLSSA-N 268.307 2.289 10 10 CECE COc1c(NC(=O)c2cc(O)cs2)ccnc1F 1558713151 DEXIVVAWPWATLV-UHFFFAOYSA-N 268.269 2.249 10 10 CECE C/C(=C/c1ccncc1)C(=O)NCCc1ccc(O)c(O)c1 1631510640 UMMNULFCCUJBPQ-BENRWUELSA-N 298.342 2.255 10 10 CECE O=C(Cc1cccc(F)c1)NCc1cccc(O)c1O 1633508248 MWOFDVAYXWXKRM-UHFFFAOYSA-N 275.279 2.096 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H]1CNCc1ccc(N)cc1 1929712160 CVUCOEARWMZPLM-CQSZACIVSA-N 291.395 2.368 10 10 CECE C[C@@H](NC(=O)c1cc(C=O)c[nH]1)c1ccccc1O 1643741979 ILBYQIXETGLRQR-SECBINFHSA-N 258.277 2.024 10 10 CECE C[C@@H]1CCC[C@H]1CNS(=O)(=O)Cc1ccc(N)cc1 230638393 LNZLHTWHAJEJRK-YPMHNXCESA-N 282.409 2.124 10 10 CECE O=C(NCc1c(O)cccc1F)c1ccccc1[N+](=O)[O-] 1646028957 OWUFQCPVDALSMV-UHFFFAOYSA-N 290.250 2.370 10 10 CECE C[C@H]1CC[C@@H](COc2ccc(N3CCNCC3)cc2)O1 231998121 KNHJILPHHRTTQW-BBRMVZONSA-N 276.380 2.043 10 10 CECE CC(C)(C)NCc1ccnc(-c2ccc(O)c(O)c2)n1 232500700 QAUAGTUQPNYZIE-UHFFFAOYSA-N 273.336 2.443 10 10 CECE COc1cc(N(C)C[C@H]2CCO[C@@H]2C)ccc1CN 2139681968 ALTOCNUNRJAVSP-DGCLKSJQSA-N 264.369 2.015 10 10 CECE CCN[C@@H](C)c1ccc2c(c1)CCCN2C[C@@H](C)C(N)=O 162269808 GNRWQOFTIUXPKD-OLZOCXBDSA-N 289.423 2.231 10 10 CECE NC(=O)c1ccc(CNCc2ccccc2O)c(Cl)c1 162839844 XFTWKVXEDKENAV-UHFFFAOYSA-N 290.750 2.434 10 10 CECE C[C@H](NC(=O)[C@]12C[C@](C)(CO1)C2)c1ccccc1O 2140277356 WRSGQPYOYWMTRR-NZVBXONLSA-N 261.321 2.139 10 10 CECE CCS[C@H]1CC[C@@H](NC(=O)COc2ccc(N)cc2)C1 233877054 SGAHFQYIJILEAE-OCCSQVGLSA-N 294.420 2.438 10 10 CECE COc1ccc(CN2CC[C@H]3[C@H](CCCN3C)C2)c(O)c1 156095945 QWRVLWBLYWWRLC-CJNGLKHVSA-N 290.407 2.317 10 10 CECE CC(C)OC(=O)c1cccc(/N=N/N2CCN(C)CC2)c1 1860486579 JRMBODIRUJFYAC-WUKNDPDISA-N 290.367 2.498 10 10 CECE CN1CCCc2cc3c(cc21)[C@H](CC(=O)O)CCO3 211905752 ASRUACDXJVYPJC-JTQLQIEISA-N 261.321 2.410 10 10 CECE C[C@H](C(=O)Nc1ccnn1-c1ccc(N)cc1)C1CC1 126237923 ZNZKOBMHVDCWJA-JTQLQIEISA-N 270.336 2.439 10 10 CECE NC(=O)[C@H]1CC[C@H](Nc2c(N)cccc2Br)C1 1942366250 VAZGGZSEKUCCIK-YUMQZZPRSA-N 298.184 2.097 10 10 CECE CN1CCCc2cc(CN3CCC[C@@H](N)CC3)ccc21 1205101660 INSLGFIMWMEPFR-MRXNPFEDSA-N 273.424 2.382 10 10 CECE COc1ccc(CN[C@@H]2CC[C@@H](O)C2(C)C)c(O)c1 2142126851 HUVQHGVQMTWXNF-ZIAGYGMSSA-N 265.353 2.040 10 10 CECE NC(=O)[C@@H](Nc1cccc(F)c1)c1cc(F)ccc1O 236186739 FENDGMQEGUOLJW-ZDUSSCGKSA-N 278.258 2.309 10 10 CECE CNc1ccc(C(=O)N(C)Cc2ccccc2O)nc1 1294680685 ZKADNMQMWYYBAN-UHFFFAOYSA-N 271.320 2.101 10 10 CECE O=C(O)[C@H]1CCN(Cc2ccc(F)cc2O)C12CCC2 1875519330 HXCSDRYAGABUHG-GFCCVEGCSA-N 279.311 2.361 10 10 CECE Cc1ccc(O)c(CN2CCN3C[C@@H](C)C[C@H]3C2)c1 1876167966 JYDGZGBZICOXLQ-ZFWWWQNUSA-N 260.381 2.227 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@]2(C)CCCO2)cc1O 1876701536 YAJXPBMRCBXKJS-ABAIWWIYSA-N 264.369 2.417 10 10 CECE C[C@H](NC(=O)[C@@H]1CCC[C@]1(C)N)c1ccccc1O 1877588026 HTGNOETXDJKUED-WBIUFABUSA-N 262.353 2.087 10 10 CECE COC(=O)[C@@H](C1CC1)N(C)[C@@H](C)c1ccccc1O 1877532288 DFZAIDIBUWBWGT-IINYFYTJSA-N 263.337 2.337 10 10 CECE CC1(C)C[C@H](C(=O)O)N(Cc2ccc(F)cc2O)C1 1964727857 MSIFVGCLICHQIZ-LLVKDONJSA-N 267.300 2.216 10 10 CECE CCN(C(=O)[C@]12CCOC[C@H]1C2)c1ccc(N)cc1 1879997980 CTHOIUNFVIMWTB-ABAIWWIYSA-N 260.337 2.048 10 10 CECE CC[C@]1(O)CCN(c2c(F)cc([C@@H](C)O)cc2F)C1 1880479804 QFGRIDBZZVEFNH-OTYXRUKQSA-N 271.307 2.369 10 10 CECE CCOc1cccc(CN2CCC[C@@H]3NCC[C@@H]32)c1O 2143699932 IKCVTCHKAZXFOV-KBPBESRZSA-N 276.380 2.117 10 10 CECE Oc1cccc(F)c1CNCCCCn1ccnc1 1964555163 MLSVJMWCUWJSCQ-UHFFFAOYSA-N 263.316 2.298 10 10 CECE CN[C@H](c1cscn1)[C@H](O)c1ccc2c(c1)CCN2C 2147883252 LWEPLUMFOVXTRI-HUUCEWRRSA-N 289.404 2.130 10 10 CECE CCOC(=O)CCCCN(C)c1ccc(CN)cc1 1967633829 CQYJKOIMMAARMR-UHFFFAOYSA-N 264.369 2.315 10 10 CECE CO[C@@H](CNCc1cc(C)ccc1O)[C@@H]1CCCOC1 1967744805 BNYDSDYMCJDVEE-CJNGLKHVSA-N 279.380 2.232 10 10 CECE CCn1cc(CN(C)[C@@H](C)c2ccccc2O)nn1 1968789652 KBYNSPBZHJBWIG-NSHDSACASA-N 260.341 2.197 10 10 CECE NCc1ccc(N2CCO[C@H](C3CC3)CC2)c(F)c1F 2144823685 VWNBICLMSGYCKT-ZDUSSCGKSA-N 282.334 2.429 10 10 CECE CC1(C)CCN(c2ccc(CO)cc2[N+](=O)[O-])CCO1 1973408496 RMDZINVAXBTQMT-UHFFFAOYSA-N 280.324 2.092 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1C[C@]12CCOC2 1974201008 GZXQTKFZQFPOPK-RISCZKNCSA-N 251.301 2.048 10 10 CECE O=C(O)c1cnc(CNCc2ccc3c(c2)CCO3)s1 1974380338 IBBVAKVFDUFEQM-UHFFFAOYSA-N 290.344 2.066 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@@H]2C(N)=O)cc1Cl 2145614640 RJAIVXLZWZQHCF-IINYFYTJSA-N 295.814 2.465 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(CC)cc(F)c1O 260703076 ZAMXDPIILMSOGC-GFCCVEGCSA-N 269.316 2.437 10 10 CECE CCC[C@@H]1CCN(CC(=O)N(C)c2ccc(N)cc2)C1 158701534 WQVOUDYASWECFO-CYBMUJFWSA-N 275.396 2.354 10 10 CECE C[C@@]12CCC[C@@H]1C(=O)N2CCCOc1ccc(N)cc1 2146793674 DLBOEUVNKZENNR-GDBMZVCRSA-N 274.364 2.439 10 10 CECE CCCN(C[C@@H](O)COc1ccc(N)cc1)C(C)C 37095521 UQXNPGKJTCOKGC-CQSZACIVSA-N 266.385 2.129 10 10 CECE CC[C@H](O)CN(CC)c1ccc(CN)cc1Cl 1999391383 VRDCZOCOMKQMNW-NSHDSACASA-N 256.777 2.396 10 10 CECE Oc1c(F)cccc1CNCc1cccc2nccn12 2151743357 CWEZBLBDEDKXCI-UHFFFAOYSA-N 271.295 2.469 10 10 CECE C[C@H]1CCO[C@H]1COCCC(=O)Nc1ccc(N)cc1 2152440395 MSWMGIFXLOHHQV-FZMZJTMJSA-N 278.352 2.039 10 10 CECE CN1CCc2cc([C@H](O)[C@@H](N)C3CC(C)(C)C3)ccc21 2153867858 OJTHUYNPGFDCNZ-HOTGVXAUSA-N 274.408 2.476 10 10 CECE CCOC(=O)C1=NN(c2ccc(Cl)c(F)c2)C(=O)[C@@H]1C 2154699125 QKEFBBDKIWDXNF-SSDOTTSWSA-N 298.701 2.381 10 10 CECE CN1CCc2cc(CN[C@@H]3CCC[C@H](O)C3)ccc21 50286649 BEUYWJCBFQAGIE-CABCVRRESA-N 260.381 2.072 10 10 CECE C[C@@H]1CCN(C(=O)COc2ccc(N)cc2)[C@H](C)C1 51728938 ARZFOWMDQSGZSM-VXGBXAGGSA-N 262.353 2.295 10 10 CECE CCCNC(=O)CN(C)Cc1ccc(Cl)cc1O 2029640970 IDIVUUOEQZOTAZ-UHFFFAOYSA-N 270.760 2.004 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)[C@@H]1CCCSC1 2031153324 JOERIPPQAJTCRR-LERXQTSPSA-N 267.394 2.157 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)C[C@@H](OC)C1(C)C 2156421778 WYFJFSCIEFOZLE-IIAWOOMASA-N 279.380 2.219 10 10 CECE COc1sccc1S(=O)(=O)Nc1ccc(O)cc1 2034635053 AOOVXXSIGCQVDR-UHFFFAOYSA-N 285.346 2.263 10 10 CECE CC[C@]1(C)CN(c2ccc(CN)c(F)c2)CCO1 2035251980 KZLPFSKAQRVXKY-CQSZACIVSA-N 252.333 2.290 10 10 CECE COCCO[C@@H]1CCN([C@H](C)c2cc(F)ccc2O)C1 2158827449 DOCIOUOYGIVUNT-DGCLKSJQSA-N 283.343 2.330 10 10 CECE CCN(c1ccc([C@H](C)NC)c(O)c1)[C@H](C)CN(C)C 300152318 FJMSXUSDDCVLOJ-OLZOCXBDSA-N 279.428 2.449 10 10 CECE COCCSCC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2038009349 IOKBKEYABBFZNZ-SNVBAGLBSA-N 272.374 2.057 10 10 CECE C[C@@]1(CO)CC(F)(F)CN1c1c(F)cc(CN)cc1F 2159047446 UNXRYEYVUXBVLM-LBPRGKRZSA-N 292.276 2.020 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CC[C@@H]4CC[C@]43C)cc21 2157281919 AXYZRAINRXMVBO-DRZCJDIDSA-N 272.348 2.075 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CO[C@H](C)C2)c(F)c1 401589466 VTIJFWPRQDXPHJ-SCVCMEIPSA-N 252.333 2.459 10 10 CECE Cc1cc(CN(C)c2ccc3c(c2)NC(=O)[C@H]3N)sn1 404513513 QVDOHAOIUYLJRZ-ZDUSSCGKSA-N 288.376 2.040 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])C1(SC)CCC1 310805881 ZSNZNCOVYUCLKM-VIFPVBQESA-N 272.374 2.104 10 10 CECE CO[C@@H](COC(=O)Nc1ccc(N)cc1)C(C)C 310879768 RIARDMBHBLXAKU-LBPRGKRZSA-N 252.314 2.488 10 10 CECE Cc1ccnc(C)c1NC(=O)c1ccc(O)c(O)c1 311385021 WJDKTQWHZOEKEG-UHFFFAOYSA-N 258.277 2.362 10 10 CECE CC1(C)C[C@H](CNCc2cc3c(cc2O)OCO3)CO1 2159382527 RMIMXDWKHXGOIY-SNVBAGLBSA-N 279.336 2.026 10 10 CECE COc1cccc(CN[C@H]2C[C@H](n3cccn3)C2)c1O 2159862347 WIVINOWQKXZXSA-JOCQHMNTSA-N 273.336 2.091 10 10 CECE NC(=O)c1ccc(CNCc2ccc(Cl)cc2O)cc1 2160457012 WVGJBXHXTHJBQQ-UHFFFAOYSA-N 290.750 2.434 10 10 CECE Oc1cccc(F)c1CN1CCCC[C@@H](C2CNC2)C1 2160780627 WECYVCKZZKWZHS-GFCCVEGCSA-N 278.371 2.353 10 10 CECE CCC[C@@H](CC(=O)NCCN=[N+]=[N-])n1ccnc1 701269823 BDJCIKYFCBYBQZ-JTQLQIEISA-N 250.306 2.041 10 10 CECE CN(Cc1cncnc1)c1ccc(CNC2CC2)cc1 2178813780 QPGTWJFQIKTYFU-UHFFFAOYSA-N 268.364 2.365 10 10 CECE C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCCCN=[N+]=[N-] 701318973 KEPVZNPQEFFBRU-JOYOIKCWSA-N 276.296 2.032 10 10 CECE Cc1cccc2nc(C(=O)NCCCCN=[N+]=[N-])cn12 706342833 GSGYRSZHIZVKAW-UHFFFAOYSA-N 272.312 2.463 10 10 CECE COc1ccc(N2CCC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])c1 688998439 HBVGWIQTMJBFNA-WDEREUQCSA-N 280.324 2.201 10 10 CECE COc1ccc(N2CCC[C@@H]2[C@H]2CCCN2C)c(N)c1 2171436333 GGPZUXYVQJBAGL-HZPDHXFCSA-N 275.396 2.340 10 10 CECE COc1ccc(N(CCN(C)C)C(C)C)c(N)c1 688226133 CPJWJUBPRXSRET-UHFFFAOYSA-N 251.374 2.054 10 10 CECE CC[C@H](CO)N(C)c1ccc(CN)cc1C(F)(F)F 379203526 ZJLRBYISWRIURQ-SNVBAGLBSA-N 276.302 2.371 10 10 CECE CC1(C)CC[C@@H](CNCc2ccc(O)c(O)c2)OC1 711250958 ONWSNXKPWFTIEL-LBPRGKRZSA-N 265.353 2.393 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[S@](=O)C[C@@H]1C 2171968023 FPKYBUPGZHHLBW-RBZFPXEDSA-N 292.448 2.204 10 10 CECE CCCN(c1cc2c(cc1N)OCCO2)[C@H]1CCOC1 380837168 WCDGMVMPRSFARA-NSHDSACASA-N 278.352 2.045 10 10 CECE CNC[C@@H]1CCCCN1c1ccc2c(c1)OCCCO2 2162628322 AGFDNQBYBWMANQ-AWEZNQCLSA-N 276.380 2.426 10 10 CECE CNCc1ccc(N2CC[C@](C)(COC)C2)c(C#N)c1 381509377 UPUMJYZPGVGMEK-INIZCTEOSA-N 273.380 2.140 10 10 CECE CCN1CCc2cc([C@]3(O)CCC(C)(C)NC3)ccc21 2163068921 NEJBKIOWASKUCH-KRWDZBQOSA-N 274.408 2.419 10 10 CECE CCN1CCc2cc([C@H](NC)c3ccncn3)ccc21 2163067124 SLGOJQRKLLKCTR-INIZCTEOSA-N 268.364 2.168 10 10 CECE CCCn1cc([C@](C)(O)c2ccc(N(C)C)cc2)nn1 2163077990 YPGYJVSNEMTPTI-OAHLLOKOSA-N 274.368 2.010 10 10 CECE CCN(CC)C1[C@H]2CN(c3ccc([C@@H](C)N)cc3)C[C@H]12 384384814 MAUUEMHWSKWLMI-KCXAZCMYSA-N 273.424 2.483 10 10 CECE C[C@H]1CNC[C@@](O)(c2ccc(N3CCCCC3)cc2)C1 2163104891 HCOSVOWSAMNLHK-RHSMWYFYSA-N 274.408 2.494 10 10 CECE C[C@H](N(C)c1ccc2c(c1)NC(=O)[C@@H]2N)C1(C)CC1 385525172 WUYKULMHCBZGDF-TVQRCGJNSA-N 259.353 2.263 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(=O)N[C@@H](C)C2)cc1Cl 387237964 JACVDQWJWJDTIO-QWRGUYRKSA-N 295.814 2.335 10 10 CECE CC[C@H]1C[C@@H]1CNC(=O)CCOc1ccc(N)cc1 388245786 SAWSSITVTOVZLB-NWDGAFQWSA-N 262.353 2.200 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2C[C@H]1CCCN1C 395353859 IXWLAHXDMIYEGS-XJKSGUPXSA-N 273.424 2.424 10 10 CECE Cc1ccc(CNCc2cccc(Cl)c2O)nn1 396724325 VCGILLZPTQXWLG-UHFFFAOYSA-N 263.728 2.434 10 10 CECE C[C@H](C[S@@](C)=O)N(C)c1ccc(CN)cc1Cl 399265174 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10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1cccc(OCCN)c1 2189289005 IZWYBRUIKKWFEF-UHFFFAOYSA-N 274.320 2.130 10 10 CECE COc1ccc([C@H](C)N[C@H](C)[C@H](O)C(F)(F)F)c(O)c1 2197316926 OWQXPONIRJBIOU-SXMVTHIZSA-N 293.285 2.363 10 10 CECE CN(C[C@]12COC[C@@H]1C2)c1ccc2c(c1)CCC[C@@H]2N 2184688446 FFQRJBUEJQTMCI-RRQGHBQHSA-N 272.392 2.495 10 10 CECE CCN[C@@H]1CCc2cc(N3CC[S@](=O)[C@H](C)C3)ccc21 2184718684 IGCDAUFTWXJDFG-RRBXVBTKSA-N 292.448 2.241 10 10 CECE N[C@@H]1CCc2cc(N3[C@H](CO)C[C@@H]4CCC[C@H]43)ccc21 2184722477 ZKWCAFPBBIJAQU-GUDXXQAFSA-N 272.392 2.372 10 10 CECE CCOC1(CN[C@@H](C)c2ccc(O)cc2O)CC1 2047788544 IMXJTNYIAQHHPZ-JTQLQIEISA-N 251.326 2.318 10 10 CECE COc1cccc(CN2[C@H]3CC[C@H]2[C@H]2CC[C@H]3O2)c1O 2198705730 UGHYMCLVUDYGMV-IGQOVBAYSA-N 275.348 2.295 10 10 CECE C[C@@H](NCC(F)(F)[C@H]1CCOC1)c1cc(O)ccc1O 2185210851 WXFDONFYMPPAQQ-ZJUUUORDSA-N 287.306 2.420 10 10 CECE C[C@@H]1CC[C@H](CNCc2cccc(O)c2O)OC1 2053735808 NMIYLQZQMASYRK-ZYHUDNBSSA-N 251.326 2.003 10 10 CECE 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Cc1cnc([C@@H](N)c2ccc(N3CCCC3)cc2)[nH]1 2107808377 DVMXHKVXBZEVSM-AWEZNQCLSA-N 256.353 2.366 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H](CC)[C@@H](C)O 2108750463 AYOWYVPYJRXIDB-SKDRFNHKSA-N 266.341 2.017 10 10 CECE CO[C@@H](C)CCOC(=O)CCOc1ccc(N)cc1 2109242613 BQITVIAJNYNVKS-NSHDSACASA-N 267.325 2.006 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2CCCC(=O)N2)c1 2089321076 KOSPOEZALDURGB-RYUDHWBXSA-N 262.353 2.020 10 10 CECE CC1(C)CCc2cc(N3C[C@H]4C(N)[C@@H]4C3)ccc2O1 2110241682 VJTNVAXOXKKKNT-CHWSQXEVSA-N 258.365 2.184 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@H](C)CC[C@H]1CN 2093674621 RRYCKKKFNOETDB-WOPDTQHZSA-N 264.369 2.218 10 10 CECE CNCc1ccc(N2C[C@H](O)CC23CCC3)c(F)c1 2099391163 DWFQJAPWXQJHDE-GFCCVEGCSA-N 264.344 2.039 10 10 CECE CCOC(=O)[C@](C)(NCCCN=[N+]=[N-])c1cncs1 2099549454 NZFWJXXYKNXBMP-LLVKDONJSA-N 283.357 2.211 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(S(=O)(=O)[C@@H]2CC2(F)F)C1 2112527132 BAEYKASELOUMLK-RKDXNWHRSA-N 294.327 2.136 10 10 CECE CNC[C@@H](C)N(C)Cc1ccc(C(F)(F)F)cc1O 2113256819 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2220409853 RXXNNGAPJHRZOO-ZDUSSCGKSA-N 266.410 2.486 10 10 CECE CN[C@H](C)c1ccc(N2CC(CCCO)C2)c(C)c1 2232036185 SNKIJHBJRRTXNC-CYBMUJFWSA-N 262.397 2.484 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](F)[C@@H](CO)C2)c(C)c1 2232104787 OWSUYSXDDXHBLD-BNOWGMLFSA-N 266.360 2.042 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCC[C@](F)(CO)C1 2232101601 ZPWUCOUDDPAEIH-IUODEOHRSA-N 267.344 2.349 10 10 CECE COc1cc(F)c(N)cc1C(=O)Nc1ccc(N)cc1 2233958887 LNPAMJAXZNMMRT-UHFFFAOYSA-N 275.283 2.251 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[S@](=O)[C@@H](C)C1 2223977220 HWQKDEYXRCJKIL-PZROIBLQSA-N 267.394 2.006 10 10 CECE Cc1cc([C@H](C)N)ccc1N(CCO)CC(F)F 2223976522 BFYKGPDVMHEISH-JTQLQIEISA-N 258.312 2.079 10 10 CECE O=C(N[C@@H]1CC[C@H]1C(F)(F)F)c1ccc(O)c(O)c1 2224400065 SOYDSNNDSHAAGN-HTQZYQBOSA-N 275.226 2.169 10 10 CECE NC(=O)c1cnc(Sc2cc(C(=O)O)ccc2F)s1 2225539933 MUNXCVINYZPTMB-UHFFFAOYSA-N 298.320 2.231 10 10 CECE C[C@@H](CC(=O)O)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2225792783 PZXFWTCOYPRWJJ-ZJUUUORDSA-N 268.317 2.036 10 10 CECE CCn1nc(C)cc1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2225797729 GTMQCVVNXRWIRX-VHSXEESVSA-N 262.317 2.173 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1 2225801134 UDPVUKCMGKEFOM-QWRGUYRKSA-N 284.316 2.335 10 10 CECE COc1ccc(N2CCCO[C@@H]3CCC[C@@H]32)c(CN)c1 2235963853 PONAUCCIUIDTTH-JKSUJKDBSA-N 276.380 2.302 10 10 CECE COc1ccc(N(C)[C@@H]2COC[C@@H]2C)c(C[C@H](C)N)c1 2235975649 WSYWSMPMIBLNDR-MQIPJXDCSA-N 278.396 2.056 10 10 CECE CCNCc1cc(OC)ccc1N1CCC[C@]1(C)CO 2235969026 YNTVQSIOLRRULR-MRXNPFEDSA-N 278.396 2.156 10 10 CECE COc1ccc(N2CCC[C@@H](OC)C2)c(C[C@@H](C)N)c1 2235968368 QVJRXGSXUBYXJO-IUODEOHRSA-N 278.396 2.200 10 10 CECE COC[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1(C)C 2236687667 TVEPJZPKMUIKCW-CYBMUJFWSA-N 276.380 2.085 10 10 CECE COc1ccc(N2CCC[C@@H](OC)C2)c(C(=O)O)c1 2227678135 RMOKPBNIZOQOCZ-LLVKDONJSA-N 265.309 2.009 10 10 CECE CNCc1cc(OC)ccc1N1C[C@H](C)OC[C@@H]1C 2227676101 QMWYUAVEGLNMBQ-RYUDHWBXSA-N 264.369 2.028 10 10 CECE COc1ccc(N2CCO[C@H]3CCC[C@@H]32)c(C=O)c1 2227700012 UBHYEYBBBDLTGK-GJZGRUSLSA-N 261.321 2.265 10 10 CECE C[C@H]1CN(c2ccc(C=CC(=O)O)cc2)[C@@H](C)CN1C 2238056835 HKBRSCGMEMTOFW-STQMWFEESA-N 274.364 2.313 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@@H]1OC(=O)NC1(C)C 2239244977 XFDLGZQYWKZNNZ-MFKMUULPSA-N 278.352 2.272 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C[C@H]1CCCS1(=O)=O 2240747714 UDRPNNWTJVMGAY-GXTWGEPZSA-N 296.436 2.028 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CC(=O)N1CCCC1 2240829222 GVWHOAFLZNQEFZ-CYBMUJFWSA-N 276.380 2.107 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2COC[C@@H]2OC)c(C)c1 2240837462 ODEHIOAXVDBQJO-WQVCFCJDSA-N 278.396 2.125 10 10 CECE COc1ccc(N(C)CC(=O)NCc2ccccc2)cc1 2241222316 UCNIJSMSZFCHSS-UHFFFAOYSA-N 284.359 2.448 10 10 CECE C[C@H](O)CN(c1ccc(CN)cc1F)C1CCC1 2259719568 ORHSJPSIXAYSCX-JTQLQIEISA-N 252.333 2.024 10 10 CECE NC[C@]12C[C@H]1CN(Cc1cc(Cl)cc(Cl)c1O)C2 2259913003 JDYMPGIBJOTNBM-ZANVPECISA-N 287.190 2.480 10 10 CECE O=C(O)[C@@H]1C[C@@H]2[C@H]1CCN2Cc1cc(Cl)ccc1O 2270851762 XYHFPBOUXPBNFQ-QJPTWQEYSA-N 281.739 2.341 10 10 CECE CN(Cc1cccnc1O)c1ccc(CN)cc1F 2272883872 FGSSPMGIAPDOMN-UHFFFAOYSA-N 261.300 2.021 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1ccc2c(c1)CCC[C@@H]2O 2273214787 YYCMXXGHDSEZDZ-JYJNAYRXSA-N 261.365 2.406 10 10 CECE COc1cc(Cl)cc(CNCC[C@@H]2CCO2)c1O 2264022317 XMZGLUKZXDFRFC-LLVKDONJSA-N 271.744 2.323 10 10 CECE CN(Cc1cc(F)cc(F)c1O)[C@@H]1CNCC1(C)C 2274206017 GPTAEIGOUGCFDB-GFCCVEGCSA-N 270.323 2.100 10 10 CECE COc1ccc(N2C[C@@H](N)CC2(C)C)c(OC)c1C 2278015176 BPXLCUMHANWCTJ-NSHDSACASA-N 264.369 2.328 10 10 CECE COc1ccc(N2CCN[C@@H](C)CC2)c2c1CCC2 2269110417 OHCKFBMSALXJRU-LBPRGKRZSA-N 260.381 2.372 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H]3C2(C)C)c(CCN)c1 2269274410 XQIKVTDMPZUKJJ-JSGCOSHPSA-N 260.381 2.431 10 10 CECE Cc1cc(N2CC(C[C@H](C)CO)C2)ccc1[C@H](C)N 2269663180 WDCPQPRPHJHAAV-AAEUAGOBSA-N 262.397 2.469 10 10 CECE Cc1cc(N2CCc3cccnc3C2)ccc1CCN 2290257556 ZHEASNRZDHPOTO-UHFFFAOYSA-N 267.376 2.454 10 10 CECE COCCNCc1ccc(N(C)CC2COC2)c(Cl)c1 2285279969 ULULKSFSSGWKMB-UHFFFAOYSA-N 298.814 2.159 10 10 CECE C[C@H](CNCc1cc(F)ccc1O)Cc1cnn(C)c1 2295454089 RPOIVEPHVLXKJP-NSHDSACASA-N 277.343 2.233 10 10 CECE CN(Cc1ccc(N2CCNCC2)cc1)CC1(Cl)CC1 2286065948 OFZVXWMGIUVOQF-UHFFFAOYSA-N 293.842 2.299 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)C3(C)O)c(C)c1 2286205974 VOEAGHIXBVHTBP-NTIGPLPUSA-N 274.408 2.483 10 10 CECE O=C1CC(=Cc2ccc(O)c(O)c2)C(=O)N1c1ccccc1 2296604976 RLUHQBYYAFIGIW-UHFFFAOYSA-N 295.294 2.445 10 10 CECE Cc1cc(C=C2C(=O)N(C)C(=S)N2C)c(C)n1C1CC1 2297454207 JXIHJHXQVDFVFD-UHFFFAOYSA-N 289.404 2.469 10 10 CECE Cc1ccn2c(C=C3SC(=S)NC3=O)cnc2c1 2297664632 XZAOVGFELOJEJZ-UHFFFAOYSA-N 275.358 2.132 10 10 CECE Cc1cccc(CNc2ncccc2S(C)(=O)=O)c1O 1160768806 ATSYRNXTDGZTNJ-UHFFFAOYSA-N 292.360 2.111 10 10 CECE CCS(=O)(=O)N(C)Nc1nc2ccc(C)cc2s1 2317459234 WEFMTIPAIPGBRT-UHFFFAOYSA-N 285.394 2.213 10 10 CECE CCN1CC(NCc2ccc(C)c(Br)c2O)C1 2307569147 DJFPCYZLDBFBLO-UHFFFAOYSA-N 299.212 2.257 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CC(C)(C)[C@H]1C 2318265279 SBOZBYCDDFHLCA-BXKDBHETSA-N 254.334 2.254 10 10 CECE CN(c1ccc(OC(F)F)cc1)[C@H]1CNC[C@@H]1F 2320538450 AMSUWEAGURZJNK-QWRGUYRKSA-N 260.259 2.034 10 10 CECE C[C@@H]1[C@H](O)CCN(c2ccc(CN)cc2Cl)[C@@H]1C 2321333453 XOKXJCRBHIBUQV-IMSIIYSGSA-N 268.788 2.394 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1C[C@@H]2C[C@H]1[C@H]1C[C@@H]21 2330319335 JFAQZPMHBIAUBZ-RQVFLQHESA-N 258.321 2.423 10 10 CECE O=C(O)[C@H]1C[C@@H]2CN(Cc3cc(Cl)ccc3O)C[C@@H]21 2330521422 QOLOROHFPLGWCI-ZHAHWJHGSA-N 281.739 2.198 10 10 CECE OC[C@H]1[C@@H]2C[C@@H]2CN1c1ccc(OC2CCC2)cc1 2333674564 HFDCTMCGFYAJPJ-LYRGGWFBSA-N 259.349 2.435 10 10 CECE COc1cc(OC)c(N2C[C@@H]3CC[C@H]2[C@H]3N)cc1Cl 2334514347 YNAXYCMOPROMFZ-BXGCZWRVSA-N 282.771 2.283 10 10 CECE CCOc1ccc(COc2cc(F)cnc2N)cn1 2337928694 DPGCJWCQLGGWBR-UHFFFAOYSA-N 263.272 2.176 10 10 CECE Nc1ccc(CNCc2ccn(C(F)(F)F)n2)cc1 2340623182 RXLSQEXPZLSWHI-UHFFFAOYSA-N 270.258 2.231 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@H](O)C23CCC3)c1C 2340862398 VGGUMJRXXMHDFM-WFASDCNBSA-N 260.381 2.427 10 10 CECE 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2.253 10 10 CECE COc1ccc(CN(C)CCc2ccncc2)c(O)c1 183753217 AOKRBCRAXHCSRP-UHFFFAOYSA-N 272.348 2.470 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]([C@H](C)O)C2)c(F)c1 226456718 HOOKDTWYBRIVGO-NHCYSSNCSA-N 252.333 2.053 10 10 CECE CCCNCc1ccc(N2CCC[S@@](=O)CC2)cc1 321935812 WBOYLMVALGWINU-LJQANCHMSA-N 280.437 2.145 10 10 CECE CC(C)(C)NCc1ccc(N2CCCNC(=O)C2)c(F)c1 87885199 OZNHSPCIOYTWAF-UHFFFAOYSA-N 293.386 2.040 10 10 CECE N[C@H](Cc1ccc(O)c(O)c1)C(=O)OC1CCCCCC1 40954675 MPJWFZSHSSNBAM-CYBMUJFWSA-N 293.363 2.234 10 10 CECE CC(C)(C)NCc1ccc(N2CCn3cnnc3C2)cc1 81537687 ASEJYZPFEXOWAI-UHFFFAOYSA-N 285.395 2.186 10 10 CECE Cc1nn(C)c2ncc(NCc3cccc(O)c3O)cc12 41117334 NSPAFCOGRIFGTR-UHFFFAOYSA-N 284.319 2.300 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H](C)O)cc1Br 235216811 ZAJHJETUTROAOA-BDAKNGLRSA-N 287.201 2.286 10 10 CECE CC[C@H](N)c1cc(I)ccc1O 95769521 CSKXKALPLNRNPZ-QMMMGPOBSA-N 277.105 2.407 10 10 CECE COc1cc(F)c(Br)c(C(C)(C)N)c1O 258444736 CLVFBXUFYRFARB-UHFFFAOYSA-N 278.121 2.496 10 10 CECE 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Cc1cc(N(C)CCCn2ccnc2)ccc1CCN 2170126723 GFIUTIQCMLFNOA-UHFFFAOYSA-N 272.396 2.219 10 10 CECE CCN(CC)C[C@@H]1CCN(c2ccc(CN)c(F)c2)C1 2170223220 DWIJMNLFOUQYSX-ZDUSSCGKSA-N 279.403 2.453 10 10 CECE Nc1ccc(CS(=O)(=O)N2CCCC3(CCC3)C2)cc1 2171026800 NQWPOLBSXXQSGV-UHFFFAOYSA-N 294.420 2.365 10 10 CECE Cc1ccc(Cn2nc(CN)cc2C(F)(F)F)c(O)c1 2079176230 GNCUPCCOBLFFKX-UHFFFAOYSA-N 285.269 2.423 10 10 CECE CN1CCC[C@H]1[C@@H]1CCCN1Cc1cc(N)ccc1O 2171433670 IBLYPTRPTSCHHV-GJZGRUSLSA-N 275.396 2.033 10 10 CECE CC(C)[C@@H]1CNC(=O)CN1c1ccc([C@@H](C)N)cc1Cl 2181163484 SNTLQXYTJLTBQQ-YGRLFVJLSA-N 295.814 2.321 10 10 CECE CCC(=O)N1CCN(c2ccc([C@H](C)NC)cc2)CC1 2182602353 PKZIWIGONHGVIK-ZDUSSCGKSA-N 275.396 2.026 10 10 CECE CN(C)c1ccc([C@H]2O[N@@]2[C@H]2CC[C@H](O)CC2)cc1 2084584565 XKCSOGROYPJLOO-ANQUJSFKSA-N 262.353 2.302 10 10 CECE C[C@H](N(C)c1cc2c(cc1F)[C@@H](O)C(=O)N2)C(C)(F)F 2178861524 SNJSPKPYMLEKOZ-UPONEAKYSA-N 288.269 2.291 10 10 CECE NN[C@@H](c1ccccc1O)c1ccccc1OCCF 2189519283 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2.128 10 10 CECE Cc1cc(NC(=O)COc2ccc(N)cc2)sn1 2041917509 WXPDMGVHGBBYTA-UHFFFAOYSA-N 263.322 2.051 10 10 CECE Oc1cccc(F)c1CN[C@@H]1CCO[C@H]1C1CC1 2042629779 YZQFNFZIPXQSQR-OCCSQVGLSA-N 251.301 2.188 10 10 CECE COc1ccc(O)c(CN(C)C[C@H]2CCCCN2C)c1 2186169452 RUEOUBVXTSEHBP-CQSZACIVSA-N 278.396 2.317 10 10 CECE CCNCc1ccc(N2C[C@H]3CC[C@]3(CO)C2)c(C)c1 2198882385 SPAVOLNZUPTJTI-NVXWUHKLSA-N 274.408 2.313 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@]3(O)C2)c(Cl)c1 2051365287 FAAWMBLFKKXRMG-UDZFHETQSA-N 267.756 2.354 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)CC(F)(F)C(F)F)CC1 2054028447 DOYBHCIVKMBOFF-UHFFFAOYSA-N 268.214 2.484 10 10 CECE CNCc1ccc(N2CCC[C@@H](C3(O)CC3)C2)c(C)c1 2187040816 YLPJXKNYBMEPJN-OAHLLOKOSA-N 274.408 2.456 10 10 CECE COc1ccc(N(C)C[C@H]2CCO[C@H]2C)c(N)c1 2057468868 NGZWSUVPOPORTD-WDEREUQCSA-N 250.342 2.139 10 10 CECE Cc1cccc(CNCc2ccc3nn[nH]c3c2)c1O 2187363098 HXWHPXSYJSRNBZ-UHFFFAOYSA-N 268.320 2.262 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cnc(C(N)=S)cn1 2192565525 AOVKWPUZDGBZCY-SECBINFHSA-N 288.376 2.014 10 10 CECE C[C@H](NC(=O)C[C@H](CN)C(F)(F)F)c1ccccc1O 2192628443 YNCLBFMIYGPIFR-DTWKUNHWSA-N 290.285 2.097 10 10 CECE COC[C@H](C)CNC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2192640951 GUNUTBMBCZJYHF-NEPJUHHUSA-N 283.376 2.391 10 10 CECE C[C@H](NC(=O)C[C@H](CN)C1CCC1)c1ccccc1O 2192630402 ZTYRWHVEFRCWFK-WCQYABFASA-N 276.380 2.335 10 10 CECE COC(=O)c1cc[nH]c1CN[C@H](C)c1ccccc1O 2192622731 BMNGSIMOBBULND-SNVBAGLBSA-N 274.320 2.358 10 10 CECE Cc1cc(N(C)[C@@H]2CCOC[C@H]2F)ccc1CN 2066651524 GEXQHPOEKRAWSJ-ZIAGYGMSSA-N 252.333 2.017 10 10 CECE COC[C@@H]1C[C@@H]1CN[C@H](C)c1ccc(F)cc1O 2069649860 KKZHJHPWCHVOIC-MXWKQRLJSA-N 253.317 2.464 10 10 CECE COC[C@@]12C[C@H]1CN(c1ccc([C@H](C)N)cc1F)C2 2109177872 RLLXBCJBOGYQLY-WBIUFABUSA-N 264.344 2.318 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1cccc2c1CNCC2 2189291765 ZIRSLQBQTHOUMZ-UHFFFAOYSA-N 270.332 2.438 10 10 CECE C[C@@H]1SCCC[C@@H]1N(C)C(=O)COc1ccc(N)cc1 2197309577 QKVMUOLPGOJARI-FZMZJTMJSA-N 294.420 2.390 10 10 CECE CC[C@H](C)[C@H](CO)N[C@@H](C)c1c(O)cccc1O 2081329561 QYUGEMPWAHZWHO-DCAQKATOSA-N 253.342 2.155 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2ncon2)c(F)c1 2104161420 NDOPNGKVARIGGW-VIFPVBQESA-N 264.304 2.126 10 10 CECE CC1(C)C[C@@H](N)CN(Cc2ccc(F)cc2O)C1 2084069549 CCLXOAVAYACBJU-GFCCVEGCSA-N 252.333 2.091 10 10 CECE CCc1nc(C(=O)N(C)Cc2ccc(N)cc2)co1 2104318228 GPVZJLTUUQLONZ-UHFFFAOYSA-N 259.309 2.091 10 10 CECE CC(C)(CNCc1c(O)cccc1F)n1ccnc1 2104470748 FPGKXSHTWXFHDI-UHFFFAOYSA-N 263.316 2.253 10 10 CECE COc1cccc(O)c1CN(C)[C@H]1CCC[C@@H]1OC 2104441921 DIADMEUOBGHULO-WFASDCNBSA-N 265.353 2.400 10 10 CECE C[C@H]1C[C@]1(F)CN(C)C(=O)Cc1ccc(N)cc1 2085434146 AMQNPQYOHZUUAF-HZMBPMFUSA-N 250.317 2.018 10 10 CECE C[C@@H]1Cc2cc(N3CC4(CCCNC4)C3)ccc2O1 2106390507 YNFNEXDYJRQQGB-GFCCVEGCSA-N 258.365 2.200 10 10 CECE COc1ccc(N2C[C@H](N)C3(CCC3)C2)c(OC)c1 2106388595 MPLPYHQZAKNQIP-AWEZNQCLSA-N 262.353 2.021 10 10 CECE CN(C)c1ccc([C@H](N)C23CCN(CC2)CC3)cc1 2106797279 YYDRDJZLXVAUGU-HNNXBMFYSA-N 259.397 2.238 10 10 CECE CC[C@@H]1NCC[C@@H]1[C@@H](O)c1ccc2c(c1)CCN2C 2106791645 UTFCHMHAJWWTGQ-DZKIICNBSA-N 260.381 2.100 10 10 CECE CN1CCCc2cc([C@](C)(N)[C@@H]3CCOC3)ccc21 2106820080 GTOCVVVJHGTULS-ZBFHGGJFSA-N 260.381 2.279 10 10 CECE CCN1CCc2cc([C@@](O)(CN)C(C)(C)C)ccc21 2106800704 KEISOBHHZZQUDN-INIZCTEOSA-N 262.397 2.261 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CC[C@H](N)C3)ccc21 2106829584 XXFBRQVCAQWEIR-YCPHGPKFSA-N 260.381 2.230 10 10 CECE COc1cc2c(cc1OC)N(C[C@H](O)C(C)C)CC2 2087112190 UFEGEJSPEBCKCZ-ZDUSSCGKSA-N 265.353 2.083 10 10 CECE CCC[C@@H](CN)[C@@H](N)c1ccc2c(c1)CCCN2C 2107813287 UYCJABLFERXHMQ-HOCLYGCPSA-N 261.413 2.444 10 10 CECE C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1NC(=O)c1ccc(O)c(O)c1 2088190463 XTSPQKQDZBGCPV-HKWIRBFKSA-N 261.321 2.262 10 10 CECE O=S(=O)(C[C@H]1C[C@H]1C(F)(F)F)Nc1ccc(O)cc1 2108369067 MGAALEJXRDQYMA-GMSGAONNSA-N 295.282 2.332 10 10 CECE Nc1ccc(OCCN2C(=O)[C@H]3CCC[C@H]2C3)cc1 2089623989 VTVMEPCXICOGHY-AAEUAGOBSA-N 260.337 2.049 10 10 CECE CC(C)NCc1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1 2090120798 BVZIDVHROGRHFR-ZBFHGGJFSA-N 260.381 2.003 10 10 CECE CCOC(=O)C[C@@H](O)c1ccc2c(c1)CCCN2C 2110641876 PGQJKIKOMGTBKI-CQSZACIVSA-N 263.337 2.056 10 10 CECE CC(C)(C)n1nccc1[C@@H](O)Cc1ccc(N)cc1 2090779727 OMGKWLSMONWCII-AWEZNQCLSA-N 259.353 2.496 10 10 CECE Cc1ncsc1[C@@H](N)[C@H](O)c1ccc(N(C)C)cc1 2091570373 YNUHMCMHEWRHAF-QWHCGFSZSA-N 277.393 2.251 10 10 CECE O=C(O)CC[C@H]1CCN(c2ccc3c(c2)OCO3)C1 107943995 UZPQXSTYYAUYGX-JTQLQIEISA-N 263.293 2.106 10 10 CECE CC[C@H](COC)CC(=O)N(C)Cc1ccc(N)cc1 2096046294 DDDYNFUPRWAUAG-LBPRGKRZSA-N 264.369 2.290 10 10 CECE CN(Cc1cncn1C1CC1)c1ccc(CN)cc1 2096691893 JSMJBEVDFAZLPO-UHFFFAOYSA-N 256.353 2.313 10 10 CECE NCc1ccc(N2CCCO[C@H]3CCC[C@@H]32)cc1F 2113806269 BHEQMPCMZLSDPW-GJZGRUSLSA-N 264.344 2.432 10 10 CECE Cc1cccc(O)c1CN1CC(F)(F)C[C@H]1CC(=O)O 2200619887 JJZWLTNMIWNRJP-SNVBAGLBSA-N 285.290 2.385 10 10 CECE OC[C@H]1[C@H]2C[C@H]1N(c1ccc(CNC3CC3)c(Cl)c1)C2 2203131631 OSQFPXPHDXAWRN-HZUKXOBISA-N 292.810 2.409 10 10 CECE CNCc1ccc(N2CC[C@@](C)(CCO)C2)cc1OC 2204544948 IQHRUBMYOCWYCZ-INIZCTEOSA-N 278.396 2.013 10 10 CECE CNCc1ccc(N2CCC[C@H](OC)[C@H]2C)cc1OC 2204544847 HTCVSEVAUHVZTH-DOMZBBRYSA-N 278.396 2.418 10 10 CECE COc1cc(N(C)C[C@@H]2COC(C)(C)C2)ccc1CN 2204559576 QOJBUWBFICRCAN-GFCCVEGCSA-N 278.396 2.405 10 10 CECE CCCN(Cc1ccc(C)cc1O)[C@@H]1CCCNC1=O 2204666679 MGRLTWYDKFNOKS-CQSZACIVSA-N 276.380 2.191 10 10 CECE [N-]=[N+]=NCCCNC1(C(=O)O)CC2(C[C@@H]2C(F)(F)F)C1 2205156960 BXJHSPQYTFZTDX-WFRXLMHJSA-N 292.261 2.462 10 10 CECE C[C@@]1(CCO)CCN1c1ccc(CNC2CC2)cc1F 2205514525 IQDFYSGXPHSOTH-INIZCTEOSA-N 278.371 2.429 10 10 CECE C[C@@H]1C[C@@H]2CN(CCC(=O)Nc3ccc(N)cc3)C[C@H]21 2206414386 HTHGLIPBIHJNLP-JMSVASOKSA-N 273.380 2.185 10 10 CECE Cc1cccc(CNC(=O)[C@@](C)(N)CC(C)C)c1O 2270007925 HDEINFOWXBJQMM-HNNXBMFYSA-N 264.369 2.080 10 10 CECE Oc1cccc(F)c1CNCC1(Cl)CCOCC1 2208878057 FXPQASSSRSGVCA-UHFFFAOYSA-N 273.735 2.409 10 10 CECE COc1ccc(N2CC[C@](O)(C(C)C)C2)cc1F 2219611925 GYMIGNJDKDIKLB-CQSZACIVSA-N 253.317 2.432 10 10 CECE COc1ccc(N2CCC(CF)CC2)c(CN)c1 2220414344 JOEXQOVRXVWFLY-UHFFFAOYSA-N 252.333 2.340 10 10 CECE COc1ccc(N(C)CC2(F)CC2)c(CCN)c1 2220419162 IZCFQYHUQHJZGS-UHFFFAOYSA-N 252.333 2.135 10 10 CECE CO[C@]12CC[C@@H]1CN(CCCc1ccc(N)cc1)C2 2230480222 CSVBJQHSTQXBNM-ZBFHGGJFSA-N 260.381 2.312 10 10 CECE Nc1ccc(CN2C[C@@H]3CCCC[C@@]3(CO)C2)cc1 2230623935 INHZAUACKKCEKR-HOCLYGCPSA-N 260.381 2.253 10 10 CECE CN[C@H](C)c1ccc(N(C)CC2(CO)CC2)c(C)c1 2232032194 YDILDBMBGOJLQL-CYBMUJFWSA-N 262.397 2.484 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[C@@H]2[C@@H](CO)[C@@H]2C1 2232106326 KLBJJCMDLHTPAG-SPWCGHHHSA-N 261.365 2.113 10 10 CECE Cc1ccc(O)c([C@@H](C)NC[C@H](C2CC2)S(C)(=O)=O)c1 2232823678 PDVMHRPQAGIYAO-IAQYHMDHSA-N 297.420 2.174 10 10 CECE COc1ccc(N2CC[C@@H](OCCN)C2)cc1C(C)C 2233149011 GXMFCXKEBSGQFH-CQSZACIVSA-N 278.396 2.373 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C[C@H](CC(=O)O)C2CC2)CC1 2234171282 KSVYKPPGWZIXJO-SNVBAGLBSA-N 280.328 2.084 10 10 CECE CNCc1cc(OC)ccc1N(C)Cc1ocnc1C 2235956339 XYKMMXHUPAUCCB-UHFFFAOYSA-N 275.352 2.347 10 10 CECE COc1ccc(N2CCOC[C@@H]2C(C)(C)C)c(CO)c1 2236002206 LSMJZRRFNPTZCJ-OAHLLOKOSA-N 279.380 2.439 10 10 CECE COc1ccc(N2CC[C@@H]3OCCC[C@@H]3C2)c(CO)c1 2236002638 NNOGYFSAJNAYEW-WBMJQRKESA-N 277.364 2.193 10 10 CECE C[C@@H]1C[C@@H]1CCN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 2236507947 ITEUJUSKGWEILD-JRPNMDOOSA-N 273.380 2.145 10 10 CECE COC[C@@H]1CCN(c2ccc(OC)cc2CN)C1(C)C 2236690628 FKSVLACDEZVOML-ZDUSSCGKSA-N 278.396 2.405 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@@H](CO)C2)c(F)c1F 2226934074 KSXQINVGOMYKGD-NXEZZACHSA-N 271.307 2.428 10 10 CECE CN[C@@H]1[C@H](Oc2ccc(N(C)C)cc2)COCC1(C)C 2237683969 CPPBONHCXBEULB-HUUCEWRRSA-N 278.396 2.144 10 10 CECE COc1ccc(N(C)Cc2ncoc2C)c(CN)c1 2227679979 QFBNVZSRLLTZPN-UHFFFAOYSA-N 261.325 2.087 10 10 CECE CCCOCCSC[C@@H](O)COc1ccc(N)cc1 2229809425 VIRISZCXFFQZKQ-ZDUSSCGKSA-N 285.409 2.168 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1C[C@H]2COC[C@@H]21 2240013235 FMXVEEOFUHJEMK-YOEHRIQHSA-N 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10 10 CECE Cc1cccc(O)c1CN1C[C@H]2[C@@H]3CC[C@@H](O3)[C@H]2C1 1237487274 HLZUMVOYFUMDNH-UPUJQMMVSA-N 259.349 2.310 10 10 CECE CC[C@@H](N)Cc1ccc(N2CC(N(C)CC)C2)cc1C 2169437878 CATLQOCRPJHNOP-OAHLLOKOSA-N 275.440 2.415 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)[C@H]1CCC[C@H]1F 2175592250 HLYIBYKPMKPEGQ-KGLIPLIRSA-N 280.343 2.387 10 10 CECE CN1CCc2cc([C@@H](O)C[C@@](C)(CN)C(F)F)ccc21 2179987347 ALHRVVLHJAGOSG-ZFWWWQNUSA-N 284.350 2.333 10 10 CECE CN(C)C1CCN(Cc2c(O)cccc2F)CC1 1137831722 LDSVVRDYFRQCNS-UHFFFAOYSA-N 252.333 2.057 10 10 CECE COC[C@@H]1C[C@@H](O)[C@H](N(C)[C@@H](C)c2ccccc2O)C1 2192598801 UAPVLNCZFDKUBW-CAVOSLQRSA-N 279.380 2.171 10 10 CECE CC(C)n1ncc([C@H](O)c2ccc(N(C)C)cc2)c1N 2188977173 CISYUUKWSZTRET-CQSZACIVSA-N 274.368 2.194 10 10 CECE O=C1Nc2cc(N3CCC34CC(CF)C4)ccc2[C@@H]1O 2182219353 KFWNNXNXXOANJW-MEXZMNCTSA-N 276.311 2.001 10 10 CECE COc1ccc(CN(C)C[C@@]23CC[C@@H](CO2)C3)c(O)c1 2193340895 VNIKCVGBNJZVSV-WBMJQRKESA-N 277.364 2.402 10 10 CECE 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CC(C)c1noc(CN2CC[C@@H](CN=[N+]=[N-])C2)n1 1912204846 YQMRGOJVWAIBDB-VIFPVBQESA-N 250.306 2.325 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](C(N)=O)C2)c(Cl)c1 109566061 FJSMGPMLXDMSPI-MWLCHTKSSA-N 281.787 2.061 10 10 CECE O=C(NCCOc1cncc(Cl)c1)c1cc(O)cs1 1449386581 PNNIXUNLWNFTDF-UHFFFAOYSA-N 298.751 2.311 10 10 CECE COC(=O)[C@@H](NC(=O)c1cc(O)cs1)c1ccsc1 1448169033 PNWXLPYSSZRQRL-JTQLQIEISA-N 297.357 2.159 10 10 CECE CC(C)[C@H](CN(C)C)NCc1cc(F)ccc1O 226586070 VAQGPSHIHNNIJD-ZDUSSCGKSA-N 254.349 2.207 10 10 CECE C/C(=C/c1cccnc1)C(=O)N(C)c1ccc(C(N)=O)cc1 1534588870 MEKPOFGJQBBKHP-BENRWUELSA-N 295.342 2.247 10 10 CECE CN(C)c1ccc(-c2nc(Cl)c(CO)[nH]2)cc1 214797074 LPZZGAPFXANSFO-UHFFFAOYSA-N 251.717 2.288 10 10 CECE Oc1c(Cl)cccc1CNCCCC1(O)CC1 2249258039 GEEDIOHUQAAEKS-UHFFFAOYSA-N 255.745 2.440 10 10 CECE CC[C@]1(F)CCN([C@H](C)C(=O)Nc2ccc(N)cc2)C1 1925590035 WHAQIFYDSIVZJS-ABAIWWIYSA-N 279.359 2.420 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC[C@@H]3CC[C@@H]32)cc1 1923974606 BSZXNLGIOSWARS-CWRNSKLLSA-N 259.397 2.237 10 10 CECE Cc1ccc([C@H](C)N[C@@H](C)C(=O)NC2CC2)c(O)c1 228950601 KZAWBPVOQKBPLY-QWRGUYRKSA-N 262.353 2.018 10 10 CECE COc1cc(Cl)cc(CN(C)C(C)(C)C(=O)O)c1O 229118535 OLRZHYNYDHRHOM-UHFFFAOYSA-N 287.743 2.349 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H](O)CC3(CC3)C2)cc1 1926414203 OLPVZQWHAJBQRT-LSDHHAIUSA-N 260.381 2.448 10 10 CECE Nc1ccc(CNC(=O)Cc2ccc(F)cc2)cc1 32110531 GRAIEMGGTTVVIL-UHFFFAOYSA-N 258.296 2.267 10 10 CECE O=C(NCc1cccc(O)c1O)c1nc(Cl)cs1 1643812557 KTBVKVRRKWOEPL-UHFFFAOYSA-N 284.724 2.138 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H](C)SC 2299414582 XNXWMNXNAPDWBR-JTQLQIEISA-N 252.383 2.369 10 10 CECE C[C@H](CC(=O)NCc1c(O)cccc1O)C(F)(F)F 1597579605 PFANKPQKZOHPNK-SSDOTTSWSA-N 277.242 2.303 10 10 CECE CCCNCc1ccc(N2CC[C@@H](C(N)=O)C2)c(Cl)c1 233111076 SLLYOIPIHFKPQL-GFCCVEGCSA-N 295.814 2.151 10 10 CECE Oc1cc(F)ccc1CN1[C@H]2CC[C@H]1[C@H]1CC[C@H]2O1 2139804654 OMLOMTROSIVVSY-DDHJSBNISA-N 263.312 2.426 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@](C)(O)C2)c(F)c1 163277941 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CO[C@@H]1CCN(Cc2ccc(F)cc2O)C[C@H]1C 1964598387 UKYSZETTWRKDQT-QMTHXVAHSA-N 253.317 2.388 10 10 CECE C[C@@]1(C(=O)NCCCN=[N+]=[N-])C[C@@H]1C(F)(F)F 1950711791 WIOFFIOAJQNYEC-POYBYMJQSA-N 250.224 2.392 10 10 CECE COC(=O)[C@@](C)(N)C1(c2cccc3c2ccn3C)CC1 1951903515 VNKLWFGHTDZWIS-OAHLLOKOSA-N 272.348 2.100 10 10 CECE OCc1ccc(N2CCOC[C@@H]2CC(F)(F)F)c(F)c1 2150370354 GZPATMKIROXBHC-JTQLQIEISA-N 293.260 2.476 10 10 CECE CN[C@H](c1nccs1)[C@@H](O)c1ccc2c(c1)CCN2C 2148660733 AKZACEDDNPYRNL-KBPBESRZSA-N 289.404 2.130 10 10 CECE C[C@H](N)[C@@H]1CCCCN1[C@H](C)c1ccc(O)cc1O 251565713 TUABCKSLILWYKW-WDMOLILDSA-N 264.369 2.361 10 10 CECE COC[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H]1COC 1967849624 TWJROJNGODCJDA-BETUJISGSA-N 299.798 2.386 10 10 CECE Oc1cc(F)ccc1CNC[C@H]1CC(F)(F)CO1 1967823111 UGAUKCXETOJJME-SNVBAGLBSA-N 261.243 2.045 10 10 CECE CC[C@@H]1[C@H]2CNC[C@H]2CN1Cc1cc(C)ccc1O 251788806 XHVNMKXBJIYBJJ-SOUVJXGZSA-N 260.381 2.130 10 10 CECE CNC(=O)[C@@H](CC(C)C)NCc1ccc(Cl)cc1O 1968979420 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COC1CC(CN(C)Cc2cc(C(C)=O)ccc2O)C1 703338303 WBPZHFAGEBNJHU-UHFFFAOYSA-N 277.364 2.452 10 10 CECE CN1C[C@@H](NCc2ccc(F)c(F)c2O)CC1(C)C 703365789 IRSVRVANBVFUSV-JTQLQIEISA-N 270.323 2.243 10 10 CECE COC[C@@H]1CN([C@@H](C)c2ccc(C)cc2O)CCO1 705845951 UUFIRUQDNRFGRR-STQMWFEESA-N 265.353 2.109 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1cnn(CC)n1 2172442966 PYAHLPXRBGWBHI-OAHLLOKOSA-N 273.384 2.063 10 10 CECE COc1ccc(N(C)C[C@H](N)C2(OC)CCCC2)cc1 2172614622 FVOSSEHFWXTTJC-HNNXBMFYSA-N 278.396 2.418 10 10 CECE COC[C@H](CCN[C@@H]1CCc2cccc(O)c21)OC 710600977 GJDQVOMEHJCDQS-QWHCGFSZSA-N 265.353 2.021 10 10 CECE CCO[C@@H]1C[C@@H]1C(=O)N(C)[C@@H](C)c1ccccc1O 690079526 XLHLIDKBEIOOKP-VHRBIJSZSA-N 263.337 2.337 10 10 CECE C[C@@H](O)C[C@H]1CCCN1CCCOc1ccc(N)cc1 380265017 UOBFNDSDSOZZNZ-UKRRQHHQSA-N 278.396 2.273 10 10 CECE COC(=O)C[C@H](C)NCc1ccc(N2CCCC2)cc1 380351926 LHWAHMAULVHUAW-ZDUSSCGKSA-N 276.380 2.328 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@@H](CCF)C2)cc1O 691908840 QBOPIUMTJGGVHP-PWSUYJOCSA-N 269.316 2.010 10 10 CECE C[C@@H]1C[C@](NCCCN=[N+]=[N-])(C(N)=O)c2ccccc21 381386649 LSXPWZFGUSLOKA-QMTHXVAHSA-N 273.340 2.164 10 10 CECE CC[C@@H](CO)N(C)c1ccc(CNC)cc1Cl 383268693 GWTBVHRYDDGPKU-NSHDSACASA-N 256.777 2.267 10 10 CECE Nc1ccc(CCNC(=O)c2cc([N+](=O)[O-])cs2)cc1 384635206 KRRWMLKICGHOHA-UHFFFAOYSA-N 291.332 2.211 10 10 CECE Cc1ccnc(N)c1[C@H](O)CCc1ccc(N)cc1 695831543 ZGGXQSIJOJXZRY-CYBMUJFWSA-N 257.337 2.221 10 10 CECE C[C@H]1CNCCN([C@@H](C)c2ccc(F)cc2O)C1 385309980 VFZYSZRAFFHXAD-QWRGUYRKSA-N 252.333 2.134 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@H]1CCCN1C 386334352 QKMSKFPGDXPNNG-SWLSCSKDSA-N 259.397 2.163 10 10 CECE CC[C@@H]1[C@H](CO)CCN1Cc1cc(C(C)=O)ccc1O 386348648 YARQPVDQUDZSRP-DZGCQCFKSA-N 277.364 2.188 10 10 CECE CCCN(C(=O)[C@H]1C[C@H](C)CO1)c1ccc(N)cc1 718387288 WKXXNQDTNGEPTE-SMDDNHRTSA-N 262.353 2.437 10 10 CECE C[C@@H]1CCN(c2ccc([C@@H](C)O)c(O)c2)CCO1 720404335 AAJSXQQERXOSDE-GHMZBOCLSA-N 251.326 2.061 10 10 CECE CC[C@@H]1CN([C@H]2CCc3cccc(O)c32)CCN1C 389149606 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N[C@H]1CCCc2cc(N3[C@H]4CC[C@H]3[C@@H](CO)C4)ccc21 2184686052 CUOOUFNAOAWQOZ-QCPWZWHMSA-N 272.392 2.372 10 10 CECE OC[C@@H](F)C1CCN(c2ccc3c(c2)CC[C@H]3O)CC1 2184738781 XWGLSPQDMYDAEP-HZPDHXFCSA-N 279.355 2.213 10 10 CECE OC1[C@H]2CCC[C@H]1CN(c1ccc3c(c1)CC[C@@H]3O)C2 2184734874 YTGCGZQRYTZXMZ-XEZPLFJOSA-N 273.376 2.263 10 10 CECE C[C@@]1(CO)CC(F)(F)CN1c1ccc2c(c1)CC[C@@H]2O 2184744401 VGTCMLJHUFNRLW-KBPBESRZSA-N 283.318 2.263 10 10 CECE CN[C@H](C)c1cc(F)c(N2CCC[C@@H](CO)C2)c(F)c1 2194693297 ZPPQPLSPLQZURL-GHMZBOCLSA-N 284.350 2.454 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](O)CC23CC3)c(F)c1 2194690316 NRXSJVHWLHQBGE-GXSJLCMTSA-N 282.334 2.478 10 10 CECE Nc1ccc(CCOc2nc3cnc(Cl)nc3[nH]2)cc1 2184844721 KDACACCLQYIINB-UHFFFAOYSA-N 289.726 2.210 10 10 CECE Cc1oncc1CCNCc1c(O)cccc1F 2042599371 MHEZMATVRUINSH-UHFFFAOYSA-N 250.273 2.160 10 10 CECE C[C@H]1CC[C@H](CC(=O)N2CCC(N=[N+]=[N-])CC2)O1 2042883320 KQBQFRPFJYAOOJ-GXSJLCMTSA-N 252.318 2.245 10 10 CECE N[C@H]1CCc2cc(N3CC[C@@H]4CCOC[C@@H]4C3)ccc21 2185436271 DDNGKRPEDVJWMY-IFIJOSMWSA-N 272.392 2.495 10 10 CECE CN(C[C@H]1C[C@H]1CF)C(=O)CCOc1ccc(N)cc1 2191373878 OPTQAXFCCJSRNZ-NWDGAFQWSA-N 280.343 2.102 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H](C2)C3O)c(Cl)c1 2052758169 ZEOACURPKRFBDA-GGOSZGPVSA-N 267.756 2.210 10 10 CECE CN(C)CCC1CN(c2ccc(CO)cc2Cl)C1 2056596881 CWDBYMPTOJYGPC-UHFFFAOYSA-N 268.788 2.220 10 10 CECE CC1(C)CN(c2cc(Cl)c(CN)cc2F)[C@H]1CO 2057253636 YYJFPLXYGTZUBS-LBPRGKRZSA-N 272.751 2.145 10 10 CECE CCC[C@@H](C)NC(=O)CN1CCC[C@H]1CN=[N+]=[N-] 2059057593 GMMUJSWZIRJEMA-MNOVXSKESA-N 253.350 2.066 10 10 CECE CO[C@H]1CCC[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C1 2187279416 ZHPIEYITAAAGOP-CABCVRRESA-N 276.380 2.227 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])C1CC2(CC2)C1 2064072421 GXZIMPSZRRPRDX-SNVBAGLBSA-N 252.318 2.008 10 10 CECE C[C@@H](O)c1ccc(N2CCC3(CC[C@@H]3O)CC2)cc1O 2187423290 KTIOCNYWXKEADZ-ABAIWWIYSA-N 277.364 2.187 10 10 CECE Cc1[nH]c(=N)sc1[C@H](O)c1ccc(N(C)C)cc1 2065906646 LFKHTAWGYZYAFE-LLVKDONJSA-N 263.366 2.012 10 10 CECE COc1c(O)ncnc1N(C)[C@@H](C)c1ccccc1O 2192597618 HNILPTNUEDCPIX-VIFPVBQESA-N 275.308 2.094 10 10 CECE CCCOc1ccc(CN2C[C@H]3C[C@H]2CN3C)c(O)c1 2187560890 VMOAGBCJJJQERP-KGLIPLIRSA-N 276.380 2.069 10 10 CECE C[C@@H]1[C@H](N(C)c2ccc(CN)c(F)c2)C2CCN1CC2 2192781761 RSAPJXVNJIUXAA-BZNIZROVSA-N 277.387 2.203 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)[C@H]2CCCS2)cc1 2071437335 XRCGONGBZRUFFQ-RDBSUJKOSA-N 266.410 2.009 10 10 CECE Nc1ccc(NC(=O)NC2CCC3(CC2)OCCO3)cc1 2071565568 PHRPGPFQQMCCAO-UHFFFAOYSA-N 291.351 2.076 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H]2C[C@@H](OC)C2)cc1O 2100206569 DWNMGAYLUAUVOR-WCFLWFBJSA-N 264.369 2.286 10 10 CECE CCN(C(=O)[C@H]1C[C@]12CCOC2)c1ccc(N)cc1 2100497910 UHFCMEQAENNGDO-HIFRSBDPSA-N 260.337 2.048 10 10 CECE C[C@]12CC[C@H]1CCN2c1ccc2c(c1)NC(=O)[C@H]2O 2101038670 CTMFKWWNSUJTSH-FGEZKYSXSA-N 258.321 2.051 10 10 CECE CC1(C)C[C@H](CCNCc2cccc(O)c2O)CO1 2103190121 JCUJDNVODCUDTA-NSHDSACASA-N 265.353 2.393 10 10 CECE CCNCc1ccc(N(C)Cc2ncno2)c(Cl)c1 2104126053 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CC[C@@H]1CN(c2cc3c(cc2N)OCCO3)C[C@@H](C)O1 689090394 ZNDCYLHRQPHTKU-GHMZBOCLSA-N 278.352 2.044 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1scnc1Cl 713482662 PKHVXYXINFWYHL-ZCFIWIBFSA-N 289.748 2.301 10 10 CECE CN(C[C@]12COC[C@H]1C2)c1ccc(CN)c(Cl)c1 689298335 UTHYDMBVXBLJOB-BXUZGUMPSA-N 266.772 2.271 10 10 CECE C[C@@H](N)c1ccc(N2CCS[C@H](CCO)C2)c(F)c1 720063996 ZSARABPTIZSOMG-ZYHUDNBSSA-N 284.400 2.150 10 10 CECE C[C@H](N)[C@@H]1CCCN(Cc2ccc3c(c2)CCN3C)C1 70171915 XCGYQMUCPRNSJH-XJKSGUPXSA-N 273.424 2.238 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1S(=O)(=O)c1cccc(F)c1 692826567 XWLUNKASJSFPNH-JTQLQIEISA-N 284.316 2.289 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@H]1CCCN1C 92622148 FITIWQPVEBPPTN-OAHLLOKOSA-N 277.412 2.064 10 10 CECE CN[C@H](C)c1ccc(N2CCOCC2(C)C)cc1O 93670804 UUOMFFDKONADJO-LLVKDONJSA-N 264.369 2.288 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC[C@]12CCCC[C@H]1C2 1155409023 LSUJPPCQDJSKLY-BLLLJJGKSA-N 275.348 2.337 10 10 CECE Cc1cn2ccnc(C(=O)N[C@H](C)c3ccccc3O)c2n1 1151886220 ZVQABDFRWPBKRD-LLVKDONJSA-N 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10 CECE N=C(N)c1cc2c(nc1Sc1nccs1)COCC2 2129698538 QNUWLEBBIHWJDT-UHFFFAOYSA-N 292.389 2.046 10 10 CECE CCNCc1ccc(N(C)C[C@H]2CCN2C)cc1C 2129901910 DIPWWWLNVTYNIK-MRXNPFEDSA-N 261.413 2.245 10 10 CECE CCc1cc(NC(=O)N2Cc3cccc(O)c3C2)no1 1262265931 GJORCIDIMQJJFF-UHFFFAOYSA-N 273.292 2.490 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)[C@H]2C3C[C@@H]4C2[C@@H]4C3)C1 2134563151 OLEMOTPCORRXBZ-AFGYQMAISA-N 260.341 2.437 10 10 CECE CON(C)c1nnc(C)n1Cc1ccc(N(C)C)cc1C 1505093683 UFVPXKHPCPSEJD-UHFFFAOYSA-N 289.383 2.007 10 10 CECE C[C@@H](C(=O)NCC(F)(F)F)N1CCC[C@@H](CN=[N+]=[N-])C1 1912176547 AMFQIQUGLBSFOO-IUCAKERBSA-N 293.293 2.076 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@@H]2CCCCO2)C1 1912185002 KTTJOLSPRANQGP-QWRGUYRKSA-N 252.318 2.104 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C[C@H]2COc3ccccc3O2)C1 1912152205 PVRSIPACYCBLHM-NEPJUHHUSA-N 274.324 2.459 10 10 CECE CC(C)(C1CCCC1)[C@@H](NCCCN=[N+]=[N-])C(N)=O 1912170189 UDLKGPRJHCFESV-NSHDSACASA-N 267.377 2.347 10 10 CECE 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CCCCN(C)c1ccc(CNCC(=O)O)cc1OC 212692398 FQOSZEFOMKQPID-UHFFFAOYSA-N 280.368 2.106 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H]2[C@H]3CO)cc1Cl 2138374161 RSWIQJXGSQAOPW-ZLDLUXBVSA-N 280.799 2.267 10 10 CECE O=C(/C=C\c1ccc[nH]1)NCc1c(O)cccc1F 1638864127 WOQORZOYOOSOSE-SREVYHEPSA-N 260.268 2.189 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@H]1NCc1ccc(N)cc1 1929713602 SKLLWGKBJQJCHB-OLZOCXBDSA-N 277.368 2.024 10 10 CECE CN[C@H](CNC(=O)OC(C)(C)C)c1ccccc1O 1928474162 JNRSDIVMJASDBM-LLVKDONJSA-N 266.341 2.177 10 10 CECE CC(=O)N[C@H]1CCN([C@H](C)c2ccc(Cl)cc2O)C1 2138551623 BRHMJBPIUSGMNZ-SKDRFNHKSA-N 282.771 2.317 10 10 CECE COc1cc(N(C)CC2(OC)CCC2)ccc1CO 2139682519 JAEAYVRLODVFBE-UHFFFAOYSA-N 265.353 2.193 10 10 CECE CC(C)(C)[C@H](CCO)NC(=O)Nc1ccc(N)cc1 1962813778 YNDRKDGJFNDTRP-LBPRGKRZSA-N 265.357 2.187 10 10 CECE COc1ccc(COCC(=O)Nc2ccc(N)cc2)cc1 19965624 FXBILUTWTBXLDB-UHFFFAOYSA-N 286.331 2.433 10 10 CECE CCCNC(=O)[C@H](C)NCc1cccc(Cl)c1O 158698915 DMAJZTANAUFASQ-VIFPVBQESA-N 270.760 2.050 10 10 CECE 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CECE CCCNCc1ccc(N2C[C@@H](O)C[C@H](F)C2)c(C)c1 2234682873 GKXCRXRULJNHLU-GJZGRUSLSA-N 280.387 2.404 10 10 CECE CCOc1ncc(C(=O)CCc2ccc(N)cc2)cn1 2234850586 CLVGTYIRSWVMIN-UHFFFAOYSA-N 271.320 2.273 10 10 CECE O[C@@H]1CN(c2ccc3c(c2)CCC3)C[C@]2(CCCO2)C1 2235092703 WCJYAEGFEHFEDM-IRXDYDNUSA-N 273.376 2.296 10 10 CECE COc1ccc(N2CC[C@H](O)[C@@](C)(O)C2)cc1C(C)C 2235144414 YNRAVFXCNBPKJS-HOTGVXAUSA-N 279.380 2.141 10 10 CECE COc1cc(C)c(N2CCC(CO)(OC)CC2)cc1C 2235100879 GWEYVYIEEOCMKZ-UHFFFAOYSA-N 279.380 2.290 10 10 CECE COc1ccc(N2CCN(CC(C)(C)O)CC2)cc1Cl 2235229351 WUTVHMZKOORTAX-UHFFFAOYSA-N 298.814 2.242 10 10 CECE COc1ccnc(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])c1 2225798585 JORKQRMBNUXBGF-NXEZZACHSA-N 261.285 2.051 10 10 CECE CC(C)(CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1)C(=O)O 2225791585 FPKHKJLLTYRPBI-VIFPVBQESA-N 268.317 2.179 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NS(=O)(=O)Cc1ccccc1 2225800482 QVIROJQZIJODCH-NEPJUHHUSA-N 280.353 2.337 10 10 CECE COc1ccc(N(C)[C@@H]2CC[C@H](OC)C2)c(CCN)c1 2235970404 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10 10 CECE CC[C@H]1[C@H](O)CCN1c1ccc(CO)cc1Cl 2250993800 MFMCJGNIFRSZFW-WCQYABFASA-N 255.745 2.182 10 10 CECE CCCN(C[C@H](C)O)c1ccc([C@H](C)O)c(O)c1 2259658426 IOPNAOAMBIIMBL-QWRGUYRKSA-N 253.342 2.043 10 10 CECE COc1cc(OC)c(N2CC[C@]3(CCN3)C2)cc1Cl 2270413040 AZLDBQREKPOBCC-CQSZACIVSA-N 282.771 2.299 10 10 CECE CC(C)[C@@H](C)[C@@H](O)c1ccc(N2CCNCC2)cc1 2270553077 VDYHDPULZGOJQZ-CZUORRHYSA-N 262.397 2.422 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CCCN(C2CC2)C1 2288803317 NAJLKCDQNIJNCN-SNVBAGLBSA-N 275.352 2.006 10 10 CECE Cc1ccc(Cl)c([C@H](NCCCN=[N+]=[N-])C(N)=O)c1 2268033733 ZROCCBGAGNXYQS-NSHDSACASA-N 281.747 2.465 10 10 CECE Cc1cc(N2CC[C@@H]3[C@H](O)C[C@H]3C2)ccc1[C@H](C)O 2269672047 NBBQJNOTMDMRJD-GVAFMPQTSA-N 261.365 2.255 10 10 CECE CN[C@H](C)c1ccc(N2CCN(C)C[C@H]2C)cc1C 2269662770 NYHYRWGMRSRNMZ-ZIAGYGMSSA-N 261.413 2.416 10 10 CECE Cc1cc(N2C[C@H](C)[C@@H](O)[C@H](C)C2)ccc1[C@H](C)N 2269651836 PPFRFHCEMAJVAF-RSUWNVLCSA-N 262.397 2.468 10 10 CECE COc1ccc(N2C[C@@H](CN)C(C)(C)C2)c(OC)c1C 2295434979 NJXUDTAFIPRGIA-GFCCVEGCSA-N 278.396 2.433 10 10 CECE C[C@@H]1CC[C@@H]1N(C)Cc1ccc(N2CCNCC2)cc1 2286072718 FUFKZJZGRARGDB-PBHICJAKSA-N 273.424 2.327 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC4(CCS4)CC3)ccc21 2286247425 QPYDQRAUPNBQNQ-ZDUSSCGKSA-N 289.404 2.114 10 10 CECE C[C@@]1(O)C[C@@H]2C[C@H]1C[C@@H]2NCc1c(O)cccc1F 2296900110 UKUSFXDGIONOKA-WIHQQPEOSA-N 265.328 2.170 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)cc1Cl 2298069335 WSCHTGGLFHPJIG-XXILOJSOSA-N 253.729 2.308 10 10 CECE [N-]=[N+]=NCCCN1CCC[C@@H](O)[C@H]1C(F)(F)F 2303910899 PWVKVQFNSCELEE-SFYZADRCSA-N 252.240 2.074 10 10 CECE CC(C)CCC[C@@](C)(NCCCN=[N+]=[N-])C(N)=O 2315941281 OWOFNGTVLKOPOM-GFCCVEGCSA-N 255.366 2.347 10 10 CECE C[C@@H]1[C@@H]2OCC[C@@H]2[C@]1(Sc1nccs1)C(=O)O 2306964926 OPWPXWFRPAOAEU-GLLZPBPUSA-N 271.363 2.113 10 10 CECE Cc1ccc(O)c([C@H](C)N(C)[C@@H]2CNC[C@@H]2F)c1 2320556383 UPWRPPVWDQHOFR-WCFLWFBJSA-N 252.333 2.003 10 10 CECE CSc1cc(N(C)[C@@H]2CCO[C@H]2C)ccc1CN 2328548954 OCUSELFZDGSTEJ-GXFFZTMASA-N 266.410 2.481 10 10 CECE COc1cccc(CN[C@H]2C[C@@]3(C)CCO[C@@H]23)c1O 2328916017 YJLPQSYLYWWKKT-TUKIKUTGSA-N 263.337 2.058 10 10 CECE C[C@H]1C(C[C@@H](N)[C@H](O)c2ccc(N(C)C)cc2)[C@@H]1C 2331034629 INDJSCSAGSWWHS-HOJOPBEUSA-N 262.397 2.405 10 10 CECE Nc1ccc(CCCNC[C@H]2[C@@H]3CCOC[C@@H]32)cc1 2331253258 RNTOKFNERKPWJC-JYJNAYRXSA-N 260.381 2.074 10 10 CECE CSc1ncc(CNC[C@]23C[C@H]4CC[C@H](N4)[C@@H]2C3)s1 2334412299 XGFPXSCDKJRSQA-GASQSECBSA-N 295.477 2.485 10 10 CECE CN(C[C@@H]1COC2(CCC2)CO1)c1ccc(N)cc1 2338144275 JYUURAHURPXSCG-CQSZACIVSA-N 262.353 2.043 10 10 CECE C[C@@H]1C[C@@H](O)CN(c2ccc(CO)c(C3CC3)c2)C1 2339148302 RAHZIVFYFXIOMS-IAQYHMDHSA-N 261.365 2.263 10 10 CECE CO[C@]1(C(F)F)C[C@H](C(=O)N(C)CCCN=[N+]=[N-])C1 2343097766 SEYPVLRDSQKDCR-DKTWLAJQSA-N 276.287 2.206 10 10 CECE CN1CCCc2cc([C@@H](NN)[C@@H]3C[C@H]3C(F)F)ccc21 2354610044 VXJPMNCBMRGESQ-YRGRVCCFSA-N 281.350 2.475 10 10 CECE CC[C@@H](c1ccccc1O)N1C[C@@H]2C[C@H](C(=O)O)[C@@H]2C1 2355439416 LKWMOSCXPHAKQP-DEQVHRJGSA-N 275.348 2.496 10 10 CECE COC[C@H](C)N(C)[C@@H](CN)c1ccc2c(c1)CCCN2C 50287293 GFVXTIXLIWFKNR-GUYCJALGSA-N 291.439 2.036 10 10 CECE CCCNCc1ccc(N2CCC[C@@H]2C(=O)NC)c(C)c1 50561896 HDQBAPMBBXUHEQ-MRXNPFEDSA-N 289.423 2.209 10 10 CECE C[C@@H]1CN([C@@H](C)c2cc(F)ccc2O)C[C@H]1C(=O)O 227385725 DZRHLGASUGSYKW-VDDIYKPWSA-N 267.300 2.245 10 10 CECE O=C(NCc1ccccc1Cl)c1cc(O)nc(O)c1 170223081 ITHLJGRVVAXYID-UHFFFAOYSA-N 278.695 2.076 10 10 CECE O=C(N[C@H]1C[C@H]2[C@H]3CC[C@@H](C3)[C@@H]12)c1cccc(O)c1O 2357254754 YCUMBVSMANIOMI-SLWWCASWSA-N 273.332 2.262 10 10 CECE COc1ccc([C@@H](C)N[C@H]2CCC[C@@H](O)C2)c(O)c1 217619937 DOGJDBVPGPXESF-GRYCIOLGSA-N 265.353 2.355 10 10 CECE COc1cc(Cl)cc(CN(C)CC2(CO)CC2)c1O 188951606 LFEIXTSKBCYAOP-UHFFFAOYSA-N 285.771 2.259 10 10 CECE C[C@H]1CC(OCC(=O)N(C)c2ccc(N)cc2)C[C@H](C)O1 227731494 WKUSXBRRGUKHLF-RYUDHWBXSA-N 292.379 2.204 10 10 CECE CCNCc1ccc(N(C)[C@H](C)COC)c(F)c1 42519064 RORMXHMQSMGZMP-LLVKDONJSA-N 254.349 2.406 10 10 CECE Cc1nc(CNCc2cccc(Br)c2O)no1 192610666 KGPABJNMFGRCJJ-UHFFFAOYSA-N 298.140 2.136 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@@H]1CN(C(C)C)CCO1 80747112 KNPAGMCPIJFSQM-QGZVFWFLSA-N 291.439 2.200 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CCCO2)c(F)c1 42464406 JHGGNWVRRFLCFX-JQWIXIFHSA-N 252.333 2.461 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](NC(=O)OC)C2)c(F)c1 228277889 TZWMCGFIZXVFFG-PWSUYJOCSA-N 295.358 2.041 10 10 CECE Cc1cc(O)c([C@H]2CNCCN2)c(C)c1Br 95718918 HPRNHYPOGHXTKE-SECBINFHSA-N 285.185 2.005 10 10 CECE CCCN(C1CNC1)[C@@H](C)c1cc(F)ccc1O 94621994 UUFUCYHKIGXESV-JTQLQIEISA-N 252.333 2.276 10 10 CECE Cc1cc(Cl)cc(CNC[C@@H](CO)[C@@H]2CCOC2)c1O 280200223 BGRWLRKZCUFOLT-YPMHNXCESA-N 299.798 2.089 10 10 CECE CC[C@H]1CCN1Cc1ccc([N+](=O)[O-])c(OC)c1O 292773288 KQXBKSGKYSWMNS-JTQLQIEISA-N 266.297 2.293 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)c1ncccn1 2163070817 ZLZDGJGXQUPGDJ-HNNXBMFYSA-N 268.364 2.168 10 10 CECE Cc1cc(C)nc([C@@H](O)c2ccc3c(c2)CCN3C)n1 2163071835 RWYAQNNTPKPJBM-HNNXBMFYSA-N 269.348 2.167 10 10 CECE CCc1nnc(C)cc1[C@@H](N)c1ccc(N(C)C)cc1 2163077612 WRUADVBLTPGGRQ-INIZCTEOSA-N 270.380 2.462 10 10 CECE NCc1ncc([C@@H](O)c2ccc(N3CCCC3)cc2)s1 2163103177 QTHYBSPLZUOSMO-HNNXBMFYSA-N 289.404 2.284 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@H]1C[C@H](F)CN1 2163110417 IPAWYWJQWYLIKD-NUEKZKHPSA-N 278.371 2.410 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3CC4(CC4)CN3)ccc21 2163111212 PVHRMBPWUQVWMM-GOEBONIOSA-N 272.392 2.245 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)CC[C@@H]4CC[C@H]43)ccc21 2163140527 KFXCEXFUCRNXTM-ISGYEWALSA-N 272.392 2.230 10 10 CECE CC(=O)C(=O)COC(=O)CCOc1ccc(C(C)C)cc1 808508638 JYQOLLXJYJTKGJ-UHFFFAOYSA-N 292.331 2.280 10 10 CECE CCc1cnc([C@H](NC)c2ccc3c(c2)CCN3C)[nH]1 2164133370 UVBIFBTULPKIJW-OAHLLOKOSA-N 270.380 2.273 10 10 CECE CCNC(=O)[C@H]1CCCN1c1ccc([C@@H](C)N)cc1Cl 2169607302 MGYOZJHZHWVESA-QMTHXVAHSA-N 295.814 2.465 10 10 CECE N[C@H](CCO)c1cc(Cl)cc(C(F)F)c1O 714070640 LTETVPKGSHOUGE-MRVPVSSYSA-N 251.660 2.365 10 10 CECE CCOc1cccc(CN2CCC[C@@H](C)[C@H]2C(=O)O)c1O 818632046 ZLVYSAFGWRBDAV-RISCZKNCSA-N 293.363 2.476 10 10 CECE CSCC1CCN(c2ccc3c(c2)NC(=O)[C@@H]3O)CC1 719311581 QBUDUHMBHBHEOW-CQSZACIVSA-N 292.404 2.252 10 10 CECE CCCN(CC1COCCOC1)c1ccc(N)cc1 2131428115 OQCVSUYPYTZJCP-UHFFFAOYSA-N 264.369 2.148 10 10 CECE CC(C)CC[C@H](O)[C@H](N)c1cc([N+](=O)[O-])ccc1O 575282355 ZFYSYMZLRPHGSD-QWHCGFSZSA-N 268.313 2.097 10 10 CECE O=C(/C=C\c1cnccn1)N1CCc2c(F)cccc21 492568150 WDQLVNSKTJWJBA-PLNGDYQASA-N 269.279 2.218 10 10 CECE C[C@H](NC[C@H]1CCCCN1CCO)c1ccc(F)cc1O 834849345 BBCHMWGWVLHONS-GXTWGEPZSA-N 296.386 2.029 10 10 CECE CS[C@H](CO)[C@H](C)NC/C=C\c1ccc(N(C)C)cc1 835039103 AZVUGMZLHUHZSA-PCXLQKCLSA-N 294.464 2.468 10 10 CECE CCOc1cccc(CN2CC3(CCOCC3)C2)c1O 839141767 ZKNLSAKOXJFHQH-UHFFFAOYSA-N 277.364 2.403 10 10 CECE C[C@@H]1NCCN(C/C=C/c2ccc(N(C)C)cc2)[C@@H]1C 843058041 NYSZLJOCRORMNR-ICWYTKJFSA-N 273.424 2.448 10 10 CECE CO[C@H](COC(=O)/C=C/c1ccc(O)c(O)c1)C1CCC1 849745579 VNDRXQRZJMWWPM-PMGBHYCQSA-N 292.331 2.469 10 10 CECE CC[C@@H]1C[C@@H](NCc2ccc(N3CCOCC3)cc2)CO1 850068965 JVZSQVRIPVMDSW-NVXWUHKLSA-N 290.407 2.180 10 10 CECE CC(=O)CC1(C(=O)NCc2c(O)cccc2F)CCC1 928708546 OOPCUMRLWNFWQC-UHFFFAOYSA-N 279.311 2.297 10 10 CECE CN(C)c1ccc(CN2C[C@@H]3CCC[C@]3(CO)C2)cc1 859925542 NVYSHQGZEKJGEI-DOTOQJQBSA-N 274.408 2.347 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NCC[C@@H]1CC1(F)F 857728238 KLFZNMLKLXHAPD-WUWIAWFRSA-N 283.274 2.273 10 10 CECE C[C@H](NC(=O)NCCCC1(O)CCC1)c1ccccc1O 868717166 NUITWOHYVGGEJX-LBPRGKRZSA-N 292.379 2.448 10 10 CECE CSc1ncc(CNC[C@H](N)[C@@H](C)SC)s1 2243840431 PKERLSGMAXLOBJ-APPZFPTMSA-N 277.484 2.033 10 10 CECE COC[C@@H]1CCN1Cc1c(O)cccc1Br 862376113 GPEVFZSDAIMRLV-VIFPVBQESA-N 286.169 2.375 10 10 CECE CCOC(=O)C1=CC[C@H](NCc2ccccc2O)C1 862487298 OAYHCRFJOANEEO-ZDUSSCGKSA-N 261.321 2.134 10 10 CECE CS(=O)(=O)c1ccc(SCCN=[N+]=[N-])cc1 63131722 PAOUUVDSFULYKK-UHFFFAOYSA-N 257.340 2.493 10 10 CECE CC(C)(C)CC(=O)N1CCN(Cc2ccccc2O)CC1 778996065 LMVZDMBOXXWXGC-UHFFFAOYSA-N 290.407 2.473 10 10 CECE Cc1ccc([C@@H]2NCCc3c2ccc(O)c3O)cn1 75794219 AOUFTQSOAMSQSC-AWEZNQCLSA-N 256.305 2.036 10 10 CECE Oc1ccc(O)c2c1CCN[C@H]2c1cccc(Cl)n1 75799240 DABRQDAYSFEVML-AWEZNQCLSA-N 276.723 2.381 10 10 CECE COc1cc2c(cc1OC)N([C@@H](C)C(C)=O)C[C@@H](C)N2 76928132 FDOGKEMRFNGWFO-ZJUUUORDSA-N 278.352 2.302 10 10 CECE Cc1ccc(CNc2ccc(C(N)=O)cc2)c(O)c1 83415474 MPNKNLZNPOKXPP-UHFFFAOYSA-N 256.305 2.412 10 10 CECE [N-]=[N+]=NCCNC(=O)c1nc(Cl)ccc1Cl 701323116 MLGMIGCNWHPXIQ-UHFFFAOYSA-N 260.084 2.429 10 10 CECE CCCN(C[C@@H](C)CS(C)(=O)=O)c1ccc(N)cc1 706673726 GZODIADTQXSPDE-GFCCVEGCSA-N 284.425 2.166 10 10 CECE NCc1ccc(N2CCSC[C@@H]2CCO)cc1Cl 689741966 MRWZVGHSXZXNRW-LBPRGKRZSA-N 286.828 2.103 10 10 CECE C[C@@H](NCc1cc(F)cc(F)c1O)c1cn[nH]c1 708534569 AQSSKMIRPXWAMC-SSDOTTSWSA-N 253.252 2.244 10 10 CECE CNCc1cc(F)c(N2CCN(C(C)C)CC2)c(F)c1 62711110 KJLCFWGANFYTEF-UHFFFAOYSA-N 283.366 2.215 10 10 CECE C[C@@H](C(N)=O)N(C)[C@@H](C)c1ccc2ccccc2c1O 711157637 LTSHRKXBVLEFQG-QWRGUYRKSA-N 272.348 2.412 10 10 CECE CCOc1cccc(CN(CC)C[C@H](C)C(=O)O)c1O 86761920 CFLBUIMJRFLZDI-NSHDSACASA-N 281.352 2.334 10 10 CECE Oc1c(Br)cccc1CNCCc1cnoc1 718900230 TWRKTVOSXGBXPE-UHFFFAOYSA-N 297.152 2.475 10 10 CECE C[C@H](O)C1CN(c2ccc(CNC3CC3)cc2Cl)C1 719791003 WMKOGQQVBSXSIW-JTQLQIEISA-N 280.799 2.409 10 10 CECE C[C@H]1CCCN(Cc2ccc(O)c(O)c2)[C@@H]1CCCN 693503232 NXLSYEWKKOLEGN-GXTWGEPZSA-N 278.396 2.437 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H](N(C)C)[C@H](C)C1 693716722 MXVMKWOXDWLSSL-HIFRSBDPSA-N 262.397 2.264 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@H]1CCCCN1 694404376 GTNGQRWOBLKDJR-CHWSQXEVSA-N 276.380 2.444 10 10 CECE COc1ccc([C@H](C)NC[C@H]2CCC[C@@H]2O)c(O)c1 89160049 GMAJFWKRDDHNQO-WDMOLILDSA-N 265.353 2.212 10 10 CECE C[C@@](NCCCN=[N+]=[N-])(C(N)=O)c1ccc(F)c(Cl)c1 90260230 YIVFGBPHFPNTCY-LBPRGKRZSA-N 299.737 2.470 10 10 CECE Nc1ccc(OCCNC(=O)N2CCCCCC2)cc1 91970960 BLHJDALNVUURIQ-UHFFFAOYSA-N 277.368 2.233 10 10 CECE NCc1ccc(N2CCO[C@@H]3C[C@@H]32)c2ccccc12 2115167713 NSMLWXGLCZVXIT-JKSUJKDBSA-N 254.333 2.276 10 10 CECE COC[C@@H]1CN(C(=O)Nc2ccc(N)cc2)C[C@H]1C 2118625063 JJIOJWYTWGCWMU-MNOVXSKESA-N 263.341 2.015 10 10 CECE CCOC(=O)[C@@](C)(NCCN=[N+]=[N-])[C@@]1(C)CC1(F)F 2116115444 ISDAEXQEIDNOJS-NXEZZACHSA-N 276.287 2.253 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1[C@H]2CCO[C@@H]12 2119913168 JPKXTQGCARPFHV-QKPAOTATSA-N 258.365 2.322 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@]3(C2)C[C@@H](O)C3)cc1 2125990828 PAZHQPTZGDTDKD-OAGGEKHMSA-N 260.381 2.448 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N(C)CCC1CNC1 2120411812 NWHBNMMVVBQGNU-CYBMUJFWSA-N 261.413 2.355 10 10 CECE CC(C)[C@H]1[C@H](O)CCN1c1c(F)cc(CO)cc1F 2126100502 NFXCKZWKTZNTJM-OLZOCXBDSA-N 271.307 2.053 10 10 CECE CO[C@H]1COC[C@@H]1N(C)c1ccc([C@H](C)N)c(Cl)c1 2120776821 RFFLIEWOOGTNHS-HERUPUMHSA-N 284.787 2.210 10 10 CECE O=C1CCN(c2ccc(OC(F)(F)F)cc2)CCC1=O 1615891629 YDARJQNMTIUOEW-UHFFFAOYSA-N 287.237 2.324 10 10 CECE COc1ccc([C@H](C)N[C@H]2COC3CC2C3)c(O)c1 2126736327 WZHOCQLAKPDRGH-SLTDEYSJSA-N 263.337 2.229 10 10 CECE CCc1cccc(CNCc2ccc(O)c(O)c2)n1 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CSc1ncc(CNC[C@@H]2CCCNCC2)s1 2248737100 QKZTYQSWCRDGAH-SNVBAGLBSA-N 271.455 2.344 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@@](F)(CO)C2)cc1 1917057751 BMBFGGCIMHDQGZ-KGLIPLIRSA-N 252.333 2.007 10 10 CECE CC(=O)C(=O)[C@@](C)(O)CCc1ccc(OC(F)F)cc1 1919104838 WYZVZCHOXBAJBX-AWEZNQCLSA-N 286.274 2.130 10 10 CECE C[C@H]1CCCN(Cc2c(O)cccc2F)[C@H]1C(=O)O 2136353878 XJKNMOFISBFAQJ-TVQRCGJNSA-N 267.300 2.216 10 10 CECE Oc1ccsc1-c1nc([C@H]2CN3CCC[C@@H]3CO2)no1 118222061 KUVVRCQUGXKWGY-PSASIEDQSA-N 293.348 2.039 10 10 CECE C[C@H](NC[C@@H]1CCC[C@H]1N(C)C)c1c(O)cccc1O 1924673058 YEOMZZAUZKIHHS-RWMBFGLXSA-N 278.396 2.479 10 10 CECE C[C@H]1CCNC[C@@H](C)N1c1ccc2c(c1)OCCO2 216858924 DAYLCTSZFRJVPF-NWDGAFQWSA-N 262.353 2.035 10 10 CECE CCO[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)C1(C)C 229394737 RTWVNGVWNNBSMJ-NEPJUHHUSA-N 279.336 2.031 10 10 CECE CC[C@H](C(=O)OC)[C@@](C)(N)c1ccc(N(C)C)cc1 1927629399 OQOHGWRPAHOHSE-HIFRSBDPSA-N 264.369 2.126 10 10 CECE CCC[C@H](C(=O)O)[C@H](N)c1ccc(N(C)C)cc1 1927637513 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C[C@H](O)c1ccc(N(C)CC(C)(C)CN(C)C)cc1O 2144761584 FWTQWAPVZHWEOZ-LBPRGKRZSA-N 280.412 2.470 10 10 CECE CN(Cc1cc(F)cc(F)c1O)CC(C)(C)C(=O)O 1972164278 NAOGVUSFVVBZPY-UHFFFAOYSA-N 273.279 2.213 10 10 CECE CCN(C)C1CN(c2ccc(CO)cc2Br)C1 2003547590 QDOGLBRPLMEWCG-UHFFFAOYSA-N 299.212 2.082 10 10 CECE COCc1nc(CN[C@@H](C)c2ccc(C)cc2O)no1 2145588605 YMUCMZMFYXCFMA-JTQLQIEISA-N 277.324 2.081 10 10 CECE CCOC(=O)C[C@@H](N)c1ccc(C(F)F)cc1O 260743418 DVNDNHHPTMGFQG-SECBINFHSA-N 259.252 2.283 10 10 CECE CCCOC1CN(c2ccc(CN)c(Cl)c2)C1 1996708279 YZQNSFIUCHZFJZ-UHFFFAOYSA-N 254.761 2.414 10 10 CECE CO[C@@H]1CCC[C@@H]2CN(Cc3cc(N)ccc3O)C[C@H]21 2150931274 RINOYSMMIAYKNE-DJSGYFEHSA-N 276.380 2.221 10 10 CECE CCO[C@H]1CCCN(c2cc3c(cc2N)OCCO3)C1 42421283 HRHZRGDKBAATTQ-NSHDSACASA-N 278.352 2.045 10 10 CECE CCNCc1ccc(N(CC(N)=O)C(C)C)c(Cl)c1 164003285 LCBBKAMWHAWCFA-UHFFFAOYSA-N 283.803 2.150 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H]3C[C@@H](O)[C@H]3C2)cc1 2151390724 FGCSJIJLLCAWAC-BHYGNILZSA-N 274.408 2.249 10 10 CECE 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10 10 CECE Cc1cc(N2CC(OC(F)(F)F)C2)ccc1CN 2221845160 KVGXBUJBZUMNHF-UHFFFAOYSA-N 260.259 2.179 10 10 CECE C[C@]1(O)C[C@H]2[C@H]1CCN2c1ccc2c(c1)CCC[C@@H]2N 2233771267 XPYKXAXPSIXZMQ-QZWWFDLISA-N 272.392 2.372 10 10 CECE COC[C@](C)(CO)N(C)c1ccc(OCC(F)F)cc1 2235079110 IJHXLNIHFAMMBM-AWEZNQCLSA-N 289.322 2.164 10 10 CECE O[C@@H]1CCC2(CC2)N(c2ccc(CNC3CC3)cc2)C1 2235769498 UBVXRBPKJTZRKL-MRXNPFEDSA-N 272.392 2.432 10 10 CECE CCNCc1cc(OC)ccc1N(C)[C@@H]1COC[C@H]1C 2235955554 TUHOCBTYODTJHJ-MLGOLLRUSA-N 278.396 2.276 10 10 CECE COc1ccc(N2CCn3cccc3C2)c(C(=O)O)c1 2235948459 RPYQFVDBTIFERK-UHFFFAOYSA-N 272.304 2.215 10 10 CECE COc1ccc(N2CCC[C@H]3COCC[C@@H]32)c(CN)c1 2235958252 JPADFCZZCTZWCM-LRDDRELGSA-N 276.380 2.159 10 10 CECE CCOc1ccc(N(C)C2CC(O)C2)cc1OCC 2226539114 SNDRDWPCIMNCPN-UHFFFAOYSA-N 265.353 2.444 10 10 CECE CC1(C)COc2ccc(N3CC[C@@H]4C[C@]4(O)C3)cc21 2226669300 AQDXGEMDBMORIF-BZNIZROVSA-N 259.349 2.318 10 10 CECE COc1ccc(N2CC(SC)C2)c(CNC2CC2)c1 2227672312 HAGPLWGQRZTDNY-UHFFFAOYSA-N 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CCCNCc1ccc(N2C[C@@H](C(N)=O)CC[C@H]2C)cc1 249683192 YMAYZTHXQWUTMK-HIFRSBDPSA-N 289.423 2.276 10 10 CECE C[C@@H](N)C1(c2c(Br)cc(F)c(O)c2O)CC1 258723661 ZSPQAXZKCFGHES-RXMQYKEDSA-N 290.132 2.378 10 10 CECE COCCNCc1ccc(N2C[C@@H](C)OC[C@H]2C)cc1C 251062076 YMNQWCLSCANBGY-HUUCEWRRSA-N 292.423 2.345 10 10 CECE CNCC1(c2cc(O)c(O)cc2Br)CC1 257818075 COFSIDCGRCECFV-UHFFFAOYSA-N 272.142 2.111 10 10 CECE C[C@@H](C(=O)O)c1cc(O)c(O)c(Br)c1 258486961 VHANBAHHWWVRMA-SCSAIBSYSA-N 261.071 2.048 10 10 CECE OCC1(NCc2cc(F)ccc2O)Cc2ccccc2C1 376827697 JKIQRELUPGRZLL-UHFFFAOYSA-N 287.334 2.151 10 10 CECE CO[C@@H]1CCN(c2c(F)cc(/C=C\C(=O)O)cc2F)C1 383392578 PJPLLIMMKYTUIF-MXQLGCADSA-N 283.274 2.288 10 10 CECE CN1CCC[C@H](C[C@@H](O)c2ccc3c(c2)CCN3C)C1 2163062413 LZSOSEMYPGRMCA-CXAGYDPISA-N 274.408 2.444 10 10 CECE CN1CCc2cc([C@H](O)C(=O)C3C[C@H]4C[C@@H]4C3)ccc21 2163853412 HPVBEKGWCALWIY-IOASZLSFSA-N 271.360 2.328 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1c[nH]ccc1=N 2164173477 OCYUACZOQAFVHW-INIZCTEOSA-N 270.380 2.259 10 10 CECE CC1(C)CO[C@@H](CCNCc2cccc(O)c2O)C1 717330844 LBNQGKIDCHBXLP-LBPRGKRZSA-N 265.353 2.393 10 10 CECE CCOc1cccc(CN2CCN[C@@H](C)C[C@@H]2C)c1O 2164466855 NJCLQWUPRHEBJH-STQMWFEESA-N 278.396 2.363 10 10 CECE C[C@H]1Cc2ccccc2N(Cc2ncoc2CCN)C1 2164506589 HACGQUIRZDINJD-LBPRGKRZSA-N 271.364 2.375 10 10 CECE Cc1cccc(CNCC(C)(C)n2cccn2)c1O 704777252 RKOIKRKLTQZRHQ-UHFFFAOYSA-N 259.353 2.422 10 10 CECE C/C=C/C(=O)NCc1cc(Br)ccc1O 804737300 NTCWTCABILUCIO-NSCUHMNNSA-N 270.126 2.347 10 10 CECE CCOc1ccc(N2CCC3(CC2)C[C@H](N)CO3)cc1 2162643023 KMVVDQUJJAWSAU-ZDUSSCGKSA-N 276.380 2.172 10 10 CECE N[C@H]1C[C@H]2CC[C@H]1N(c1ccc3c(c1)OCCCO3)C2 2162666310 JSRGYTYPLJYFRQ-KWCYVHTRSA-N 274.364 2.164 10 10 CECE CC(=O)C(=O)COc1cc2oc(=O)cc(C)c2cc1Cl 808013057 XVEDOUAUOMAILT-UHFFFAOYSA-N 294.690 2.292 10 10 CECE COC(=O)c1cccc(N)c1N[C@H](CCO)C(C)(C)C 2165021631 MEOZOOXTGKMPHY-GFCCVEGCSA-N 280.368 2.264 10 10 CECE O=C(O)/C=C\c1ccc(N2C[C@@H]3[C@@H](C2)C3(F)F)cc1 715458259 KOEVCWAQGISLHL-BCIKPAMSSA-N 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10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2CCCS2)cc1 1999526754 DYACRARQIVAHDZ-OLZOCXBDSA-N 251.399 2.153 10 10 CECE CCN1CCC[C@H](N[C@@H](C)c2ccc(O)cc2O)C1 40502213 CVDWAJFOMGADKY-RYUDHWBXSA-N 264.369 2.233 10 10 CECE C[C@H]1C[C@@H]1N(CCO)c1ccc(CN)cc1Cl 2002031862 LLJJZUAWFUUGKR-ZANVPECISA-N 254.761 2.006 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)CCCCCC(=O)O 2153648882 ADXZNGBETDKOTF-UHFFFAOYSA-N 278.352 2.262 10 10 CECE CCCn1cc(NCc2cccc(O)c2O)ccc1=O 41117753 YNFDHTJPHYKSHH-UHFFFAOYSA-N 274.320 2.282 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2COCCCO2)c(F)c1 2153985208 HHICPOUFMNUAGZ-WCQYABFASA-N 282.359 2.087 10 10 CECE CCCn1cnc([C@@H](O)c2ccc3c(c2)CCN3C)c1 2154343679 OFSPNPQIUGVTOY-INIZCTEOSA-N 271.364 2.367 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CC(C)(C)C)ccc21 45074403 FNPFMEMNXROBCS-ZDUSSCGKSA-N 261.369 2.382 10 10 CECE CNCc1ccc(OCc2ccc(OC)nn2)c(C)c1 2155018118 AXQQJNMDKFIXGF-UHFFFAOYSA-N 273.336 2.092 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1COC(C)(C)C1 2159366058 FVQNQXWQQPXUPQ-CYBMUJFWSA-N 276.380 2.432 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Oc1cc(OCc2ccccc2)ccc1[C@@H]1CNCCN1 95691398 VTMIXAOFOKIVAO-INIZCTEOSA-N 284.359 2.205 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCCSC1 90260068 RIJFKPWWDPIFIL-LLVKDONJSA-N 272.374 2.105 10 10 CECE COc1ccc([C@@H](C)NCC2(C)COC2)c(O)c1 94721829 ZBEVKEZNKQOODB-SNVBAGLBSA-N 251.326 2.088 10 10 CECE CC(=O)N(C(=O)NCCC(C)C)c1ccc(N)cc1 242596093 CJBXAKZCYMLNPO-UHFFFAOYSA-N 263.341 2.377 10 10 CECE Cn1ccc2sc3c(c21)[C@H](CCC(=O)O)NCC3 606602901 RCXQJERSPCHUFY-QMMMGPOBSA-N 264.350 2.291 10 10 CECE Cn1c(-c2n[nH]c3c2CCNC3)cc2ccccc21 606594120 SWCPTSHPEDKFFJ-UHFFFAOYSA-N 252.321 2.214 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)CCN(C)C)cc1O 93671695 SXDDEZWBSSDQOD-ZDUSSCGKSA-N 279.428 2.451 10 10 CECE COc1nsc(OC)c1NCCOc1ccc(N)cc1 2162472623 BXKLQSXULKADRD-UHFFFAOYSA-N 295.364 2.233 10 10 CECE CC[C@H](NCc1cnn(C)n1)c1ccc(N(C)C)cc1 806168640 VVZGDDOTNRWJBG-HNNXBMFYSA-N 273.384 2.122 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@H]2CN1c1ccc2c(c1)CCCO2 2162633363 XSIGQTKEUDCYSJ-NUEKZKHPSA-N 272.392 2.446 10 10 CECE 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CCOC1CN(c2ccc(OC)cc2CNC2CC2)C1 2235968579 TZYQBRAFDJTVCF-UHFFFAOYSA-N 276.380 2.172 10 10 CECE OC[C@H]1CC(F)(F)CN1c1ccc(OC2CC2)cc1 2226769337 CSFQQJUSXWXDFO-LLVKDONJSA-N 269.291 2.434 10 10 CECE OCc1ccc(N2CC(COC(F)(F)CF)C2)c(F)c1 2236868365 OTRJYXSIQFWAFI-UHFFFAOYSA-N 293.260 2.333 10 10 CECE CN1CCc2cc(N3CC[C@H](C4(O)CC4)C3)ccc21 2226807614 HFKRXLKQLVMIBN-ZDUSSCGKSA-N 258.365 2.030 10 10 CECE COc1ccc(N2C[C@@H]3CC(O)C[C@H]3C2)c(F)c1F 2226935293 YMENXULTPYOVBM-IUCAKERBSA-N 269.291 2.181 10 10 CECE COc1ccncc1NC(=O)Nc1ccc(N)cc1 2227254490 QUDDCAXZCFQBEU-UHFFFAOYSA-N 258.281 2.316 10 10 CECE Oc1cc(F)ccc1CN1CCO[C@@H]2CCC[C@H]21 295407162 RIDXIEVXLCIIKH-TZMCWYRMSA-N 251.301 2.285 10 10 CECE CN(C)c1ccc(O[C@@]2(C(=O)O)C3C[C@@H]4C2[C@@H]4C3)cc1 2237684442 JHGVLXJOMGTPBH-GXXNRABOSA-N 273.332 2.241 10 10 CECE COc1ccc(N(C)C[C@@H]2CC[C@@H](C)O2)c(CO)c1 2227678434 VYHOREYFXCJYRP-RISCZKNCSA-N 265.353 2.191 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC=C[C@]1(C)C(=O)O 2239429023 FIPIIDOFWWPIDZ-MEBBXXQBSA-N 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Nc1ccc(C[C@@H](O)c2cccc3nccn23)cc1 2265558167 GEJWOJSJONKGMI-CQSZACIVSA-N 253.305 2.193 10 10 CECE Cc1cc(N2C[C@@H](CO)C3(CC3)C2)ccc1[C@H](C)N 2269665160 FRNPQPWVEUOPER-STQMWFEESA-N 260.381 2.223 10 10 CECE Cc1cc(N2C[C@@H](O)[C@H](C3CC3)C2)ccc1[C@H](C)N 2269755106 PNOCEAGQMVFNRP-KNXALSJPSA-N 260.381 2.222 10 10 CECE CCN(c1ccc([C@@H](C)N)c(C)c1)[C@@H](C)CS(C)(=O)=O 2285123792 ICXRHEVEFNSAMY-QWHCGFSZSA-N 298.452 2.274 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H](CO)[C@@H]3C2)c(OC)c1C 2295375569 LNCAYKQCYWCLNV-RWMBFGLXSA-N 277.364 2.077 10 10 CECE Cn1cnc(Br)c1NCCc1ccc(N)cc1 2300217760 TUJPUGGUGVSKRI-UHFFFAOYSA-N 295.184 2.419 10 10 CECE Oc1ccc(Cl)cc1CN[C@@H]1C[C@@H]2C[C@H]1C[C@H]2O 2310039279 GLYUCVBMQBYSIM-ONVGCPIPSA-N 267.756 2.295 10 10 CECE COc1cc(Cl)c(N(C)C2CC(O)C2)c(OC)c1 2319564856 KBRHTKLSQRJFGV-UHFFFAOYSA-N 271.744 2.317 10 10 CECE CCN[C@](CO)(CSc1nccs1)[C@@H]1CC1(F)F 2327113565 TVPLNVFIYBOJKP-WCBMZHEXSA-N 294.392 2.231 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3C[C@@H]4CC[C@H]3O4)ccc21 2329487019 RPDMZODKYGCBKN-XNISGKROSA-N 259.349 2.280 10 10 CECE C[C@H]1Cc2cc(N3C[C@@H]4CC[C@]4(CO)C3)ccc2O1 2333687000 JPRTXUSXNSUJKL-DETPVDSQSA-N 259.349 2.219 10 10 CECE NC[C@@H]1C[C@@H]1C[C@H](O)c1ccc(N2CCCC2)cc1 2335827039 TXVVPLRKPVXJNZ-YCPHGPKFSA-N 260.381 2.305 10 10 CECE CNCc1ccc(N2CCO[C@@H]3C[C@H]32)cc1C1CC1 2339147945 ZRTBBXNSYJQXDJ-HZPDHXFCSA-N 258.365 2.261 10 10 CECE CN[C@@H]1CCCN([C@H](C)c2c(O)cccc2O)CC1 2340126461 SRVWPTREDFAHHB-VXGBXAGGSA-N 264.369 2.233 10 10 CECE C[C@@H](O)CN(c1ccc(CO)cc1F)C1CCCC1 2342919286 CXROFDSQCKXUSJ-LLVKDONJSA-N 267.344 2.448 10 10 CECE Cc1ccc(CNC[C@]2(O)C[C@H]2C(F)(F)F)c(O)c1 2344266426 GSYVGUCJKYTBEB-VXGBXAGGSA-N 275.270 2.104 10 10 CECE COc1ncc(CN(C)c2ccc(N)cc2)cc1F 2349804718 DLQDPKIBUDQIGQ-UHFFFAOYSA-N 261.300 2.448 10 10 CECE CCN1CCc2cc([C@H](NN)[C@H]3C[C@@H](F)C3)ccc21 2352245255 VOYNLDAFGCDTRV-GUTXKFCHSA-N 263.360 2.322 10 10 CECE CSc1cc(N2CC(n3cccn3)C2)ccc1CN 2353855091 FMHDBWAUJZNJIP-UHFFFAOYSA-N 274.393 2.125 10 10 CECE CSc1cc(N2CC[C@H]3COCC[C@@H]32)ccc1CN 2353856174 XHTIBVBOXAIXCP-JSGCOSHPSA-N 278.421 2.482 10 10 CECE CO[C@H]1C[C@H](CF)N(c2ccc(CN)c(SC)c2)C1 2353859744 IQZGTRLHPHZVRA-OLZOCXBDSA-N 284.400 2.430 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)C[C@@H]2C[C@H]1CC2(F)F 2354318960 YSUOBKGDDHSMNN-DUBDDPSESA-N 283.318 2.449 10 10 CECE CCN1CCc2cc([C@@H](O)[C@]34CC[C@H]3CCN4)ccc21 2354609226 YGYYWFQMJAXAJU-UAGQMJEPSA-N 272.392 2.245 10 10 CECE Nc1ccc(CCC(=O)N[C@@H](C(F)F)C2CC2)cc1 1893194134 BKKACYFOSPSIKV-CYBMUJFWSA-N 268.307 2.361 10 10 CECE NC(=O)[C@H]1CCCN(Cc2c(O)ccc3ccccc23)C1 119918292 ZJLCATUOXUJPMA-ZDUSSCGKSA-N 284.359 2.243 10 10 CECE CN(Cc1cccc(F)c1)c1ccc2c(c1)NC(=O)[C@@H]2N 102453447 HHKUJJCXTJLSKD-OAHLLOKOSA-N 285.322 2.414 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@H]2CCCO2)c(F)c1 109568662 JHGGNWVRRFLCFX-ZYHUDNBSSA-N 252.333 2.461 10 10 CECE Oc1cccc(CNCCC2CCOCC2)c1O 310712942 DNPCQXJBKBIAOR-UHFFFAOYSA-N 251.326 2.004 10 10 CECE COC(=O)[C@H]1CCN[C@H]1c1c(C)n(C)c2ccccc12 1952856741 BRXGKARCVCKCIT-SWLSCSKDSA-N 272.348 2.310 10 10 CECE CN(CCc1ccc(N)cc1)[C@@H]1C[C@@H]2[C@H]3CC[C@H](O3)[C@H]21 2356953598 KMMGVPBOYDWOMV-OVYGPGRDSA-N 272.392 2.309 10 10 CECE [N-]=[N+]=N[C@@H]1CO[C@@H]2[C@@H](OCc3ccccc3)CO[C@H]21 309823908 DGXGTUDIZHVRTO-MROQNXINSA-N 261.281 2.048 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H]1C[C@H]2[C@@H]1[C@@H]1CC[C@H]2O1 2356958506 JAPDPNWEMUPFQN-XJBGLIRHSA-N 276.355 2.287 10 10 CECE COc1cccc(CN2C[C@@H](C)OCC2(C)C)c1O 184791528 YHTUJFODLFNTSC-LLVKDONJSA-N 265.353 2.400 10 10 CECE CCNC(=O)CN(C)c1ccc(/C=C\C(=O)O)c(Cl)c1 312195704 DRDOWWJJOCZMCL-ALCCZGGFSA-N 296.754 2.010 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(C)CCCN1 79517105 MCNGTEKMSJLEDL-KRWDZBQOSA-N 289.423 2.243 10 10 CECE COCCSCCCC(=O)Nc1ccc(N)cc1 35058809 IADBBMUKGKZZRH-UHFFFAOYSA-N 268.382 2.367 10 10 CECE CCN[C@@](C)(C(=O)OCC)c1ccc(N(C)C)cc1 37902575 LMCFPYGKSSFOIV-OAHLLOKOSA-N 264.369 2.140 10 10 CECE CN(C)c1ccc(NC(=O)COc2ccc(N)cc2)cc1 40305367 RTDPWDMAQYMNRB-UHFFFAOYSA-N 285.347 2.352 10 10 CECE Cc1cc(C(=O)NCCCN=[N+]=[N-])ccc1[N+](=O)[O-] 42012916 BFGOLHATXMLBPS-UHFFFAOYSA-N 263.257 2.333 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCO[C@H]1C 130511517 LIROQECBMHIOIV-CABZTGNLSA-N 264.325 2.035 10 10 CECE CCN(CC)c1ccc(CN[C@H](C)C(=O)NC2CC2)cc1 228949443 FJQZXCUVEJLOHL-CYBMUJFWSA-N 289.423 2.290 10 10 CECE CC(C)CCNC(=O)[C@H](C)NCc1ccccc1O 228415183 KHHYHQGUTAVECP-LBPRGKRZSA-N 264.369 2.033 10 10 CECE Cc1cc(Br)c(O)c(CN[C@H](C)CCO)c1 134750688 DGDDZJICMDCNSG-SECBINFHSA-N 288.185 2.324 10 10 CECE C[C@@H](NCCCCCCO)c1ccc(O)cc1O 235207067 OCKXGJOORXTNGH-LLVKDONJSA-N 253.342 2.301 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1O 145426886 XOCCDWVWMPSHJU-NEPJUHHUSA-N 276.296 2.069 10 10 CECE Cc1csc(C[C@@H](NN)c2ccc(N(C)C)cc2)n1 97769508 DWQYBSSUJPBMJW-CYBMUJFWSA-N 276.409 2.265 10 10 CECE CCOc1ccc(NC(=O)COc2ccc(N)cc2)cn1 94983261 PAYXLBDLKSQWDB-UHFFFAOYSA-N 287.319 2.080 10 10 CECE COc1ccc(N(CCCN)C[C@H]2CC[C@@H](C)O2)cc1 231996826 OTVDNSIDDAVGMP-CZUORRHYSA-N 278.396 2.418 10 10 CECE 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2052065984 QTUORAUVMLDFLS-SSDOTTSWSA-N 276.714 2.176 10 10 CECE Nc1ccc(OCC(=O)O[C@H]2CCC[C@@H]2F)cc1 2055286995 RAIDEGOWJKCHLZ-RYUDHWBXSA-N 253.273 2.081 10 10 CECE N[C@@H]1CCc2cc(N3CCC(C4(O)CC4)CC3)ccc21 2187046455 GKGYOQUBKXBEIP-MRXNPFEDSA-N 272.392 2.374 10 10 CECE C[C@@H](O)c1ccc(N2CCC3(CC[C@H]3O)CC2)cc1O 2187423291 KTIOCNYWXKEADZ-IAQYHMDHSA-N 277.364 2.187 10 10 CECE Cc1ccnnc1[C@H](N)c1ccc2c(c1)CCCN2C 2192700971 NXFSJIXRTQHPEM-OAHLLOKOSA-N 268.364 2.216 10 10 CECE CCNCc1ccc(N(C)[C@@H]2COCC2(F)F)c(F)c1 2197030087 SCYNBIYRVPHVMY-CYBMUJFWSA-N 288.313 2.406 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])CCC2CC1C2 2069312576 YVSRJWOWBAKLBC-RTYFJBAXSA-N 252.318 2.008 10 10 CECE COc1ccc(CN[C@H](C)[C@@H](OC)C(F)(F)F)c(O)c1 2197334292 ZBZOSECPJQQLGG-PRHODGIISA-N 293.285 2.456 10 10 CECE C[C@H](N[C@H](CC(=O)O)C(F)F)c1ccccc1O 2072485477 VDCCURDGTDIHRL-IONNQARKSA-N 259.252 2.151 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC(CCCN)C1 2078783706 QVCDXXPJVHFINP-SNVBAGLBSA-N 252.333 2.263 10 10 CECE OC[C@H]1CC[C@@H]1NCc1c(O)cccc1Br 2210355013 GCGBXPTVAPJNSL-KCJUWKMLSA-N 286.169 2.015 10 10 CECE O=C(O)[C@@H]1C=CCCN1Cc1c(O)cccc1Cl 2081095461 ZLNXNXOXRGXKSQ-NSHDSACASA-N 267.712 2.261 10 10 CECE CCN1CCC[C@H](N(C)c2ccc(CO)cc2C)C1 2102510833 XYLQYGYMQKZSLO-HNNXBMFYSA-N 262.397 2.408 10 10 CECE CC[C@H]1CNCCCN1Cc1cc(F)cc(F)c1O 2102923006 KJIVYMJJZNGABW-LBPRGKRZSA-N 270.323 2.244 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)c(Cl)c1 2082888373 SBPUGAMHCYWUQR-AGSIJNCFSA-N 267.756 2.210 10 10 CECE Cc1cccc(CNC(=O)C2(CCF)CC2)c1O 2084067204 AXNBIEQRHUEGSY-UHFFFAOYSA-N 251.301 2.457 10 10 CECE Cc1cccc(O)c1CN[C@@H]1CCN2CCCC[C@@H]12 2104513593 XKFDIWMRVZBARJ-CABCVRRESA-N 260.381 2.417 10 10 CECE COc1ccc(N2CCCNCC(F)(F)C2)c(C)c1 2106383993 TXMLYYBTWHPGQF-UHFFFAOYSA-N 270.323 2.439 10 10 CECE CN(C)c1ccc([C@H](COC2CCCC2)NN)cc1 2106826230 RHNPBDZKVKCLIK-HNNXBMFYSA-N 263.385 2.216 10 10 CECE CCN(CC)c1ccc([C@@H](O)c2cnn(C)c2)cc1 2106819521 AERHPZZBTCPEHJ-OAHLLOKOSA-N 259.353 2.348 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@H](COC)OC)cc1 2106829763 ZPQHNAKBZJBBLV-CABCVRRESA-N 266.385 2.194 10 10 CECE Cc1cccc(O)c1CN1CCC[C@]2(CCNC2)C1 2107030042 NGWUVTZOPVPTDA-MRXNPFEDSA-N 260.381 2.276 10 10 CECE CC(F)(F)[C@@H]1C[C@@H]1CNC(=O)Cc1ccc(N)cc1 2108172340 VKVWXLVOWBVOAB-ZYHUDNBSSA-N 268.307 2.219 10 10 CECE Oc1cccc(CNCCOC2CCSCC2)c1O 2088590524 OLVGXTCXCYYWPP-UHFFFAOYSA-N 283.393 2.100 10 10 CECE O=C(N[C@@H]1C[C@@H]2CCC[C@@H]2C1)c1cccc(O)c1O 2108701950 PRCSKHWDMVRZAK-URLYPYJESA-N 261.321 2.406 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H](O)C3(CCC3)C2)cc1 2108773257 AFCPXGRGIZQUHN-LSDHHAIUSA-N 260.381 2.448 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H]3C[C@]3(CO)C2)cc1 2090118606 IMLHUVFDYDQIEM-CWRNSKLLSA-N 260.381 2.176 10 10 CECE CNCc1ccc(N2C[C@H](C3CC3)[C@@H](O)C2)cc1Cl 2090683246 AIIFPQQBITYQFS-HIFRSBDPSA-N 280.799 2.267 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H](N)Cc2cccs2)cc1 2091350641 CEHBLZNXUHMVJY-HUUCEWRRSA-N 276.405 2.418 10 10 CECE C[C@H]1CC[C@@H](CNC(=O)COc2ccc(N)cc2)S1 2095323741 MHLABYPDZMEYSQ-GWCFXTLKSA-N 280.393 2.048 10 10 CECE Cc1ccc([C@H](C)NCCc2ccnnc2)c(O)c1 2095536015 PDQRBBCUNUIVFQ-LBPRGKRZSA-N 257.337 2.384 10 10 CECE Cc1ccc(O)c(CN2CCSC(C)(C)[C@H]2C(=O)O)c1 2201084782 CGYKUUIHAZPCSK-CYBMUJFWSA-N 295.404 2.481 10 10 CECE C[C@@H](N[C@@H](CO)CC(C)(F)F)c1ccc(O)cc1O 2113231452 SFIOYPPORIAURP-RKDXNWHRSA-N 275.295 2.155 10 10 CECE OCc1ccc(N2CCC[C@H](n3cccn3)C2)cc1 2114782544 YTCVLFUIDHZDPJ-HNNXBMFYSA-N 257.337 2.217 10 10 CECE CC[C@@H]1CC[C@@H](CNC(=O)CCc2ccc(N)cc2)O1 2201430459 RETWHTNMWLPZRC-CABCVRRESA-N 276.380 2.275 10 10 CECE C[C@H](N[C@@H]1C[C@@]12C[C@@H]2C(=O)O)c1ccc(F)cc1O 2268054233 WBTFQBYUBGIWJK-XWURXSNNSA-N 265.284 2.045 10 10 CECE COc1cc(N2CCCOCC2)ccc1C=CC(=O)O 2204556400 DDWWQKZIQGMZFU-UHFFFAOYSA-N 277.320 2.020 10 10 CECE COc1cc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)ccc1CO 2204551693 YHOQYUAHOCGTJG-GVAFMPQTSA-N 271.360 2.446 10 10 CECE CCNCc1ccc(N2CCC[C@@H]2[C@@H](C)O)cc1OC 2204558949 JJBXLICBWCREDY-IUODEOHRSA-N 278.396 2.154 10 10 CECE Cc1ccc(CN2CC[C@@H](C(F)(F)F)[C@@H](N)C2)c(O)c1 2204640143 WLTRQDLBCBARQX-NEPJUHHUSA-N 288.313 2.412 10 10 CECE COc1ccc(N(C)[C@H]2CCSC2)c(CN)c1 2214845392 AURBRRKVEIUOKR-NSHDSACASA-N 252.383 2.096 10 10 CECE COc1ccc(N2CC(C)(C)OC[C@H]2C)c(CO)c1 2268775098 IEHXSLGUJZUUJH-LLVKDONJSA-N 265.353 2.191 10 10 CECE COc1ccc(N2CC[C@H](C(C)(C)O)C2)cc1F 2219610060 QMBDHAIVPBLIOZ-JTQLQIEISA-N 253.317 2.432 10 10 CECE OCc1ccc(N2CC[C@@H](OC(F)(F)F)C2)c(F)c1 2230725500 SMAXMNKWKAVUIE-SECBINFHSA-N 279.233 2.433 10 10 CECE CC1(C)NC(=O)O[C@@H]1CN1CCC[C@@H](N=[N+]=[N-])CC1 2230848355 HLDUWGDJIVGYRM-NXEZZACHSA-N 267.333 2.038 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H]2CN(C)C[C@H]2C1 2232023458 YKCPUFSGHZOGNZ-SNPRPXQTSA-N 259.397 2.013 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1OC[C@@H]2CCC[C@H]21 2224957314 GIXQMYOQSWPMHJ-LNSITVRQSA-N 265.328 2.436 10 10 CECE CN1CCCc2cc(N3C[C@@H]4CC[C@@H](O)[C@H]4C3)ccc21 2235044530 ZKPZXGSCNNUCRS-JLJPHGGASA-N 272.392 2.276 10 10 CECE COC[C@@](C)(CO)N(C)c1ccc2c(c1)C(C)(C)CO2 2235045675 LLAWMXLSHLEDHC-MRXNPFEDSA-N 279.380 2.190 10 10 CECE CC(C)[C@@](C)(CC(=O)NCCCCN=[N+]=[N-])C(=O)O 2225794254 DKGUDFZNPKVIHS-GFCCVEGCSA-N 270.333 2.330 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NS(=O)(=O)c1cccc(F)c1 2225798545 JMLVPVSTDWWCOS-GHMZBOCLSA-N 284.316 2.335 10 10 CECE COc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)c(C(=O)O)c1 2235945222 CIXRZOUGWLDIEM-IAZYJMLFSA-N 283.274 2.341 10 10 CECE COc1ccc(N2CCOC(C)(C)[C@H]2C)c(CCN)c1 2235968348 QQIQGMPKXSCFTI-GFCCVEGCSA-N 278.396 2.200 10 10 CECE COC[C@@H]1[C@@H]2CCN(c3ccc(OC)cc3C=O)C[C@H]21 2235984703 CDMUWKZNVLZHAB-RBSFLKMASA-N 275.348 2.226 10 10 CECE CNCc1cc(OC)ccc1N1C[C@H](C)[C@H](O)C[C@H]1C 2235977374 QCGHICYHAAKCLD-HWWQOWPSSA-N 278.396 2.010 10 10 CECE COc1ccc(N2CC[C@]3(CCC[C@H]3O)C2)c(C=O)c1 2236004663 OGUYJKDHHQYXHF-HZPDHXFCSA-N 275.348 2.249 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2C[C@]12COC[C@H](C1)C2 2236356782 WLOJJUFEOIXFPC-XNJGSVPQSA-N 272.392 2.495 10 10 CECE Cc1c(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])cnn1C1CC1 2236643173 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COC(=O)[C@](C)(NCCN=[N+]=[N-])c1ccc(F)c(C)c1 2240782475 WBVLHDFKRPNAEV-CYBMUJFWSA-N 280.303 2.422 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](O)C(F)(F)C2)c(C)c1 2240834323 YOODHJOJPZWMPC-RISCZKNCSA-N 284.350 2.482 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCC[C@@H](OCCO)C1 2240839749 JOXWFJAFICUCDR-DZGCQCFKSA-N 279.380 2.026 10 10 CECE CSc1ncc(CNCc2ccc(CN)nc2)s1 2257137565 VPIGGRSGKFCEDB-UHFFFAOYSA-N 280.422 2.009 10 10 CECE Oc1ccc(CN[C@@H]2CCC[C@@H]2CF)c(O)c1O 2260443562 LLBQSZMZVVDVOE-PSASIEDQSA-N 255.289 2.031 10 10 CECE C[C@@]1(CNCc2ccc3c(c2)CCO3)CCC[C@H]1O 2271293545 OUIGYSKPHLMINU-CVEARBPZSA-N 261.365 2.262 10 10 CECE CN(Cc1ccccc1O)c1ncnc2cc[nH]c12 2273001308 OZUPOHQFAAOWPT-UHFFFAOYSA-N 254.293 2.300 10 10 CECE FCOc1ccc(N2CCNCC23CCC3)cc1 2263908431 IMFFICXGLAXLGR-UHFFFAOYSA-N 250.317 2.325 10 10 CECE C[C@H]1C[C@@H]1CCCCn1ccc2c(c1=O)CNCC2 2265785621 PUIRCENQKYOJNK-JSGCOSHPSA-N 260.381 2.320 10 10 CECE O=C(C[S@](=O)CC1=CCCC1)c1ccc(O)c(O)c1 2278768424 CGZYRJBQLKNYKL-LJQANCHMSA-N 280.345 2.140 10 10 CECE CCN1C(=O)NC(=Cc2ccc(N3CCCC3)cc2)C1=O 2293861299 ZFILDIFGNWEYJR-UHFFFAOYSA-N 285.347 2.199 10 10 CECE COc1ncc(F)cc1[C@@H](O)CCc1ccc(N)cc1 2295377962 KPKAHCKKSRIUHZ-AWEZNQCLSA-N 276.311 2.478 10 10 CECE Nc1ccc(CCN2CCC3(CC[C@@H](O)C3)CC2)cc1 2288006662 YTOQIPFJYWFSCI-MRXNPFEDSA-N 274.408 2.438 10 10 CECE O=C(NCc1ccccc1Cl)c1cc(O)c(O)c(O)c1 586734141 OXASNSFSOXQCCE-UHFFFAOYSA-N 293.706 2.387 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)c1ccc(Cl)o1 2300530835 XBYBQFNZVVSQJT-UHFFFAOYSA-N 278.721 2.254 10 10 CECE Cc1cc(N(C)Cc2snnc2C)ccc1CN 2314388242 UFSURJPPVOFOCF-UHFFFAOYSA-N 262.382 2.250 10 10 CECE CNCc1ccc(N(C)[C@H](CO)C(C)C)c(C)c1 2318849053 KQZOUDGCLNSANI-OAHLLOKOSA-N 250.386 2.168 10 10 CECE CCC[C@](C)(C(=O)O)N(C)Cc1ccccc1O 2323713845 DYERVICSKNITMU-CQSZACIVSA-N 251.326 2.467 10 10 CECE CC(C)OC(=O)c1cccc(N=NN2CCNCC2)c1 2330234232 JJMGNIFMFCMENP-UHFFFAOYSA-N 276.340 2.156 10 10 CECE CNCc1ccc(N(C)C[C@@H]2C[C@@H]3CC[C@H]2O3)cc1 2329976000 GXHCJMZZGIZLNL-CWRNSKLLSA-N 260.381 2.410 10 10 CECE 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2.364 10 10 CECE CN1CCc2cc([C@@H](NN)[C@@H]3C[C@H]3C(F)(F)F)ccc21 2354609507 GQDFSOAZCUWLCD-NQBHXWOUSA-N 285.313 2.382 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1C[C@@H]2CNC[C@@H]21 2355448405 DYBTZNPHOCVXIF-IWCQGFGOSA-N 272.392 2.176 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@@H]4C[C@H](O)[C@H]3C4)ccc21 2356172273 PWGUWMKMQKMMPB-QYHDQYMBSA-N 272.392 2.243 10 10 CECE Nc1ccc(N2CCN(CCc3ccccn3)CC2)cc1 57896148 KRLYEJTUMBUOEI-UHFFFAOYSA-N 282.391 2.029 10 10 CECE CN1CCCc2cc(CNCCc3cnn(C)c3)ccc21 112346424 UEJDQPASPCEGOS-UHFFFAOYSA-N 284.407 2.135 10 10 CECE [N-]=[N+]=NCCCSc1nnnn1-c1ccccc1 42416405 UIWIJJGHSZBZBC-UHFFFAOYSA-N 261.314 2.455 10 10 CECE Cc1ccc(CN(C)c2cc3c(cc2N)OCC(=O)N3)o1 35699179 ZJMOWKSBOKFSBO-UHFFFAOYSA-N 287.319 2.138 10 10 CECE COc1nccc(N(C)C)c1NCc1ccc(O)cc1O 36941708 POZJBKLOJKUDEE-UHFFFAOYSA-N 289.335 2.180 10 10 CECE C[C@@H](Cc1cc(O)c(O)c(Br)c1)C(=O)O 211463376 NEXXXZWHWQEUAZ-YFKPBYRVSA-N 275.098 2.124 10 10 CECE Cc1ccc([C@@H](C)NCCCN2CCCC2=O)c(O)c1 184889042 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CC(C)(C)OC(=O)NCCCNCc1ccccc1O 105433516 JZUHSYNGNMXXGQ-UHFFFAOYSA-N 280.368 2.397 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)N1CCC[C@@H]2CCCC[C@H]21 1912156165 LFEXDMMNJXEKSR-QWHCGFSZSA-N 279.388 2.410 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)c2cncnc2)C1 1912176790 DXFVQHFLEQCALY-SNVBAGLBSA-N 260.301 2.029 10 10 CECE Cc1noc(C)c1CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1912191534 SKDUFTKRNPVTGN-LLVKDONJSA-N 277.328 2.383 10 10 CECE CCOC(=O)[C@@H](C)CN1CCC[C@H](CN=[N+]=[N-])C1 1912188058 LTWUVXSGBLEMDK-WDEREUQCSA-N 254.334 2.208 10 10 CECE Cc1ccc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)cc1[N+](=O)[O-] 1912146341 RAQGBGYHMAZPGH-JTQLQIEISA-N 275.268 2.428 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)Cc2ccsc2)C1 1912196541 WENODACTXZUSJW-SNVBAGLBSA-N 250.327 2.449 10 10 CECE C[C@H](C(=O)N1CCCC1)N1CCC[C@@H](CN=[N+]=[N-])C1 1912144642 WNFJWSMYRDCDMI-NEPJUHHUSA-N 265.361 2.020 10 10 CECE COc1cc(CN2CCC(N=[N+]=[N-])CC2)sn1 1912158968 BKYCARDQAFMRQX-UHFFFAOYSA-N 253.331 2.426 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2cc(O)ccc2O)C1 1912196300 UIWVGASITZWGKR-VIFPVBQESA-N 276.296 2.260 10 10 CECE C[C@@H]1C[C@@H](C)CN(CCN2CC[C@H](N=[N+]=[N-])C2)C1 1912204648 BVCNTLBSAQBQKV-UPJWGTAASA-N 251.378 2.349 10 10 CECE Cc1cc(C(=O)N2CCCC[C@@H](CN=[N+]=[N-])C2)n(C)n1 1912203476 QQUODZJCZAGRDA-NSHDSACASA-N 276.344 2.281 10 10 CECE CC(C)[S@@](C)(=O)=NC(=O)CCOc1ccc(N)cc1 1913895616 JSSQQFSVEPXUDI-LJQANCHMSA-N 284.381 2.071 10 10 CECE C[C@H](N=[S@](C)(=O)C(C)(C)C)C(=O)Nc1ccc(N)cc1 1913860706 FBLXRMWYNJXQJK-WVDJIFEKSA-N 297.424 2.492 10 10 CECE CC[S@@](C)(=O)=NCCCC(=O)Nc1ccc(N)cc1 1913883639 DUTFMOPIEAEQAN-LJQANCHMSA-N 283.397 2.105 10 10 CECE C[C@]1(C(=O)NCCCN=[N+]=[N-])C[C@H]1C(F)(F)F 1950711792 WIOFFIOAJQNYEC-SVRRBLITSA-N 250.224 2.392 10 10 CECE C[C@@H]1CC[C@H](C(=O)O)N(Cc2c(O)cccc2F)C1 2136364682 QDIRWINJKGWBGA-BXKDBHETSA-N 267.300 2.216 10 10 CECE C[C@@]1(CNCc2ccc(F)c(F)c2O)CSCCO1 2136567464 IVDIKZYLUKGVFM-CYBMUJFWSA-N 289.347 2.282 10 10 CECE CN(C)[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(N)cc1 1921767154 BNSAYRJRVANLHH-KBPBESRZSA-N 276.384 2.263 10 10 CECE N=C1/C(=C/c2c[nH]c3ccccc23)C(=O)N=C2SC=NN12 465884 UQUWWAURWOUQNC-NRBJTAHNSA-N 295.327 2.417 10 10 CECE CC[C@H]1CC[C@@H](CNCc2c(O)cccc2OC)O1 2136772268 OTAWISRKPVHFAA-RYUDHWBXSA-N 265.353 2.448 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H](N)C3)c(F)c1F 2136984201 PZOIGAUZPOGPKF-ILWJIGKKSA-N 268.307 2.432 10 10 CECE CN(C)C1(CNCc2ccc(Cl)cc2O)CC1 1560893705 UXUCARVYAWGJLA-UHFFFAOYSA-N 254.761 2.229 10 10 CECE CCC(CC)[C@H](O)CNC(=O)CCc1ccc(N)cc1 230442347 WMEACYZDWYIOPS-OAHLLOKOSA-N 278.396 2.115 10 10 CECE CCN(C)c1ccc(CN2CC[C@]3(CCOC3=O)C2)cc1 1648658079 PGUXBFWPGBXYLN-KRWDZBQOSA-N 288.391 2.282 10 10 CECE Cc1ccsc1C(=O)NCc1ccc(O)cc1O 1643101140 WNBZNGYJRJDARU-UHFFFAOYSA-N 263.318 2.398 10 10 CECE Cn1ncc2c(NCc3cccc(Cl)c3O)ncnc21 1651506797 AAQUHIBCHFSLAV-UHFFFAOYSA-N 289.726 2.334 10 10 CECE CCCN(CCC)[C@@H](CN)c1ccc(O)cc1O 32022495 OVHRFJDZPPDMFP-ZDUSSCGKSA-N 252.358 2.220 10 10 CECE CCC(O)(CC)CN(C)c1ccc(CO)c(OC)c1 2139685558 QQXBTYRANNYIOT-UHFFFAOYSA-N 267.369 2.175 10 10 CECE CCN1CCN(c2ccc(CN)c3ccccc23)CC1 233495077 NZJVMCBKLKWRAE-UHFFFAOYSA-N 269.392 2.440 10 10 CECE CC(C)(C)[C@H]1CCN(C[C@H](O)COc2ccc(N)cc2)C1 158495532 VKXHSZJLRVJYMX-ZFWWWQNUSA-N 292.423 2.377 10 10 CECE Oc1cc2c(cc1CN1CC[C@@]3(CCOC3)C1)CCC2 151286054 NZHOEXRERRIMKG-QGZVFWFLSA-N 273.376 2.493 10 10 CECE C[C@H](C(=O)NCc1ccc(N(C)C)cc1)C1CCOCC1 159733579 RNYUGNUUKBLJJD-ZDUSSCGKSA-N 290.407 2.432 10 10 CECE CN(C)CCCN=NNc1ccc2c(c1)OCO2 1860489775 CPHVGAHJVPTHMN-UHFFFAOYSA-N 250.302 2.146 10 10 CECE COc1ccc(N(C)C[C@@H]2CCCN2)c(OC)c1C 258896375 LYCNOANEEROFOY-LBPRGKRZSA-N 264.369 2.200 10 10 CECE CN(CCc1ccncc1)c1ccc(CN)c(F)c1F 234296788 JYFNDTAHKRSWAM-UHFFFAOYSA-N 277.318 2.497 10 10 CECE CC[C@H](NC(=O)c1cccc(O)c1O)c1nccs1 126440473 CTDPXAVFSFUVOI-VIFPVBQESA-N 278.333 2.435 10 10 CECE Cn1cnc(CCNCc2ccc3c(c2)CCCO3)c1 922178053 PZIOKZUDXDRGTC-UHFFFAOYSA-N 271.364 2.077 10 10 CECE C[C@H](NC(=O)[C@@]1(C)CCCOC1)c1ccccc1O 827969166 JBRAUCNAJAKMLJ-NHYWBVRUSA-N 263.337 2.386 10 10 CECE CC[C@H](NC(=O)Cc1ccc(N)cc1)[C@H]1CCCCO1 848442299 BAKCBITUDHOAII-LSDHHAIUSA-N 276.380 2.275 10 10 CECE Cc1cc(C(=O)O)c(NC(=O)c2ccc(O)c(O)c2)s1 235848124 KDSIPOXZCLCLAK-UHFFFAOYSA-N 293.300 2.418 10 10 CECE C[C@H](NC[C@@H](C)CN1CCOC1=O)c1ccccc1O 1876047288 VGTOQCQIKYUBOP-NEPJUHHUSA-N 278.352 2.131 10 10 CECE Oc1cc(F)ccc1CNCCOC(F)(F)F 1964562811 SVNUMNYGDMRXQV-UHFFFAOYSA-N 253.195 2.157 10 10 CECE CN(Cc1ccccc1O)c1cnccc1C(N)=S 1877518487 VFDHJGCLKDWWCX-UHFFFAOYSA-N 273.361 2.058 10 10 CECE CCNc1cc(N(C)Cc2ccccc2O)ncn1 1877544321 DDXXEMUPBWIWEN-UHFFFAOYSA-N 258.325 2.250 10 10 CECE C[C@@H](c1ccccc1O)N(C)CC(C)(C)C(=N)NO 1877538096 KWLLUQIBDFOWDS-JTQLQIEISA-N 265.357 2.367 10 10 CECE CN(Cc1ccccc1O)c1ccc(N)c(N)c1F 1877532987 MWHMYCCJYHIXRO-UHFFFAOYSA-N 261.300 2.332 10 10 CECE Oc1c(F)cc(F)cc1CNCCCc1nncs1 1877899163 ZRKIGTHHRDEAKE-UHFFFAOYSA-N 285.319 2.244 10 10 CECE CN(C)C(=O)[C@H]1CCCN(c2ccc(CN)cc2Cl)C1 2143702315 FMMUEMHWFLINNI-LBPRGKRZSA-N 295.814 2.103 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@]23CCOC3)c(F)c1 1880479658 PASKFQGAUVKDII-XPTSAGLGSA-N 269.291 2.387 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCO[C@@H](CF)C2)c(F)c1 1880491361 VSDYBNCUVDEBPV-SCZZXKLOSA-N 275.270 2.193 10 10 CECE CCC[C@@H](C(=O)O)N(C)Cc1ccc(F)cc1O 1964723424 FSQIWBNIGWRYDR-NSHDSACASA-N 255.289 2.216 10 10 CECE O=C1CN[C@H](c2c(O)c(Cl)cc(Cl)c2Cl)CN1 1951859746 LCNNFFXHWWEUNV-LURJTMIESA-N 295.553 2.113 10 10 CECE CC(C)N(CCCC(=O)N(C)C)c1ccc(CN)cc1 43448132 DNJDUBREXVCWNQ-UHFFFAOYSA-N 277.412 2.229 10 10 CECE COc1ccc(CN(C)c2ccc(CN)cc2)cn1 1967635497 OBRZMKYUZAAAEO-UHFFFAOYSA-N 257.337 2.185 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCC3(CC2)CNC3)c1 2145085878 YEGJKVRVLVEADA-GFCCVEGCSA-N 276.380 2.147 10 10 CECE Oc1ccc(Br)cc1CN1CCN[C@@H]2CC[C@H]21 2002922321 ZNUWKSLRFWBEDY-VXGBXAGGSA-N 297.196 2.091 10 10 CECE CC1([C@@H](CO)NCc2ccc3c(c2)CCCO3)CC1 1967841467 ISZTXDIBWFFVJJ-OAHLLOKOSA-N 261.365 2.262 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)OCCO3)[C@H](C)[C@H]1C 252594115 GHXKIXXZLIAZEB-YRGRVCCFSA-N 276.380 2.281 10 10 CECE O[C@@H](CC1OCCO1)c1ccc(N2CCCC2)cc1 1977933823 HGPHGIYNYYLQKT-AWEZNQCLSA-N 263.337 2.083 10 10 CECE COc1cc(F)c(O)c([C@H]2CCCCN2)c1OC 258286584 BEGUBGWHARVOFB-SECBINFHSA-N 255.289 2.363 10 10 CECE Oc1cc(Cl)ccc1CNCc1cnsn1 1979643228 JNKUUKQHTDWEAJ-UHFFFAOYSA-N 255.730 2.187 10 10 CECE [N-]=[N+]=NCCCN1CCO[C@@H](c2nccs2)C1 2004438837 MKMOQZCKSGBLHS-SECBINFHSA-N 253.331 2.217 10 10 CECE Oc1c(Br)cccc1CNCc1ncco1 1987057084 VJMNRGHAEJRZKS-UHFFFAOYSA-N 283.125 2.433 10 10 CECE CNCc1cc(F)c(N2CC(C)(C)C[C@@H]2CO)c(F)c1 2151105807 INLZOLOJSGUKNG-LLVKDONJSA-N 284.350 2.281 10 10 CECE CCC[C@](C)(N)C(=O)N(C)[C@H](C)c1ccccc1O 37826577 NPTJRMROYTXFIH-ABAIWWIYSA-N 264.369 2.429 10 10 CECE Nc1ccc(OCCC(=O)NCCc2cccs2)cc1 40294353 WQCLASKQYHRTHM-UHFFFAOYSA-N 290.388 2.458 10 10 CECE COc1cccc(O)c1CNCCCCn1ccnc1 2160736300 OHKOSXBQBSGLGO-UHFFFAOYSA-N 275.352 2.167 10 10 CECE CC[C@H]1CN(C)CCCN1Cc1c(O)cccc1OC 2160714675 RMAIEKSDSLGRGP-ZDUSSCGKSA-N 278.396 2.317 10 10 CECE 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10 CECE CN(c1cc2c(cc1F)[C@H](O)C(=O)N2)C1(C)CCC1 1879608898 TZHXGHGMXABVTH-LBPRGKRZSA-N 264.300 2.190 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@H](O)[C@@H](C)C2)c(F)c1 1880482023 LQQVBINKLGNCHN-MWODSPESSA-N 271.307 2.225 10 10 CECE C[C@H](O)c1cc(F)c(N2CC=CC[C@H]2CO)c(F)c1 1880487836 IVXUNUGLZCSLRD-ONGXEEELSA-N 269.291 2.145 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCC(CO)CC2)c(F)c1 1880924219 PANSQRLSHGZNGN-SECBINFHSA-N 270.323 2.193 10 10 CECE CC(C)[C@H](CN[C@@H](C)c1ccc(O)cc1O)N(C)C 20145664 NGFNHDBLRXJKSS-FZMZJTMJSA-N 266.385 2.335 10 10 CECE C[C@@H]1[C@H](NCc2ccccc2O)CN1C(=O)OC(C)(C)C 1885890117 VVXCJRSZRUFKKK-DGCLKSJQSA-N 292.379 2.490 10 10 CECE CC(C)=C(F)CNC(=O)CCOc1ccc(N)cc1 1888200300 ITFHUKLKMMPUPQ-UHFFFAOYSA-N 266.316 2.417 10 10 CECE N[C@@H](CCCC(=O)O)c1c(O)cccc1Br 1951741624 ZJDPZCCERRQJBL-QMMMGPOBSA-N 288.141 2.409 10 10 CECE CC(C)(C)OC(=O)N1CC[C@H](CN=[N+]=[N-])C(=O)C1 1952077919 QUNLKPDUMWLWTH-MRVPVSSYSA-N 254.290 2.123 10 10 CECE CN[C@@H](COC)c1cc(Br)cc(OC)c1O 1952354248 OJDHYDOAPZKQMB-VIFPVBQESA-N 290.157 2.070 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H]2CCN(C)C2)c(F)c1 251349193 GCTJLUCKTQYKCI-STQMWFEESA-N 279.403 2.494 10 10 CECE CN(C)c1ccc(CNC[C@H](CO)C(F)(F)F)cc1 1967743772 SCTBWXJQSDUIDH-LLVKDONJSA-N 276.302 2.013 10 10 CECE COc1cccc(CN2C[C@H](OC)C(C)(C)C2)c1O 1967789414 DVRIHMOBBJEABN-ZDUSSCGKSA-N 265.353 2.258 10 10 CECE CCOc1cccc(CNC[C@@H]2CC=CCO2)c1O 1967855429 KGMBTZPRSLPBNE-ZDUSSCGKSA-N 263.337 2.226 10 10 CECE NCC[C@@H]1CC[C@H](NCc2ccc3c(c2)CCO3)C1 1968002255 UWIMQZCZWYWKMA-WFASDCNBSA-N 260.381 2.229 10 10 CECE CC[C@@H]1CN(Cc2c(O)cccc2F)CCN1C 1969372602 GQTYMLJXTMBYKN-LLVKDONJSA-N 252.333 2.057 10 10 CECE C[C@@H](NC[C@@H]1CCCC(=O)N1)c1ccc(N(C)C)cc1 1970805961 RGXNLVORQOQUHO-OCCSQVGLSA-N 275.396 2.072 10 10 CECE CC[C@H]1CCN([C@H](CN)c2ccc(N(C)C)cc2)C1 252844230 DMRLVKIAXHJIQF-XJKSGUPXSA-N 261.413 2.484 10 10 CECE CNCc1ccc(N2CCn3nc(C)cc3C2)c(C)c1 2146182496 AADJOYCTFRFUNB-UHFFFAOYSA-N 270.380 2.240 10 10 CECE Oc1cc(Cl)ccc1CNC[C@@H]1C[C@@H]2COCC[C@H]2O1 2148971960 GAHYVHKAFLMGKH-OSAQELSMSA-N 297.782 2.329 10 10 CECE COC(=O)c1cc(C2(N)CCCCC2)c(O)cc1O 258403119 KNYYXTBOTFYUHT-UHFFFAOYSA-N 265.309 2.003 10 10 CECE CN(C)c1ccc(CNCCO[C@@]2(C)CCOC2)cc1 2146271881 DIGCKHWPJVNZNS-INIZCTEOSA-N 278.396 2.038 10 10 CECE Nc1ccc(CC[C@H](O)c2cnc3n2CCCC3)cc1 2151140283 BBEZFHPLSAWAHQ-HNNXBMFYSA-N 271.364 2.468 10 10 CECE CCN(c1ccc(CN)cc1)[C@H](C)C(=O)NCC(C)C 34654545 ANEFMBNWMASLPO-CYBMUJFWSA-N 277.412 2.132 10 10 CECE Cc1ncoc1C(=O)N(Cc1ccc(N)cc1)C1CC1 159287398 UAXIFLZCPZHBMF-UHFFFAOYSA-N 271.320 2.370 10 10 CECE C[C@H](NC[C@@H](O)c1ccccc1)c1ccc(O)cc1O 35601299 MIVHQWFRPRLDQE-MEDUHNTESA-N 273.332 2.482 10 10 CECE CN(CCN=[N+]=[N-])Cc1cc2c(ncn2C)s1 2006609184 UAHXXAJUNATDHJ-UHFFFAOYSA-N 250.331 2.377 10 10 CECE CN(Cc1cccs1)C[C@H](O)COc1ccc(N)cc1 35716589 OYYBDUCQSBRJGC-ZDUSSCGKSA-N 292.404 2.202 10 10 CECE Cc1cc(C(N)=O)ccc1NCc1ccc(N)cc1 37732729 RAQTWSVJBBQBSV-UHFFFAOYSA-N 255.321 2.288 10 10 CECE CCCc1nccnc1NCCc1ccc(O)c(O)c1 2148021171 QENMIMJLPFTNTC-UHFFFAOYSA-N 273.336 2.495 10 10 CECE N[C@@H](c1ccccc1O)[C@]1(O)CCOC12CCCCC2 2148164857 QQTFBMSWILMMJT-GOEBONIOSA-N 277.364 2.246 10 10 CECE CN[C@@H](c1cc(C(F)(F)F)n(C)n1)c1ccccc1O 2158703744 YVNJIAPYVKTKHI-GFCCVEGCSA-N 285.269 2.453 10 10 CECE COc1ccc(O)c([C@H](C)N2CCC[C@H](CN)C2)c1 44527576 WGIVBHJBKOGONV-NWDGAFQWSA-N 264.369 2.133 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N3CC(SC)C3)ccc21 2153905932 WOJIZGXXGHIDRU-CQSZACIVSA-N 291.420 2.231 10 10 CECE C[C@H](O)c1ccc(N2CCn3ncc(Cl)c3C2)cc1O 2154039598 ZRBWJJWEWBOGRV-VIFPVBQESA-N 293.754 2.316 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@@H]1CCC12CCC2 2154894094 BQRGPXRXDQWJNY-KGLIPLIRSA-N 272.348 2.441 10 10 CECE OCC(F)(F)CCNCc1c(O)cccc1Cl 2012613950 APFZMAPKSDTUAU-UHFFFAOYSA-N 265.687 2.153 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2ccccc2C(N)=O)CC1 2155560924 OWMKMPYBNDJIIL-LBPRGKRZSA-N 273.340 2.450 10 10 CECE CCc1nc(CSc2nccs2)cc(=NC)[nH]1 2018221559 XOQQGFSGAZVGIX-UHFFFAOYSA-N 266.395 2.251 10 10 CECE COCCSCCN[C@H](C)c1ccccc1O 2024835011 WCUZSYCUYYWVAJ-LLVKDONJSA-N 255.383 2.422 10 10 CECE CC[C@@H](C)N1CCN(CCOc2ccc(N)cc2)CC1 55063417 WNEASPOLFDBHPI-CQSZACIVSA-N 277.412 2.064 10 10 CECE COCCOC[C@@H]1CCN(Cc2ccc(F)cc2O)C1 295245309 FKOPLWFEDFOERQ-GFCCVEGCSA-N 283.343 2.016 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)c1scnc1Cl 2031157646 GSCXJVXZGMYDJG-NXEZZACHSA-N 284.768 2.496 10 10 CECE COCCC1CN(c2ccc([C@@H](C)O)cc2F)C1 2034797279 IVLISZUXUFSFEO-SNVBAGLBSA-N 253.317 2.352 10 10 CECE C[C@@H]1CCN(C(=O)Nc2ccc(N)cc2)C[C@@H]1F 2034801655 GPYMBRNCYFTCOA-SKDRFNHKSA-N 251.305 2.481 10 10 CECE COC1(CNCc2ccc(O)cc2O)CCCC1 311175148 TXWSSPBXZHIDHS-UHFFFAOYSA-N 251.326 2.147 10 10 CECE COC(=O)C(C)(C)CN[C@@H](C)c1ccc(OC)cc1O 312221077 DUPCOQAADGTDHQ-JTQLQIEISA-N 281.352 2.251 10 10 CECE CC(C)CNC(=O)CN(C)[C@@H]1CCc2cccc(O)c21 312825447 NGIKXXBDMFUCGN-CYBMUJFWSA-N 276.380 2.084 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)CSc1ccncc1 701302790 GDFIIYSUMLPWRS-JTQLQIEISA-N 277.353 2.475 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N1CCN2C(=O)OC[C@@H]2C1 2170719614 DDLWEFZNLPJIED-KOLCDFICSA-N 296.754 2.243 10 10 CECE C[C@H](NC[C@H]1CCCC[C@@H]1O)c1ccc(O)cc1O 85962865 ZVYDQJMRAUTPBU-WDMOLILDSA-N 265.353 2.300 10 10 CECE CNCc1ccc(N(C)C[C@@]23COC[C@H]2C3(F)F)cc1 2161868703 DHTFMQZWMZDEAM-ZIAGYGMSSA-N 282.334 2.124 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@H]1CCCCNC1=O 2171241796 OGDNLFQHYUPCMP-MFKMUULPSA-N 280.343 2.193 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@]1(C)CNC[C@@H]1C 702386754 VAYCUOBSGDRFQA-HWWQOWPSSA-N 276.380 2.157 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCCC[C@H]1CF 2171878127 SPWHOMOFDUBQKL-FZMZJTMJSA-N 279.359 2.420 10 10 CECE CCc1cccc(CN2CCN(C)[C@H](CC)C2)c1O 709289800 JIQTYFUDHICANN-OAHLLOKOSA-N 262.397 2.481 10 10 CECE COc1ccc(N2CCCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])c1 688056259 XRTYQKUYOKIBLQ-CMPLNLGQSA-N 280.324 2.343 10 10 CECE NC[C@@H]1CN(c2ccc3c(c2)CCO3)C[C@@H]1C(F)(F)F 2162649046 XKXPDZFOFWGOSQ-PWSUYJOCSA-N 286.297 2.195 10 10 CECE CN(c1c(F)cc(CN)cc1F)C(C)(C)CCO 688385515 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CECE Cc1cc(N2C[C@@H](O)C[C@@H]2C)ccc1CNC1CC1 384768832 CVFSBAQLCWRXLX-LRDDRELGSA-N 260.381 2.207 10 10 CECE Oc1ccc(CNCc2cnc(Cl)s2)c(O)c1 718201611 WCEPCAFVDIXXHD-UHFFFAOYSA-N 270.741 2.498 10 10 CECE C[C@@H]1CO[C@H](C(=O)N(C)[C@H](C)c2ccccc2O)C1 718489677 XWNUIJGQPCLGON-WDMOLILDSA-N 263.337 2.337 10 10 CECE C[C@@H](NCc1cccc(O)c1O)[C@@H]1CCCCO1 393600629 QRIFIYUPJVPVQB-MFKMUULPSA-N 251.326 2.145 10 10 CECE COc1ccc(N(C)C[C@@H](C(N)=S)C2CC2)cc1 397415662 RGNKSNQLCCXKEN-CYBMUJFWSA-N 264.394 2.444 10 10 CECE COc1ccc(N2C[C@H](C)CC[C@H]2CO)c([N+](=O)[O-])c1 2166924840 PFVDITMJTXPDAY-MNOVXSKESA-N 280.324 2.201 10 10 CECE CC[C@@H](O)c1ccc(N2CCO[C@@H](C(C)(C)O)C2)cc1 2174154132 PWNMVEYROLYFPG-HUUCEWRRSA-N 279.380 2.106 10 10 CECE Nc1ccc(OCCCN2C[C@H](C(F)F)CC2=O)cc1 2174584296 RZXSDMQLSYYFHP-SNVBAGLBSA-N 284.306 2.151 10 10 CECE CCc1cc(CN)n([C@@H](C)c2c(O)cccc2F)n1 2070039026 LCXJCWRYKLYMJW-VIFPVBQESA-N 263.316 2.358 10 10 CECE CN(Cc1ccco1)C(=O)CN1CCC[C@@H]1CN=[N+]=[N-] 2179616238 MWVZWTVZJJTSMD-LLVKDONJSA-N 277.328 2.013 10 10 CECE Nc1ccc(O)c(CN2CCCN(C3CCC3)CC2)c1 2169583826 PQYMXURIDILAKL-UHFFFAOYSA-N 275.396 2.035 10 10 CECE CC(C)N(Cc1ccnn1C)c1ccc(CN)c(F)c1 2170048106 HACJVSYJMFOADA-UHFFFAOYSA-N 276.359 2.433 10 10 CECE CCC[C@H]1COCCN1c1cc(OC)c(OC)cc1N 2170222603 BFJCCKWEJGEYGX-NSHDSACASA-N 280.368 2.291 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CCCCNC1 2178933448 VBMKUSYZOKXVTP-OLZOCXBDSA-N 276.380 2.301 10 10 CECE CCN1CCc2cc([C@@]3(O)CCN[C@H]3C3CC3)ccc21 2188252937 PFQSVOIYMVHEIS-IRXDYDNUSA-N 272.392 2.029 10 10 CECE CC(C)n1ncnc1CN[C@H](C)c1c(O)cccc1O 2196300847 SQIWNCVYISZEGP-SNVBAGLBSA-N 276.340 2.121 10 10 CECE CC(=O)c1ccc(O)c(CN2[C@H]3CCC[C@H]2COC3)c1 2198736392 DFJJNZIGALJJCD-GJZGRUSLSA-N 275.348 2.348 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1cnc(F)c(F)c1 2183246604 ITXILQILTNMNDC-UHFFFAOYSA-N 277.274 2.214 10 10 CECE CCN1CCc2cc(N3C[C@H](N)CC(F)(F)C3)ccc21 2184238920 NOWCMJUWJYYKIA-GFCCVEGCSA-N 281.350 2.242 10 10 CECE C[C@H]1C[C@H](F)CN1Cc1cc2c(cc1O)OCO2 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2.285 10 10 CECE CCCN(CCO)c1ccc(CNC(C)C)cc1 42453086 JPWNARJLYXFXEX-UHFFFAOYSA-N 250.386 2.393 10 10 CECE COC(=O)c1cccc(NC(=O)c2ccc(O)c(O)c2)c1 226952442 AZQFUWWLXISCTO-UHFFFAOYSA-N 287.271 2.137 10 10 CECE COc1ccc(CN[C@@H]2CCCSC2)c(O)c1 135695271 ZQBONDWTXVWIAS-LLVKDONJSA-N 253.367 2.386 10 10 CECE CCCN[C@@H]1CCOC[C@@H]1Sc1nccs1 81897343 NKQWEOJTQIPDBQ-ZJUUUORDSA-N 258.412 2.392 10 10 CECE CCC(C)(C)NC(=O)[C@H](C)NCc1ccccc1O 228415780 TVAJXNNTTNSNEP-NSHDSACASA-N 264.369 2.175 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cccc(F)c1F 90256639 LFXIUANZHUVSOL-JTQLQIEISA-N 270.239 2.079 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CCO[C@H](C)C1 234610993 AULHLJZWZBYNDY-ZJUUUORDSA-N 264.325 2.035 10 10 CECE CCCc1nc(C(=O)N(C)[C@H](C)c2ccccc2O)n[nH]1 95055526 DKGYJERQRZSZKT-SNVBAGLBSA-N 288.351 2.296 10 10 CECE [N-]=[N+]=NCCN[C@@]1(C(N)=O)CCCC[C@@H]1c1ccccc1 97899020 OEMWYFQUZZPURW-HIFRSBDPSA-N 287.367 2.468 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H]2NCCC[C@H]2C1 1237415622 QEOUCTNYORFBOV-ZFWWWQNUSA-N 260.381 2.275 10 10 CECE Cc1c(F)cc(Br)c(O)c1[C@H](N)CC(=O)O 258457489 GTCWBRLZVVXWBH-SSDOTTSWSA-N 292.104 2.077 10 10 CECE CNCN(C)c1ccc(OC)c(Br)c1 258855322 JJUXTHWSYVWBQB-UHFFFAOYSA-N 259.147 2.071 10 10 CECE CCOc1cccc(CN2[C@H]3CC[C@H]2[C@@H](CO)C3)c1O 291035738 YTUUTTRFDAFSQL-RDBSUJKOSA-N 277.364 2.136 10 10 CECE CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)OCC(=O)C(C)=O 808545328 WPACSVRDLVZQAZ-OSMZGAPFSA-N 284.352 2.062 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H](C[C@@H]3O)C2)cc1C 2163568920 PDSCBDHSCIRDTH-KMFMINBZSA-N 274.408 2.312 10 10 CECE CN1CCCc2cc([C@@H](O)C[C@]3(N)CCSC3)ccc21 2163112340 ATSXDRPWXWUNGG-JKSUJKDBSA-N 292.448 2.327 10 10 CECE C[C@H](N)c1ccc(N(C)CC2(S(C)(=O)=O)CCC2)cc1 2167824548 ILYINDTWWSAEPM-LBPRGKRZSA-N 296.436 2.110 10 10 CECE C[C@@H](N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1)c1ccc(O)cc1O 712969481 MOSFSNCVSHBCQA-DRNSDYETSA-N 277.320 2.002 10 10 CECE COCC[C@@H](COC)NCc1cc(Cl)c(F)cc1O 816616085 NWNVVHNFTXREFQ-JTQLQIEISA-N 291.750 2.326 10 10 CECE Oc1ccc(O)c([C@@H](N2CCOCC2)C(F)(F)F)c1 575278878 YYTYBNLTYUUVAZ-LLVKDONJSA-N 277.242 2.033 10 10 CECE CN(c1ccc(CO)c([N+](=O)[O-])c1)[C@@H]1CCC[C@@H]1F 2132057197 AUCRXFFMAWSUNE-NWDGAFQWSA-N 268.288 2.414 10 10 CECE C[C@@H](F)[C@@H]1CCCN1c1ccc(CO)c([N+](=O)[O-])c1 2132057942 KHZPBEIHKNSRAP-SKDRFNHKSA-N 268.288 2.414 10 10 CECE N=C(N)c1cncc(CSc2nccs2)c1 721565069 GTZBGLOFHYMQME-UHFFFAOYSA-N 250.352 2.114 10 10 CECE CC(C)(C)OC(=O)NC1[C@H]2C[C@H]1CN(CCN=[N+]=[N-])C2 1954206944 NXPRKVXRTGUVEV-UWVGGRQHSA-N 281.360 2.142 10 10 CECE COC[C@@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 837172058 PTIBJQQZWOADRF-GFCCVEGCSA-N 293.363 2.295 10 10 CECE CNC[C@@H]1CCCCN1Cc1cc(F)cc(C(C)=O)c1O 903530132 QZYJYCBMJWWGEE-AWEZNQCLSA-N 294.370 2.308 10 10 CECE CC1(C)CC[C@H](CC(=O)NCc2ccc(O)cc2O)OC1 910958019 VUFURVGVEHKDTG-CYBMUJFWSA-N 293.363 2.309 10 10 CECE Cc1cc(O)c(CN(C)CC(=O)NC2CC2)c(Cl)c1 840909702 KXFLOGMDPUSGOR-UHFFFAOYSA-N 282.771 2.064 10 10 CECE COc1ncncc1CNCCCSc1nccs1 842683651 QBMXHRMYOHFQID-UHFFFAOYSA-N 296.421 2.214 10 10 CECE Cc1ccc(C(=O)N[C@H]2C[C@H](OC(C)(C)C)C2)c(O)c1O 848313341 QXSIINFNZATSOF-XYPYZODXSA-N 293.363 2.482 10 10 CECE Cc1cc(CCNCc2ccc(N(C)C)c(F)c2)nn1C 922688289 OGKKFJGUOKQBLT-UHFFFAOYSA-N 290.386 2.266 10 10 CECE C[C@@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccc(F)cc1O 858603110 RCTRAMAEBDMUKI-YGRLFVJLSA-N 292.354 2.335 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)N(C)C3CC3)C2)cc1 854301647 RIOUCGLYDQRNMH-LBPRGKRZSA-N 289.379 2.078 10 10 CECE C[C@@H]1CCC[C@@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)O1 855798691 RYAXVKFSYNEDKM-RXVTVFCNSA-N 291.347 2.185 10 10 CECE CC[C@H](Nc1c(N)cccc1Br)C(=O)OC 697474320 DUTFGUBENPUONG-VIFPVBQESA-N 287.157 2.395 10 10 CECE C[C@H]1CC[C@@H](NCc2cc(Cl)ccc2O)CN1 863483508 BVELEQKRXMFBPR-JOYOIKCWSA-N 254.761 2.276 10 10 CECE COc1ccc(N2CC[C@H]2CNC2CC2)cc1F 696335369 SDLSQORXLGXPFO-LBPRGKRZSA-N 250.317 2.165 10 10 CECE CC(=O)C(=O)COC(=O)c1cc(Cl)nc(C(C)(C)C)c1 869700052 HLIUCOCUSZOIED-UHFFFAOYSA-N 297.738 2.347 10 10 CECE CCOc1ccc(CN[C@@H](C)[C@H](O)C(F)(F)F)c(O)c1 865710502 AWBCGMCXYNTHCV-UFBFGSQYSA-N 293.285 2.192 10 10 CECE C[C@@H]1C[C@@H]1NC(=N)NCc1cccc(Br)c1O 864464815 IPDZMPFECTWJHP-XCBNKYQSSA-N 298.184 2.177 10 10 CECE COCCN(Cc1cc(C)ccc1O)[C@H](C)COC 133442815 SHVABZSDWMNZKJ-CYBMUJFWSA-N 267.369 2.184 10 10 CECE COCCN(CCOC)[C@H](C)c1ccc(C)cc1O 133410062 UIINIKIGEOARCP-CYBMUJFWSA-N 267.369 2.356 10 10 CECE COCCNCc1ccc(N(C)C2CC2)c(F)c1 62735109 IRDGNALNOQMTHM-UHFFFAOYSA-N 252.333 2.160 10 10 CECE Oc1ccc(O)c2c1CCN[C@@H]2c1ccc[nH]c1=S 75799516 YNCYTDJENNSFON-CYBMUJFWSA-N 274.345 2.390 10 10 CECE NCCc1nc2cccc(F)c2n1-c1ccc(N)cc1 75976098 OQLVZXBSXGDXKS-UHFFFAOYSA-N 270.311 2.248 10 10 CECE Cc1cc(N)cc([C@]2(C)CO[C@@H](C(C)C)CN2)c1O 83479691 KDEFDJUBUGPOOA-HIFRSBDPSA-N 264.369 2.142 10 10 CECE CCCCCCNC(=O)[C@@H](N)c1ccc(C)cc1O 83479302 QXUGFNPOXIXSLQ-AWEZNQCLSA-N 264.369 2.397 10 10 CECE C[C@@H](Cc1ccsc1)NC(=O)Cc1ccc(O)c(O)c1 1136363063 NNUBMFXYLXXOKT-JTQLQIEISA-N 291.372 2.449 10 10 CECE Cc1csc(N(C)C(=O)Cc2ccc(O)c(O)c2)n1 1136645652 PSBVESRUXZWWNR-UHFFFAOYSA-N 278.333 2.068 10 10 CECE CN(C(=O)Cc1cn2ccsc2n1)c1ccc(N)cc1 702124778 HVPKCUCVDGIKEG-UHFFFAOYSA-N 286.360 2.184 10 10 CECE CNCc1ccc(N2C[C@H]3CN(C)C[C@]3(C)C2)cc1Cl 702419178 ZXVRYNUHUPUDME-CZUORRHYSA-N 293.842 2.447 10 10 CECE CN(CC1(C)COC1)c1ccc(CN)c(Cl)c1 702953211 VORCKLPKBUOWNC-UHFFFAOYSA-N 254.761 2.271 10 10 CECE COc1cc(C)cc(CN[C@H]2CCn3ccnc32)c1O 894871482 VTZYEXNLLSVFMZ-LBPRGKRZSA-N 273.336 2.140 10 10 CECE COCCNCc1ccc(N2CCC3(CC3)C2)cc1 400032644 HVTGMWKCYWSSIT-UHFFFAOYSA-N 260.381 2.413 10 10 CECE CCNCc1ccc(OC)c(CN2C[C@@H](C)OC2=O)c1 688552329 WBGBATBRSGMKPM-LLVKDONJSA-N 278.352 2.145 10 10 CECE Oc1cccc(Br)c1CNCCOC(F)F 706842000 HXHADCDFVGXFTQ-UHFFFAOYSA-N 296.111 2.484 10 10 CECE CCNCc1ccc(N2CCN(C)C[C@@H](C)C2)c(C)c1 707548077 SVPARRRTWWOTBY-CQSZACIVSA-N 275.440 2.492 10 10 CECE CN[C@H](C)c1ccc(N2CCNC(=O)C[C@H]2C)c(Cl)c1 707639106 AXOAFAAHENZFCX-GHMZBOCLSA-N 295.814 2.335 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H](C)[C@@H]2CO)cc1O 708472398 KASRTVOYSGXIAN-MJVIPROJSA-N 265.353 2.043 10 10 CECE COC[C@@](C)(CO)N(C)c1ccc([C@@H](C)O)cc1Cl 689233350 QPYNUQMIWNPJKK-QMTHXVAHSA-N 287.787 2.227 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@]23COC[C@H]2C3)c(F)c1 689307626 ZUQJEUQOTYEUOI-HCKVZZMMSA-N 264.344 2.318 10 10 CECE CNCc1cc(F)c(N(C)[C@@H]2CCC[C@@H]2O)c(F)c1 709477875 SFMWRDLOQDHZCV-OLZOCXBDSA-N 270.323 2.034 10 10 CECE CCCNC[C@@H]1CCN1c1ccc(CN(C)C)cc1 710248410 UIXZGDBAZXZTJQ-INIZCTEOSA-N 261.413 2.327 10 10 CECE C[C@H]1C[C@H](CN)CN1Cc1ccc(Br)cc1O 691486283 HKSYBRGADZJLQX-VHSXEESVSA-N 299.212 2.324 10 10 CECE CC1CC(CN(C)c2ccc3c(c2)N(C)C(=O)[C@H]3N)C1 691913616 VSXYXOGSXQYCIN-NWHVRFAMSA-N 273.380 2.145 10 10 CECE C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)CCO1 720495525 CGJQWIBZKXMVKM-SECBINFHSA-N 257.280 2.281 10 10 CECE C[C@@H]1CCC[C@@H]1NC(=O)CCOc1ccc(N)cc1 71205278 LOYHKCRHAXXJOP-RISCZKNCSA-N 262.353 2.343 10 10 CECE Oc1cccc(CNC[C@]23CCC[C@@H]2OCC3)c1O 687481885 QKFQSGFFISBFOY-DZGCQCFKSA-N 263.337 2.147 10 10 CECE CS[C@@H]1CCC[C@@H]1N(C)c1ccc2c(c1)NC(=O)[C@H]2N 687916600 CVWIXXXWQKABED-MJBXVCDLSA-N 291.420 2.359 10 10 CECE CC[C@H]1CN(c2ccc([C@@H](C)NC)c(O)c2)CCN1C 93671664 GEOGYDKLNLDCEF-OLZOCXBDSA-N 277.412 2.203 10 10 CECE CCN[C@@H](C)c1ccc(N(CCO)C(C)C)cc1O 93671049 XFYWROFEIVDYLC-LBPRGKRZSA-N 266.385 2.270 10 10 CECE COC[C@@H]1CC[C@@H](N)[C@@H](Sc2nccs2)C1 1918841357 SRIPZWODRKZUOD-BBBLOLIVSA-N 258.412 2.378 10 10 CECE CCCNCc1ccc(N2CC(F)(CO)C2)c(C)c1 2116278870 LEJQEXBKIMMMAT-UHFFFAOYSA-N 266.360 2.015 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@H]3C(F)F)c(Cl)cc21 2115227536 MBVUCEGEROMIGA-WPRPVWTQSA-N 287.697 2.136 10 10 CECE CNCc1ccc(N2CC[C@H](CO)C[C@@H]2C)c(C)c1 2115826929 JTAXCDBHWLRPIR-ZFWWWQNUSA-N 262.397 2.312 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)C1C[C@@H]2CC[C@H](C1)O2 2124926788 NMIHIYKYGBEMCU-HSTDOPHLSA-N 264.329 2.245 10 10 CECE C[C@H](C(=O)NCc1c(O)cccc1O)C(C)(F)F 1178910657 GSOMBYLPQATAIE-SSDOTTSWSA-N 259.252 2.005 10 10 CECE OC[C@@H]1C=CCCN1c1ccc2c(c1)CCC[C@@H]2O 2128269603 UJBWDIMPSRHSAQ-HOCLYGCPSA-N 259.349 2.184 10 10 CECE C[C@@]1(CO)CCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128271694 DDFZSCBORQESLJ-JKSUJKDBSA-N 261.365 2.265 10 10 CECE C[C@@H]1CC[C@H](O)CN1c1ccc2c(c1)CCC[C@H]2O 2128277361 MXUWHAPSWNRNAL-DIOULYMOSA-N 261.365 2.406 10 10 CECE CCCNCc1ccc(N2CC=C[C@H]2CO)cc1C 2119806782 HMNYNDMNSBLVKU-INIZCTEOSA-N 260.381 2.232 10 10 CECE CCN1CC[C@@H](N(C)c2ccc3c(c2)CC[C@@H]3O)C1 2128323237 SVRGPCMVPCPMLD-ZBFHGGJFSA-N 260.381 2.197 10 10 CECE COc1ccc(N(C)[C@H](CCO)C(F)F)c(C)c1 2219572653 ZGNHYDLCGHTHLW-GFCCVEGCSA-N 259.296 2.456 10 10 CECE CN[C@H](C)c1ccc(N2CC=C[C@H]2COC)c(F)c1 2125970347 XMLFQHOUQSKAEV-YPMHNXCESA-N 264.344 2.497 10 10 CECE COC(=O)[C@](C)(C[C@@H](C)C(F)(F)F)NCCN=[N+]=[N-] 2121374568 AXJSYZJEKBVEOD-APPZFPTMSA-N 282.266 2.407 10 10 CECE CN(C)[C@H]1CC[C@H](NCc2ccc(O)cc2O)CC1 2121441904 LTFKVEGSSAMLIE-JOCQHMNTSA-N 264.369 2.060 10 10 CECE O=C(/C=C/COc1ccccc1)NCc1cccc(O)c1O 1176566379 WGSVOYMEMGLBLV-BJMVGYQFSA-N 299.326 2.349 10 10 CECE C[C@H](N)c1ccc(N2CC3(CO)CCC2CC3)cc1 2122356800 WMNQHQSGNPVCRT-JQRITLKVSA-N 260.381 2.448 10 10 CECE FC(F)(F)Oc1ccc(N2CC[C@H]3CNC[C@@H]32)cc1 2132371587 RZLPPGAGTSMCGN-CABZTGNLSA-N 272.270 2.383 10 10 CECE Cc1ncnc(C)c1[C@H](N)c1ccc(N(C)C)cc1 2130934983 GGUHTGXKVMIXBH-OAHLLOKOSA-N 256.353 2.208 10 10 CECE CCN1CCN(C(=O)/C=C\c2cnccn2)c2ccccc21 1338823068 QAGISAHQTSVBRJ-FPLPWBNLSA-N 294.358 2.363 10 10 CECE CCOc1ccc(N2CCC(OCCO)CC2)cc1 2226755180 QAVKNIYNENHFRT-UHFFFAOYSA-N 265.353 2.063 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134329215 XNLJXUUZKYCXRO-BCTPILQISA-N 257.337 2.387 10 10 CECE CO[C@@H]1[C@H](NCc2c(O)cccc2Cl)COC1(C)C 1911077024 XSKZPCNMYOJLBQ-DGCLKSJQSA-N 285.771 2.328 10 10 CECE CN(C(=O)/C=C/c1cn(C)cn1)c1ccc(F)cc1 1350979855 BWIVEFYNFOSCAL-VMPITWQZSA-N 259.284 2.235 10 10 CECE C[C@@H](C(=O)N1CCC1)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912155524 LJJXHTTXHRKYMW-RYUDHWBXSA-N 265.361 2.020 10 10 CECE CC(C)CN1CCO[C@H](CN2CCC[C@H](N=[N+]=[N-])C2)C1 1912159294 GFNFPOAGKUXDJP-UONOGXRCSA-N 281.404 2.118 10 10 CECE COc1ccc(C)cc1CC(=O)N1CC[C@H](N=[N+]=[N-])C1 1912177393 JDZPQTQAFFAWGY-LBPRGKRZSA-N 274.324 2.457 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)c2cnc(Cl)nc2)CC1 1912165273 ISRJFUQRTDGUFZ-UHFFFAOYSA-N 280.719 2.293 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@]2(CN)C1 2136677032 GRHWKKVRKORBEM-ZETOZRRWSA-N 264.344 2.263 10 10 CECE Nc1ccc(CN2CC3(CCC4(CC3)OCCO4)C2)cc1 1923477129 PNKHQHBJKGATGC-UHFFFAOYSA-N 288.391 2.388 10 10 CECE C[C@@H]1CC[C@@H](CNC(=O)Cc2ccc(O)c(O)c2)C1 1618831452 VBLNOUYSXBWYNS-ZYHUDNBSSA-N 263.337 2.193 10 10 CECE NC1(C2CN(Cc3ccc(Br)cc3O)C2)CC1 1924026561 LXJBJNWTYWXRLL-UHFFFAOYSA-N 297.196 2.078 10 10 CECE COc1ccc(N2CCC[C@@H]3NCC[C@@H]32)cc1OC 216765215 GPLZAWVMCMSYML-STQMWFEESA-N 262.353 2.035 10 10 CECE NC[C@H]1CCC2(CCC2)[C@@H]1NCc1ccccc1O 1924943922 GWOOAGAWPAEPRF-IUODEOHRSA-N 260.381 2.389 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](O)CC3(CC3)C2)cc1 1926413759 JZGMHZFHSIAXJS-IUODEOHRSA-N 260.381 2.318 10 10 CECE Cc1cc2c(cc1N(C)C(C)(C)CCN)OCO2 258680464 ARLLAXAKTJETSG-UHFFFAOYSA-N 250.342 2.287 10 10 CECE CN[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1O 1928474163 JNRSDIVMJASDBM-NSHDSACASA-N 266.341 2.177 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cccc(F)c2O)c1 1640800280 KQOCXQZCBBGXKH-UHFFFAOYSA-N 275.279 2.475 10 10 CECE COc1ccc([C@@H](CN)N2CCCCCC2)c(O)c1 32026735 ITKCGGUYHMAJCT-CQSZACIVSA-N 264.369 2.277 10 10 CECE COc1cc(N(C)C[C@H]2CO[C@H](C)C2)ccc1CO 2139698921 OOYFNCQSUAQKBJ-NEPJUHHUSA-N 265.353 2.049 10 10 CECE COc1cc(N(C)C[C@@H]2CCO[C@@H]2C)ccc1CO 2139699967 CUSLXRQWZVYFCD-NEPJUHHUSA-N 265.353 2.049 10 10 CECE CCNCc1ccc(N(C)C[C@@H](C)OC)cc1OC 2139686926 LOWVQNAXWJHQOV-GFCCVEGCSA-N 266.385 2.276 10 10 CECE CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@@H]1N(C)C 2139798486 RAMAIVKXSJBRLL-HIFRSBDPSA-N 262.397 2.473 10 10 CECE Cc1ccc(CNc2ccc3nncn3c2)c(O)c1 2139771485 ZZOQIMUFPOAIDI-UHFFFAOYSA-N 254.293 2.355 10 10 CECE Cc1cc(NS(=O)(=O)N2CCC(C)CC2)cc(C)c1O 1963013960 BQZAUIQFZQSJSQ-UHFFFAOYSA-N 298.408 2.398 10 10 CECE NC(=O)c1cccc(N)c1N[C@H]1CCOc2ccccc21 161134252 NXPVHQPLEZBQKE-ZDUSSCGKSA-N 283.331 2.303 10 10 CECE CSC[C@@H](C)N(C)c1cc2c(cc1N)OCCO2 167167873 GZQXAVBHYHOYPK-SECBINFHSA-N 268.382 2.228 10 10 CECE Cc1ccc(O)c([C@H](C)NC2CCS(=O)CC2)c1 157951266 WJCUMANKYQSDOU-OMTHAAKESA-N 267.394 2.262 10 10 CECE COc1ccc(N2CC[C@H]3CCN[C@H]3C2)cc1F 250388562 AJCWGZSVZBCNSL-MFKMUULPSA-N 250.317 2.023 10 10 CECE CC[C@]1(C)CN([C@H](C)CN)c2ccc(OC)cc2N1 251635840 MKKVLVGGGPINSO-IAQYHMDHSA-N 263.385 2.443 10 10 CECE COc1cc(CN[C@H](C)c2c(O)cccc2O)ccn1 234949619 XPTPXZPYYYDVSP-SNVBAGLBSA-N 274.320 2.352 10 10 CECE CNCc1ccc(N2CCC[C@H](O)C2)cc1Cl 234444376 SVZONEWCUSGWSE-LBPRGKRZSA-N 254.761 2.021 10 10 CECE COCCNCc1ccc(N2CC[C@@](C)(O)C2)cc1Cl 234692590 LZDXUPOVLOTHAU-OAHLLOKOSA-N 298.814 2.037 10 10 CECE CC1(C)CC[C@H]1C(=O)NCCc1ccc(O)c(O)c1 830530990 DIBBQPCQQQSGLB-NSHDSACASA-N 263.337 2.193 10 10 CECE CCn1cc(CN[C@H](C)c2c(O)cccc2O)c(C)n1 2143437740 HBEVYEOQEPNTGU-LLVKDONJSA-N 275.352 2.473 10 10 CECE Oc1c(Br)cccc1CN[C@@H]1[C@@H]2CCO[C@@H]21 1895428848 PASKCTCUFDLGAR-XRNSZHNASA-N 284.153 2.032 10 10 CECE CC(C)OC(C)(C)COC(=O)COc1ccc(N)cc1 2143668503 SUHIRJMSTFCCCW-UHFFFAOYSA-N 281.352 2.394 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC[C@H]1C(=O)N(C)C 2143699976 ISDGCZYMFGDXGU-GWCFXTLKSA-N 280.343 2.145 10 10 CECE Cc1cnc(COc2ccc(N3CCNCC3)cc2)s1 2143814593 DPEFAVOIYPMCKO-UHFFFAOYSA-N 289.404 2.440 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@@H]2C[C@]21C(=O)O 2143929983 WFMZSUYVWYMZEH-IQMDTDKHSA-N 277.320 2.098 10 10 CECE CC[C@@H]1CN(c2ccc(OC)cc2N)[C@H](CC)CN1 1876282159 XWBZVHKAJNYKSH-VXGBXAGGSA-N 263.385 2.244 10 10 CECE C[C@H](NC(=O)c1c(Cl)cnn1C)c1ccccc1O 1302538393 PTRDRCVTGOLANF-QMMMGPOBSA-N 279.727 2.270 10 10 CECE CCCN(C)C1CN(c2ccc(CNC)c(C)c2)C1 1877448531 NVABXMDVJOERMI-UHFFFAOYSA-N 261.413 2.245 10 10 CECE Oc1ccc(Cl)cc1CNCc1nnc2ccccn12 20185519 KZPVMWOMYXKYJT-UHFFFAOYSA-N 288.738 2.378 10 10 CECE COc1ccc(O)c(CN2C[C@H](N)CCC2(C)C)c1 1879071986 FPLFCUGULNXTLP-GFCCVEGCSA-N 264.369 2.103 10 10 CECE CCn1cnc(CN[C@H](C)c2ccc(OC)cc2O)c1 2144314905 SQPUEQSQPLVBLQ-LLVKDONJSA-N 275.352 2.468 10 10 CECE C[C@H]1[C@@H](C)[C@@H](N(C)c2ccc(CO)cc2)CCN1C 1879228158 UESGQTTWAOAHNC-WWGRRREGSA-N 262.397 2.344 10 10 CECE COc1cc(Cl)cc(CNC[C@]23C[C@H](CO2)C3)c1O 1879827838 RUAXSSPXTUYHST-DEZZCRIOSA-N 283.755 2.323 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCN1C(=O)c2ccccc2C1=O 1880797679 RWBGCOWHRJQQND-NSHDSACASA-N 299.334 2.057 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@H](O)CC2(C)C)c(F)c1 1880924237 PGQMAKODELBKEF-PSASIEDQSA-N 270.323 2.334 10 10 CECE COCc1cc(CN[C@@H](C)c2ccccc2O)on1 1964509161 UBNVCFDQPSIYJF-JTQLQIEISA-N 262.309 2.377 10 10 CECE CC(C)CN[C@](C)(C(=O)O)c1ccc(N(C)C)cc1 37965251 VBBYZPVGKQXGIU-HNNXBMFYSA-N 264.369 2.298 10 10 CECE Cc1c(N)c(C)c(N2CCNCC2)c(C)c1CN=[N+]=[N-] 1887554404 UMNRKRHQBLMQAM-UHFFFAOYSA-N 274.372 2.414 10 10 CECE CCOC(=O)[C@@H]1CCN[C@@H](c2cccc(OC)c2O)C1 1952453253 WOVXRZYHSLMYBV-ZYHUDNBSSA-N 279.336 2.005 10 10 CECE COc1cccc(O)c1CNC[C@H](CO)C(C)(C)C 1967698329 AWTILPXAIPWLFX-LLVKDONJSA-N 267.369 2.145 10 10 CECE Oc1cccc(F)c1CN1CCO[C@H](C(F)F)CC1 1967806956 FQXCQBSSJGPZPE-LBPRGKRZSA-N 275.270 2.387 10 10 CECE CN1C[C@H](NCc2ccc(N)cc2)CC12CCCC2 1967990355 AJBIPDZZWYGFBU-OAHLLOKOSA-N 259.397 2.375 10 10 CECE CN1CCc2cc(CN[C@@H]3CCCCC[C@H]3O)ccc21 252875972 QPXJHUOYGVOBJS-NVXWUHKLSA-N 274.408 2.462 10 10 CECE C[C@@]12CC[C@@H](CN1c1cc3c(cc1F)[C@H](O)C(=O)N3)C2 2145904222 TXMJNSMTTUQOPQ-AFEMSUNCSA-N 276.311 2.190 10 10 CECE Cc1cc(N2C(=O)[C@H]3C[C@H](C)C[C@H]3C2=O)ccc1N 253163916 XNDCCRYIZPSTSE-VTYGSRLXSA-N 258.321 2.113 10 10 CECE O=C(O)[C@H]1CCCCN(Cc2c(O)cccc2F)C1 1972908497 JLDRURLVGXQDPI-JTQLQIEISA-N 267.300 2.218 10 10 CECE NN[C@H](c1ccc2cnccc2c1)c1ccccc1O 2146239222 CYYXFKDTKNMWPM-MRXNPFEDSA-N 265.316 2.493 10 10 CECE CN(C[C@H]1CCCCCO1)C(=O)c1cccc(O)c1O 2152631682 KJBKVGJCJPEORZ-LLVKDONJSA-N 279.336 2.129 10 10 CECE CNCc1cc(F)c(N2CC3(CC=CCO3)C2)c(F)c1 2151325098 JWRCJTJJTRTBQW-UHFFFAOYSA-N 280.318 2.220 10 10 CECE O=C(O)[C@H]1CCC[C@@H](CSc2nccs2)O1 1990165081 USAZSMFZPYMEAE-JGVFFNPUSA-N 259.352 2.258 10 10 CECE CN(C(=O)CN(C)C1CCCC1)c1ccc(N)cc1 37273251 QIHMEFMYEGLTFD-UHFFFAOYSA-N 261.369 2.106 10 10 CECE CN[C@@H](c1ccc[nH]1)[C@@H](O)c1ccc2c(c1)CCN2C 2148187015 SOGZMTOLCXNTTJ-HOTGVXAUSA-N 271.364 2.001 10 10 CECE C[C@H](CNCc1cccc(Br)c1O)N1CCC1 1997059785 YSTKIVHXPDZPOD-SNVBAGLBSA-N 299.212 2.339 10 10 CECE CNCc1ccc(N2CC[C@@H]3CCN(C)C[C@H]3C2)cc1 2148894405 MHUXEPGJGAFRJL-HOTGVXAUSA-N 273.424 2.184 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@]3(C)CCO[C@@H]23)c1O 2154146716 SKNJBENAHRLDSJ-KCXAZCMYSA-N 277.364 2.448 10 10 CECE Oc1c(F)cc(F)cc1CNC1CCN(CCF)CC1 2154504667 HBWRYYCEJADBJT-UHFFFAOYSA-N 288.313 2.194 10 10 CECE C[C@@H]1C(=O)N(c2ccc(C(F)(F)F)cc2)N=C1C(=O)O 2154695606 GSUQVEKARLWBCA-LURJTMIESA-N 286.209 2.129 10 10 CECE CC(C)CN(CCN(C)C)c1ccc(CN)cc1F 44415671 AVGDDPFFRJFCGP-UHFFFAOYSA-N 267.392 2.308 10 10 CECE Oc1c(Cl)cccc1CNC[C@H]1OCC[C@H]1F 2009187180 QAABYKJDERXNMN-GHMZBOCLSA-N 259.708 2.262 10 10 CECE Cn1cc(CN2CCC[C@H]2CN=[N+]=[N-])c(Cl)n1 2009442887 JSVPPDIEHVFOJO-VIFPVBQESA-N 254.725 2.348 10 10 CECE C[C@@]1(NCc2cc(Cl)ccc2O)CCC[C@H]1O 2011557597 ZKJONPNZFFEIMI-CHWSQXEVSA-N 255.745 2.439 10 10 CECE CCCn1nncc1CN[C@H]1CCc2cccc(O)c21 2156474520 PBAOKCWYSFDCAQ-ZDUSSCGKSA-N 272.352 2.171 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc(CNC2CC2)cc1F 2156546848 DVWINFYWMAJBHD-WCQYABFASA-N 278.371 2.285 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H](O)C2(C)C)c(Br)c1 2023140809 DIVITMUAEFWUNF-PELKAZGASA-N 299.212 2.428 10 10 CECE C[C@@H]1CN(CCNCc2ccc3c(c2)CCO3)C[C@H]1C 2160557085 RJLVNISHZXCDNB-ZIAGYGMSSA-N 274.408 2.299 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)c1cnsc1 2031152155 BXDMNCMMYNAZJW-OLZOCXBDSA-N 264.350 2.233 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)c1scnc1C 2031159618 MDMOSSWEYUAUBN-NEPJUHHUSA-N 264.350 2.151 10 10 CECE CC[C@@H]1CCOC[C@@H]1NCc1cc(F)ccc1O 2035123288 PXXZQTPMKMDCNP-MFKMUULPSA-N 253.317 2.436 10 10 CECE COC(=O)C(C)(C)CN1CCC[C@@H](N=[N+]=[N-])CC1 2037999773 JDARPVONJWCNAP-SNVBAGLBSA-N 254.334 2.350 10 10 CECE CC(C)[C@@H](O)[C@@H](C)N[C@@H](C)c1cc(O)ccc1O 2041299042 GINVPNYYPKQJTH-IMSIIYSGSA-N 253.342 2.154 10 10 CECE CO[C@H](COC(=O)CCc1ccc(N)cc1)C1CC1 400224071 JQEJUCZKQYKVBK-CQSZACIVSA-N 263.337 2.170 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)C1CCSCC1 403654767 VLVIMBASZOBGMO-UHFFFAOYSA-N 264.394 2.165 10 10 CECE CCCN[C@@H]1C(=O)Nc2cc(N3CC(CF)C3)ccc21 2159106601 FXIZSMNQKCHRTP-AWEZNQCLSA-N 277.343 2.085 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@H](CCN(C)C)C1 701494604 PBEJBIZGBIFKDW-STQMWFEESA-N 278.396 2.432 10 10 CECE Cc1cc(NS(=O)(=O)[C@H]2CC2(F)F)c(C)cc1O 2049739379 QBQCCOFKCTUFMB-JTQLQIEISA-N 277.292 2.158 10 10 CECE CN[C@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)OCCO2 2162656416 BOEMZHFLDDIACR-XYYAHUGASA-N 274.364 2.177 10 10 CECE Cc1cccc(N)c1N[C@H]1CCCN([C@@H]2CCOC2)C1 2173052730 BRNUERQTTSPUSY-UONOGXRCSA-N 275.396 2.242 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H](C(=O)O)[C@@H](F)C1 2164555836 NDMFBUCHCXBWQJ-QRTLGDNMSA-N 285.290 2.337 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@H]3CCC[C@H]32)cc1 378683534 ZIGOMPDRIQJLBX-BXUZGUMPSA-N 259.353 2.082 10 10 CECE CCN(Cc1cc(C(C)=O)ccc1O)CC1(O)CCC1 2181191975 AEWSENSXKPKFMU-UHFFFAOYSA-N 277.364 2.332 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H](N)CC[C@H]2C)c1 690925259 XLCHMADCSAYPMR-GRYCIOLGSA-N 264.369 2.273 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1c(O)cccc1F 691689929 PTOGNCPJHNLVCC-QMMMGPOBSA-N 264.260 2.446 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)C[C@@]2(C)COCCO2)c1 2174265089 WYSGFNOBPFKAJV-CJNGLKHVSA-N 279.380 2.499 10 10 CECE CNCc1ccc(N2CC[C@](C)(CO)C2)c(Cl)c1 381355222 IVRRJPLGFSLHOM-AWEZNQCLSA-N 268.788 2.268 10 10 CECE CCN([C@H]1CCN(C)C1)[C@H](C)c1ccc(OC)cc1O 693476640 TZQRXAOTXOGBRG-OLZOCXBDSA-N 278.396 2.488 10 10 CECE CNCc1ccc(N2CC(C)(OC)C2)cc1Br 382594514 DQWLUBPICLDRCY-UHFFFAOYSA-N 299.212 2.394 10 10 CECE Oc1ccc(-c2nc(COC3CCC3)no2)cc1O 714861274 KXAXBEHFVCLDAX-UHFFFAOYSA-N 262.265 2.217 10 10 CECE Nc1ccc(OCCN2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)cc1 384687722 AYOYZUOCQRACNT-MGBSGCIJSA-N 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2.249 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2c(N)cccc2F)CC1 2271363862 YXRPONLEMIIRSY-UHFFFAOYSA-N 263.276 2.228 10 10 CECE N[C@@H]1CN(c2ccc(OCF)cc2)C[C@@H]1C(F)F 2263923800 NOPAWFDPGXHCNA-WDEREUQCSA-N 260.259 2.021 10 10 CECE Nc1ccc(OCC(=O)NCCCSC(F)F)cc1 2264418947 CIZCKMPUZSTGME-UHFFFAOYSA-N 290.335 2.110 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1ccn(C(F)(F)F)n1 2277855582 BKHYKTOIEHHOCN-UHFFFAOYSA-N 276.222 2.132 10 10 CECE CCC[C@]1(C(=O)NCc2cnc(SC)s2)CCCN1 2269092372 GQTICBWVEYSUMW-CYBMUJFWSA-N 299.465 2.404 10 10 CECE CSc1ncc(CNC(=O)C[C@H](N)C2CCCC2)s1 2269193529 MOFYFTUZUKRWLE-NSHDSACASA-N 299.465 2.389 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1c[nH]nc1C1CC1 2269189488 AFIRNHRDNRPFOH-VIFPVBQESA-N 260.301 2.202 10 10 CECE C[C@H](N)c1ccc(N2CC=C[C@H]2C(=O)N(C)C)c(Cl)c1 2280320067 SCGITXSCAVJHFW-HZMBPMFUSA-N 293.798 2.193 10 10 CECE COc1ccc(N2C[C@]3(C)C[C@]3(CO)C2)c2c1CCC2 2284609968 XEQYIXUAJMJHKH-DLBZAZTESA-N 273.376 2.393 10 10 CECE COc1ccc(N2C[C@@H](C)C[C@H](CO)C2)c(OC)c1C 2295374985 FZOWQWUGVIFFQJ-AAEUAGOBSA-N 279.380 2.467 10 10 CECE COc1ccc(N2CC[C@H]3CCN[C@@H]3C2)c(OC)c1C 2295432022 CJMWBTGXRAMMPX-CHWSQXEVSA-N 276.380 2.200 10 10 CECE FCOc1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3CN2)cc1 2295951798 LCURGHIOYWVBOY-DANNLKNASA-N 276.355 2.427 10 10 CECE CN(C)c1ccc(OCc2ccnc(NN)c2F)cc1 2286970686 IYQATVCULJQPDX-UHFFFAOYSA-N 276.315 2.151 10 10 CECE CSc1ncc(CNC[C@H]2C[C@@H]3C[C@@H](N)[C@@H]3C2)s1 2312988725 FFXCNZSTNZBERK-LUTQBAROSA-N 283.466 2.328 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccc([N+](=O)[O-])s1 2315987942 CBHARYBGIGIUGT-UHFFFAOYSA-N 269.286 2.429 10 10 CECE COC(=O)[C@@](N)(CSc1nccs1)CC1CCC1 2318372013 KPHASXHMJFLIFS-LBPRGKRZSA-N 286.422 2.296 10 10 CECE COc1ccc(CN[C@H]2C[C@@]3(C)CCO[C@@H]23)c(O)c1 2328914188 RPKFYOKEFVBVAT-AEGPPILISA-N 263.337 2.058 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@@H]2CN(C)CC[C@@H]21 2330187786 MIFGOUMCQCZPAM-GUTXKFCHSA-N 260.381 2.479 10 10 CECE CO[C@H]1C[C@@H]2C[C@H](NCc3ccc(O)cc3O)[C@@H]2C1 2331993219 DBSIXHZUWLPSFD-CABNGKKXSA-N 263.337 2.001 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)[C@@]23CCC[C@@H]2C3)cc1 2332026765 XWYSODTZXRXJAL-SLBVQIDZSA-N 260.381 2.304 10 10 CECE Cc1ccc(O)c([C@@H](C)N2C[C@@H]3C[C@H]2[C@@H]3C(=O)O)c1 2333052453 SJGITPRLNZLGNZ-IUCKATPISA-N 261.321 2.167 10 10 CECE O[C@H]1CC[C@@H]2CN(c3ccc4c(c3)CCCO4)C[C@H]12 2333684653 AYRDXPJYSBAXNZ-SNPRPXQTSA-N 259.349 2.219 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC[C@H]2C[C@]1(CO)C2 2336573727 BJBSCWFSECSAJZ-IOASZLSFSA-N 261.365 2.400 10 10 CECE C[C@]1(O)CCCN(c2ccc(CO)c(C3CC3)c2)C1 2339146778 SUKHXAPGCSFMIT-INIZCTEOSA-N 261.365 2.408 10 10 CECE NCc1ccc(N2CC[C@]3(CCO3)C2)cc1C1CC1 2339165667 KWBLTXWARHNJMW-INIZCTEOSA-N 258.365 2.392 10 10 CECE Nc1ccc(NC(=O)COC[C@H]2CC23CCC3)cc1 2341365144 ZYWUBSZSCBFKBG-LLVKDONJSA-N 260.337 2.414 10 10 CECE COc1cc(Cl)c(N2C[C@@H]3C[C@]3(CN)C2)c(OC)c1 2342285846 IGWTZFCHRKMKFG-XPTSAGLGSA-N 282.771 2.142 10 10 CECE CCc1cnn(CCN(C)Cc2ccccc2O)c1 2346251420 UTRDNXJNDIQWIP-UHFFFAOYSA-N 259.353 2.283 10 10 CECE CCOc1cccc(CN[C@H]2C[C@@]3(C)CCO[C@@H]23)c1O 2354146590 SKNJBENAHRLDSJ-VBNZEHGJSA-N 277.364 2.448 10 10 CECE CCC(C)(C)OC[C@@H](O)COc1ccc(N)cc1 51327982 DJTOSNVMJXULQN-LBPRGKRZSA-N 253.342 2.214 10 10 CECE CCCNCc1ccc(N(CC)CC(=O)NCC)c(C)c1 50561857 FRWQIJYEWGFPRA-UHFFFAOYSA-N 291.439 2.457 10 10 CECE C[C@@H](N[C@@H]1CCC(=O)NC1)c1ccc2ccccc2c1O 111018532 GJYOZXAXTKEANZ-DGCLKSJQSA-N 284.359 2.475 10 10 CECE O=C(NCc1ccc(N2CCCC2)cc1)c1ccncc1O 177299735 WWHBWAVKLWQDTR-UHFFFAOYSA-N 297.358 2.317 10 10 CECE Cc1oc(C(=O)O)cc1COc1ccc(CO)cc1 51361113 AYSPQXNEZNHSQE-UHFFFAOYSA-N 262.261 2.358 10 10 CECE COc1ccc(O)c(CNC(=O)Cc2ccccc2)c1 172042879 GHAXHXKYMJKLBD-UHFFFAOYSA-N 271.316 2.260 10 10 CECE C[C@@H](NCCN(C)C1CC1)c1ccc(F)cc1O 62748535 FDJWFUCPPGJCLI-SNVBAGLBSA-N 252.333 2.276 10 10 CECE COc1cccc(CNC[C@@H]2Cc3ccccc3O2)c1O 38009406 QAVSSQKBCZWAFH-AWEZNQCLSA-N 285.343 2.494 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@@H]2CC(O)C3)cc1 126509905 MONORFNWOXZCRQ-XYPWUTKMSA-N 260.381 2.240 10 10 CECE C[C@H]([C@H](O)c1ccc(O)c(O)c1)N(C)C(=O)OC(C)(C)C 212266804 MIONJNDPQYDTOL-RNCFNFMXSA-N 297.351 2.387 10 10 CECE CNC(=O)[C@@H](C)CN(C)Cc1cc(Cl)cc(C)c1O 180682311 GZVREMWYBPEATQ-JTQLQIEISA-N 284.787 2.168 10 10 CECE CCCN(C(=O)[C@H]1CO[C@@H](C)C1)c1ccc(N)cc1 131529384 VHTRHSSZZJRESM-NWDGAFQWSA-N 262.353 2.437 10 10 CECE CN1CC[C@@H](CN(C)c2ccc(/C=C\C(=O)O)cc2)C1 227136974 DVRAIOFOYFZFIH-BMWLXYDHSA-N 274.364 2.172 10 10 CECE CCN(Cc1cccc(OC)c1O)[C@H](C)COC 132587239 ZTAOJRXUCNTQNA-LLVKDONJSA-N 253.342 2.258 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H]2CCO[C@@]3(CCOC3)C2)cc1 229202621 XHKDYLIIPAICLR-PVAVHDDUSA-N 290.407 2.338 10 10 CECE Cc1ccc2c(c1)C(=O)N(CCc1ccc(N)cc1)C2=O 40675758 QPXKQNSPVTUCLT-UHFFFAOYSA-N 280.327 2.416 10 10 CECE CO[C@H]1CC[C@H](NC(=O)NCc2ccc(N(C)C)cc2)C1 191018117 CMSKDBKMDIVOJB-ZFWWWQNUSA-N 291.395 2.119 10 10 CECE CCN(CC(C)(C)O)c1ccc([C@H](C)N)c(O)c1 93672020 XSBZWRUKGUZSKM-JTQLQIEISA-N 252.358 2.009 10 10 CECE C[C@@H](N)c1ccc(N2CC(C)(O)C2)cc1Br 384024136 CUXQNRPVECEAJR-MRVPVSSYSA-N 285.185 2.040 10 10 CECE CC(C)[C@H](CCO)N[C@@H](C)c1cc(O)ccc1O 231072543 ODBSEWIAUZWHFK-GWCFXTLKSA-N 253.342 2.155 10 10 CECE C[C@H]1OCC[C@H]1SCC(=O)c1ccc(O)c(O)c1 235637431 GNDFJGGBRYJADV-AMIZOPFISA-N 268.334 2.191 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCC[C@@H]1C(=O)O 94622172 JTKVCNFKRNQVKS-GZMMTYOYSA-N 253.273 2.141 10 10 CECE CN1C(=O)C(=Cc2ccc(F)nc2)SC1=S 2310148842 QCUXOHYLJASQAG-UHFFFAOYSA-N 254.311 2.052 10 10 CECE CC(=O)C(=O)COC(=O)CCC(C)(C)c1ccccc1 808528831 REIGBARTUHHUCK-UHFFFAOYSA-N 276.332 2.446 10 10 CECE CN1CCc2cc(N3C[C@H]4CCC[C@]4(CN)C3)ccc21 2163067451 WYNSPWIROIGHBO-PBHICJAKSA-N 271.408 2.244 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2OCCO[C@H]2C)cc1 2163098735 XJWUBOMMEPSNJL-RCBQFDQVSA-N 279.380 2.370 10 10 CECE CN1CCCc2cc([C@]3(O)CCC[C@@H](CN)C3)ccc21 2163102622 MGJUKIZNALCCQZ-DYVFJYSZSA-N 274.408 2.406 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@]12CCNC[C@@H]1C2 2163105998 HQDFXJUQLWXPSD-UAGQMJEPSA-N 272.392 2.320 10 10 CECE C[C@@](O)(c1ccc(N2CCCC2)cc1)[C@H]1[C@H]2CN[C@H]1C2 2163108924 ZPTSIZSZHFELEF-ISWURRPUSA-N 272.392 2.102 10 10 CECE CN1CCCc2cc([C@@H](O)Cc3csc(=N)[nH]3)ccc21 2163107071 QOEMJRNZPABVRB-AWEZNQCLSA-N 289.404 2.214 10 10 CECE CC[C@@H]1NCC[C@H]1[C@@H](O)c1ccc2c(c1)CCCN2C 2163112029 YIEBCNBNZJBUHJ-VYDXJSESSA-N 274.408 2.491 10 10 CECE CO[C@@H]1CCCC[C@]1(O)[C@H](N)c1ccc(N(C)C)cc1 2163146831 JGLSQUANMJGMQE-BZUAXINKSA-N 278.396 2.073 10 10 CECE CCn1cncc1[C@@H](NC)c1ccc2c(c1)CCN2C 2164077100 ATFIVGNENZUITO-INIZCTEOSA-N 270.380 2.204 10 10 CECE COc1ccc(N2CCC[C@H]3CNCC[C@H]32)cc1OC 2162657555 XANNUXMKZVOSOZ-GXTWGEPZSA-N 276.380 2.282 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCC[C@@H]1CCO 2164996333 OZNHTZRQKORMHT-ZWNOBZJWSA-N 278.352 2.018 10 10 CECE CC[C@H](C)[C@H]1OC(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1O 575282416 IGKVQZKVCFBSJZ-CQFDHEJISA-N 280.280 2.496 10 10 CECE C[C@H]1C[C@H](CO)CN1c1ccc(CN)cc1Br 1950540250 ZEGFKASHQSKJPD-ONGXEEELSA-N 299.212 2.115 10 10 CECE CO[C@@H]1COCC[C@@H]1CNCc1cc(Cl)cc(C)c1O 824708872 KZFHZAWRZCCVIX-BXUZGUMPSA-N 299.798 2.495 10 10 CECE CO[C@@]1(CO)CCCN(Cc2cccc(Cl)c2O)C1 826952713 QIMOGNSPILDBLU-AWEZNQCLSA-N 285.771 2.019 10 10 CECE COc1ccc(CNC(=O)N[C@@H]2CC[C@H]3C[C@@H]3C2)c(O)c1 827637300 FCBHMGXQELJUOO-CYZMBNFOSA-N 290.363 2.389 10 10 CECE COC[C@H](NCc1cccc(C)c1O)C1CCOCC1 826872116 GXLQTYVKBMQTRZ-HNNXBMFYSA-N 279.380 2.232 10 10 CECE COc1cccc(CNC(=O)N[C@@H]2CC[C@@H]3C[C@@H]3C2)c1O 828502673 OTTQTBNCNZUCOE-RAIGVLPGSA-N 290.363 2.389 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@H](C(N)=O)C2)cc1Cl 723176232 MJELAVLVFFGWIG-QWRGUYRKSA-N 295.814 2.322 10 10 CECE CN1C[C@H](NCc2ccc3c(c2)CCN3C)C(C)(C)C1 722303776 DZKRGFSZZDKTLN-INIZCTEOSA-N 273.424 2.109 10 10 CECE O=C1O[C@H](CNCc2cccc(Cl)c2O)CN1C1CC1 848928142 ADUQBQVLVGDOCH-LLVKDONJSA-N 296.754 2.118 10 10 CECE Cc1cc(Cl)cc(CNC[C@@H](N)C2CC2)c1O 841051244 XCQGTTVVLPXRJO-GFCCVEGCSA-N 254.761 2.181 10 10 CECE CCOc1ccc(O)c(CN2CC[C@]3(CCCNC3)C2)c1 843117282 OEEOBPKOFLWZPO-KRWDZBQOSA-N 290.407 2.366 10 10 CECE O=C(c1cccc(O)c1O)N1CCC(c2ccon2)CC1 856173936 UXDGPXMRBFSUMW-UHFFFAOYSA-N 288.303 2.106 10 10 CECE Cc1ccc(O)c(CNCC[S@](=O)CC(F)(F)F)c1 850348028 CVIIXUOKTNOHKR-IBGZPJMESA-N 295.326 2.101 10 10 CECE C[C@@H]1O[C@H](C)C[C@@H]1CNC(=O)NCc1c(O)cccc1F 922891564 LUVXTAJLIJHDKX-OUAUKWLOSA-N 296.342 2.144 10 10 CECE COc1ccc(N(C)C[C@H](OC)[C@@H]2CCOC2)cc1OC 851734574 HYZMGGRVBWBEES-WBMJQRKESA-N 295.379 2.192 10 10 CECE CN1CCc2cc(CNC[C@](C)(O)C(F)(F)F)ccc21 698699842 PLCGCUOFKCXDLD-ZDUSSCGKSA-N 288.313 2.082 10 10 CECE C[C@H]1CC[C@H](NCc2cc(Cl)cc(F)c2O)CN1 863485242 XKCBMUDVGKMHPT-KWQFWETISA-N 272.751 2.415 10 10 CECE O=C(COC(=O)[C@]12CCCC[C@H]1C2)c1ccc(O)c(O)c1 869708856 RKWVLEVOYOLOCB-ZBEGNZNMSA-N 290.315 2.404 10 10 CECE Nc1nc2c(c(N3Cc4cccc(O)c4C3)n1)CCCC2 866116690 AZPVMNWVNURZSK-UHFFFAOYSA-N 282.347 2.163 10 10 CECE CCc1cccc(CN[C@H]2CCN(C3CCC3)C2=O)c1O 862552206 YYSQENNQLCCWCH-HNNXBMFYSA-N 288.391 2.198 10 10 CECE CC1(C)CNCC[C@H](NCc2cccc(F)c2O)C1 872251468 JHWHRVZIVVHOQC-LBPRGKRZSA-N 266.360 2.399 10 10 CECE Oc1ccc2c(c1O)CCN[C@H]2c1ccc(F)cc1 83655935 FOTJGNLLIDLACA-AWEZNQCLSA-N 259.280 2.472 10 10 CECE Oc1ccc([C@@H]2NCCc3ccc(O)c(F)c32)c(O)c1 83623173 OSRKIPXKGPWABA-HNNXBMFYSA-N 275.279 2.178 10 10 CECE CC[C@H](C)NCc1ccc(N2CCCNCC2)cc1 84846264 QXIFWWRWQFFCRR-AWEZNQCLSA-N 261.413 2.374 10 10 CECE CSc1ncc(CNCC(F)(F)[C@H](N)C2CC2)s1 2257128701 SAUKBTOEVKOGGS-SECBINFHSA-N 293.408 2.327 10 10 CECE CN(C)[C@@H]1CCCN(c2ccc(CN)cc2Cl)C1 91393550 OYQZSJALTGJCMU-GFCCVEGCSA-N 267.804 2.329 10 10 CECE CC(C)[C@@H]1CN(c2ccc3c(c2)NC(=O)[C@@H]3N)CCS1 687995079 LHHDVGAZKTYVKW-UONOGXRCSA-N 291.420 2.216 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 717123858 MENQOBGKDOUEEH-PKIAMQTDSA-N 274.364 2.056 10 10 CECE Cc1cc(N2C[C@H]3COC[C@@H]3C2)ccc1CNC1CC1 718243112 FFDVHTLKRYOOOS-GJZGRUSLSA-N 272.392 2.330 10 10 CECE CN(CC1CCSCC1)c1ccc2c(c1)NC(=O)[C@H]2N 718306526 CYVADYIAUWMSLS-AWEZNQCLSA-N 291.420 2.218 10 10 CECE CNCCCCC(=O)N(C)Cc1ccc(N(C)C)cc1 719735739 SRKKLMZITIZNKX-UHFFFAOYSA-N 277.412 2.101 10 10 CECE CC1(C)[C@@H]2[C@@H](CCCN2c2ccc(CN)cc2F)[C@H]1O 693170642 ZWXDOFGGGPFMSS-BYCMXARLSA-N 278.371 2.270 10 10 CECE O=C(O)[C@@H]1[C@H]2CCN(Cc3c(O)cccc3Cl)C[C@@H]21 721742457 RKMJAOVKICBKFZ-MWODSPESSA-N 281.739 2.198 10 10 CECE COC[C@@H](O)CN[C@@H](C)c1ccc2ccccc2c1O 71270397 GHCGHRNHUBLDCS-AAEUAGOBSA-N 275.348 2.203 10 10 CECE Cc1cn(C)nc1CNCc1cc(Cl)ccc1O 723500639 HTOKSOCCENIEKI-UHFFFAOYSA-N 265.744 2.377 10 10 CECE COc1ccc(N2C[C@@H](C3CC3)NC[C@H]2C)cc1F 86218023 OPAZBZYULGQHDJ-YGRLFVJLSA-N 264.344 2.411 10 10 CECE Oc1cc(Br)ccc1CNN1CCCC1 686779652 HVUUGBVDRQGSCO-UHFFFAOYSA-N 271.158 2.255 10 10 CECE CCN(CC)C1CN(CCCc2ccc(N)cc2)C1 697762426 CMBOFIJQCLCVSR-UHFFFAOYSA-N 261.413 2.227 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@](C)(C(F)F)C2)cc1O 698738670 VYCRUDFAZZAVTI-LKFCYVNXSA-N 287.306 2.306 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1cccc2ccccc12 90258223 SSGRBVGYLRAZEH-CYBMUJFWSA-N 269.308 2.266 10 10 CECE Oc1c(Br)cccc1CNCc1cncnc1 775150793 BBRWWYDCHPRYPN-UHFFFAOYSA-N 294.152 2.235 10 10 CECE Cc1cc(O)nc(CN[C@H](C)c2ccccc2O)n1 879649004 GXCTWSOQURGPPD-SNVBAGLBSA-N 259.309 2.047 10 10 CECE Cc1[nH]nc2ncc(C(=O)N3Cc4cccc(O)c4C3)cc12 1302787522 OGAGVWAANNKJMM-UHFFFAOYSA-N 294.314 2.128 10 10 CECE CC(C)[C@]1(O)CCN(c2ccc3c(c2)CC[C@H]3N)C1 2128328606 PGNLSNMEHVBQIT-CVEARBPZSA-N 260.381 2.230 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc2c(c1)CC[C@@H]2O 2128320147 APFFCBREIOSCKM-MAZHCROVSA-N 261.365 2.263 10 10 CECE C[C@H](O)c1ccc(N2CC3(CCC(O)CC3)C2)cc1 2124673615 VQMKNMRWZKBWOU-LBPRGKRZSA-N 261.365 2.481 10 10 CECE COc1ccc([C@H](C)N[C@@H]2C=C[C@@H](OC)C2)c(O)c1 2119389865 HJAKCGVADPLOJG-QJPTWQEYSA-N 263.337 2.395 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)c(F)c1 2119899851 PPINVPPYFXCKQI-APAOZMKASA-N 265.328 2.350 10 10 CECE COc1ccc(CN2CCOCCC2(C)C)c(O)c1 2126001009 LJYMOGSULCSJNV-UHFFFAOYSA-N 265.353 2.402 10 10 CECE Cc1cc(N(C)C[C@H]2OCC[C@@H]2F)ccc1CCN 2122540697 BRAQCXTVRVOJOC-LSDHHAIUSA-N 266.360 2.059 10 10 CECE Cn1nnc(CN2CCC[C@H]2CN=[N+]=[N-])c1C(F)F 2123005303 QVRNISSSBKZSPL-ZETCQYMHSA-N 271.275 2.027 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@H]4C[C@]4(O)C3)ccc21 2128274730 QBUWKXUWLPLBGY-MAZHCROVSA-N 259.349 2.017 10 10 CECE CCCC1CC(NS(=O)(=O)Cc2ccc(N)cc2)C1 2123485270 YUBJTGQTDJSNHB-UHFFFAOYSA-N 282.409 2.267 10 10 CECE C[C@]1(CO)CCCN1c1ccc2c(c1)CCC[C@@H]2N 2128271673 PAWYHQQIULJZFK-JKSUJKDBSA-N 260.381 2.374 10 10 CECE CN(C)C[C@@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128328133 LJHRBPDJLCRCDP-LRDDRELGSA-N 259.397 2.021 10 10 CECE CN1CC[C@@H](CN(C)c2ccc3c(c2)CC[C@H]3O)C1 2128318581 VYJAFQZLJWMUED-MLGOLLRUSA-N 260.381 2.054 10 10 CECE CO[C@H]1CCN(c2ccc3c(c2)CC[C@H]3N)C[C@H]1C 2128315118 OHMSAXSRNXBHIR-LYRGGWFBSA-N 260.381 2.494 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(C)CC(F)(F)F)ccc21 103068968 XGJLQTKBPCHHOT-LLVKDONJSA-N 287.285 2.288 10 10 CECE C[C@H]1C[C@H](N(C)CC(=O)Nc2ccc(N)cc2)CS1 2132952667 KKTRMZUPISGGBY-GWCFXTLKSA-N 279.409 2.033 10 10 CECE CCCN(Cc1ccc(N)cc1)C[C@@H]1[C@@H]2COC[C@@H]21 2132391579 WYHJZOWNHDVNPI-MUJYYYPQSA-N 260.381 2.373 10 10 CECE CC(C)[C@@H](COC(F)F)NCc1ccc(O)cc1O 2130913804 GSTIKNRBDLYOJE-LLVKDONJSA-N 275.295 2.451 10 10 CECE O=C(O)C1CC(Sc2ncc([N+](=O)[O-])s2)C1 1900369860 DXGLZCLGSXCYER-UHFFFAOYSA-N 260.296 2.007 10 10 CECE Nc1ccc(CN=c2[nH]ccnc2C(F)(F)F)cc1 2133216431 NHEZYUCTKKJFOL-UHFFFAOYSA-N 268.242 2.112 10 10 CECE Nc1ccc(CC(=O)c2ccnn2C(F)(F)F)cc1 2135011416 RDVPFGUANLRUOZ-UHFFFAOYSA-N 269.226 2.367 10 10 CECE CN(CC1CC2(CC2)C1)C(=O)COc1ccc(N)cc1 1913802040 PGIOGMDYHPALRC-UHFFFAOYSA-N 274.364 2.296 10 10 CECE COc1ccc(O)c([C@H](C)NCC(C)(C)[C@H](C)O)c1 1913837337 DKTWPNZERXLJAA-QWRGUYRKSA-N 267.369 2.458 10 10 CECE COC[C@@H]1C[C@H]1CN(C)c1ccc(CN)c(F)c1F 2133441563 YLWNRKVCBAKHDX-QWRGUYRKSA-N 270.323 2.142 10 10 CECE Nc1ccc(C=CC(=O)NCc2ccccc2O)cc1 1911815281 YRLTUPONTWDDKY-UHFFFAOYSA-N 268.316 2.304 10 10 CECE CC(C)N1CCN(c2ccc(C=CC(=O)O)cc2)CC1 1911839522 CFZBJOGEPAJEIB-UHFFFAOYSA-N 274.364 2.315 10 10 CECE COc1ccc(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)c(F)c1 1912191476 RYQVCXHZWRZFCO-MRVPVSSYSA-N 264.260 2.359 10 10 CECE C[C@@H]1CCC[C@H](S(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1912143504 HBSWVHHIDSSYDY-VWYCJHECSA-N 272.374 2.280 10 10 CECE COCCOCCCN1CCC[C@@H](CN=[N+]=[N-])C1 1912161740 MXLUQGSJTANWCD-LBPRGKRZSA-N 256.350 2.062 10 10 CECE COc1ccc(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)cc1O 1912168858 XGZZQBCCEYLWDL-SECBINFHSA-N 276.296 2.173 10 10 CECE C[C@H]1CCC[C@H]1CS(=O)(=O)NCCCN=[N+]=[N-] 1912161875 OJTQDLSVAXTPPS-UWVGGRQHSA-N 260.363 2.042 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(S(=O)(=O)c2cc(F)ccc2F)C1 1912182524 CNOSBMFHIAFLRI-MRVPVSSYSA-N 288.279 2.038 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)c2cccnn2)C1 1912172940 XXFXLGGBDJCFLM-SNVBAGLBSA-N 260.301 2.029 10 10 CECE CN(Cc1cccnn1)c1ccc(C=CC(=O)O)cc1 1912115601 LSKOCXAVSNFFKT-UHFFFAOYSA-N 269.304 2.211 10 10 CECE [N-]=[N+]=NCC1CCN(C[C@H](O)CC(F)(F)F)CC1 1912201237 RKJOJMMHMIUHGR-SECBINFHSA-N 266.267 2.322 10 10 CECE CC(C)(C)OC1CC(C(=O)N2CC(N=[N+]=[N-])C2)C1 1912206120 FBMJYVOYCHRYCJ-UHFFFAOYSA-N 252.318 2.101 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1C[C@@H]2CC[C@@H]2C1 2134952867 YZPGUYKYIYKGRJ-NOOOWODRSA-N 266.345 2.254 10 10 CECE CN(c1ccc(CO)cc1Cl)C1(CO)CCC1 1914971848 BPQSTYBKIPEXAV-UHFFFAOYSA-N 255.745 2.184 10 10 CECE CN[C@H](C)c1ccc(N2CCNC(=O)C2(C)C)c(Cl)c1 110658528 OSXHZQGGVDJSCB-SNVBAGLBSA-N 295.814 2.335 10 10 CECE CCN[C@H](c1ccccc1O)[C@@]1(O)CC[C@@H](COC)C1 1918611076 BITKIKZHKHSDAL-DAXOMENPSA-N 279.380 2.220 10 10 CECE Cc1ncc(C(=O)NCc2cccc(Cl)c2O)n1C 1606868350 NESXLOPNFOBRES-UHFFFAOYSA-N 279.727 2.018 10 10 CECE CN(C)c1ccc(OCC2(C(N)=S)CC2)cc1 2215968245 SUUWYVGQTHLTDN-UHFFFAOYSA-N 250.367 2.198 10 10 CECE COc1cc(OC)c2c(c1)[C@@H](N(C)O)CCCN2C 212097711 FPTMGFHOQGHMHC-LBPRGKRZSA-N 266.341 2.296 10 10 CECE CN(C)[C@@H]1CCC[C@H]1NCc1ccc(F)c(F)c1O 1921750232 RAFKHXZIMQNJCC-VXGBXAGGSA-N 270.323 2.243 10 10 CECE C[C@@H](NC(=O)c1cn(C)nc1Cl)c1ccccc1O 1471195109 BVCBNGZNRYDHHO-MRVPVSSYSA-N 279.727 2.270 10 10 CECE Nc1ccc(CN(c2ncc(F)cn2)C2CC2)cc1 228130520 HBNYVOQIAUMCCO-UHFFFAOYSA-N 258.300 2.367 10 10 CECE Cc1ccc([C@@H](C)N(C)CC(=O)NCC(C)C)c(O)c1 228302921 CQYXBUQQCFDQCY-CYBMUJFWSA-N 278.396 2.466 10 10 CECE O=C(Oc1cccc2c1OCCO2)c1cccc(O)c1O 1624777252 WOYKMSPJHPZZOL-UHFFFAOYSA-N 288.255 2.088 10 10 CECE CCCC[C@H](O)CCC(=O)NCc1ccc(O)cc1O 1626850775 XABHSDOVXPIGQJ-LBPRGKRZSA-N 281.352 2.045 10 10 CECE CC[C@@]1(F)CCN(C(=O)[C@H]2CNc3ccccc3N2)C1 1925601098 QSZQOYHZNLFAIQ-UKRRQHHQSA-N 277.343 2.243 10 10 CECE COc1ccc(O)c(CN[C@H](C)[C@@H]2C[C@@H]3CCO[C@@H]23)c1 1926218345 HGZSYSNRWDPDCW-PSHZPRKYSA-N 277.364 2.304 10 10 CECE Cc1cc(NC(=O)c2c(F)ccc(O)c2O)sn1 1638695901 VDKVVCISILCFAN-UHFFFAOYSA-N 268.269 2.254 10 10 CECE CC1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(O)c(O)c1 1585011082 QHWQUFGNERDPAR-VGPLMAKISA-N 275.348 2.430 10 10 CECE Cc1cc(N(CCC(N)=O)Cc2ccccc2)ccc1CN 1931981882 IAEBKNUJVVEBOU-UHFFFAOYSA-N 297.402 2.336 10 10 CECE CCNC1CCN(Cc2cc(F)ccc2O)CC1 1963285954 ULOCDROGQYNVAY-UHFFFAOYSA-N 252.333 2.105 10 10 CECE CCOC(=O)CCC[C@H](N)c1cc(F)ccc1O 1951606151 WEAWXVWOFGQQMY-NSHDSACASA-N 255.289 2.265 10 10 CECE Cc1ccc(CN2CCNC[C@@H]2CC(F)F)c(O)c1 2139773220 BDTIMQBUTMLROH-LBPRGKRZSA-N 270.323 2.130 10 10 CECE CCCC1=NN(C)C(=O)/C1=C/c1ccc(O)c([N+](=O)[O-])c1 1865677996 NVJBTRDWADOJCZ-JXMROGBWSA-N 289.291 2.312 10 10 CECE CN(C)c1ncc(/C=C/C(=O)N2CCc3ccccc32)cn1 1866371592 NOJPHSQEIRJZNE-BQYQJAHWSA-N 294.358 2.145 10 10 CECE CC(=O)Nc1cccc(C(=O)Nc2ccc(N)cc2)c1 20327333 YRYSHMZGTGLBHC-UHFFFAOYSA-N 269.304 2.480 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H]2CC[C@@H](O)C2)c1 234974677 SXURMZXJZGQVJH-QJPTWQEYSA-N 265.353 2.212 10 10 CECE C[C@@H](O)c1ccccc1NCc1ccc(O)c(O)c1O 235227644 NVHZJFISDSNXLX-SECBINFHSA-N 275.304 2.469 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCCC[C@@]1(C)C(=O)O 235180494 OYGOCYCVPODQNI-BMIGLBTASA-N 279.336 2.488 10 10 CECE COC[C@@H](CNC(=O)Nc1ccc(N)cc1)C(C)C 926143341 OHHWGJJKVSHKOP-LLVKDONJSA-N 265.357 2.309 10 10 CECE O=C(NCc1ccccc1O)c1cnc2cc[nH]c2c1 1137471319 GLNZDLOIFDEQBM-UHFFFAOYSA-N 267.288 2.199 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1nccc(Cl)c1F 1948717436 XNBNOGYWCBAWQL-UHFFFAOYSA-N 257.656 2.256 10 10 CECE C[C@H](N[C@@H]1CCc2cccc(O)c21)[C@@H](O)C(F)(F)F 866463032 HCUULPOYJSRHMZ-LPBBDHJYSA-N 275.270 2.281 10 10 CECE CN(C[C@@H]1C[C@H]1CF)c1ccc([N+](=O)[O-])c(CO)c1 1875810972 DOPYWQPQMRXIQH-UWVGGRQHSA-N 268.288 2.129 10 10 CECE CCCOc1cc(N2CC[C@H]([C@@H](C)N)C2)ccc1N 1876325441 JOEPOIGRVGFYOC-NEPJUHHUSA-N 263.385 2.231 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C23CCC(CC2)O3)CC1 1876797364 MVEUFQQUQXLWNT-ZBOXLXRLSA-N 264.329 2.389 10 10 CECE CN(Cc1ccccc1O)[C@H]1CNC12CCCCC2 1877546080 RQIXXBMSJYZGIK-HNNXBMFYSA-N 260.381 2.499 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cccc3nc[nH]c23)C1 1878209723 XCOUCRWXMUCDHH-QMMMGPOBSA-N 256.269 2.088 10 10 CECE N[C@H]1CCC2(CCC2)N(Cc2cc(F)ccc2O)C1 1878997479 ADSUSZLFYOTKGD-ZDUSSCGKSA-N 264.344 2.377 10 10 CECE C[C@H](O)[C@H]1CCCN1c1c(F)cc([C@@H](C)O)cc1F 1880484597 GVLGIPHAFBRKRQ-VYUIOLGVSA-N 271.307 2.368 10 10 CECE Oc1c(Cl)cccc1CN1CCOC(F)(F)C1 1946947824 FHIFZZCEYKTRHG-UHFFFAOYSA-N 263.671 2.471 10 10 CECE CN(Cc1ccc(F)cc1O)C[C@H]1CCCN1C 1964567950 FJFRSMAUGAXPNJ-CYBMUJFWSA-N 252.333 2.057 10 10 CECE C[C@H]1CCC[C@@]1(O)CNCc1c(O)cccc1F 1964569437 JZDVUNPSRSAKOD-IINYFYTJSA-N 253.317 2.172 10 10 CECE COc1ccc(CNCc2ncnn2C(C)C)cc1C 1964577993 YJOAYQHVERGFAT-UHFFFAOYSA-N 274.368 2.466 10 10 CECE Cc1cscc1[C@@H](NCCCN=[N+]=[N-])C(=O)O 1951011840 SGSYNDKFRXTIJJ-SECBINFHSA-N 254.315 2.472 10 10 CECE COC(=O)[C@H]1CCN[C@@H](c2ccc(Cl)cc2O)C1 1952452037 FLWXJECFOJJEGD-GZMMTYOYSA-N 269.728 2.259 10 10 CECE COCc1nocc1CNCc1cc(C)ccc1O 1967714443 ARUYPFUFLWUMNY-UHFFFAOYSA-N 262.309 2.125 10 10 CECE COc1cc(N)c(N(C)[C@H]2CCCC[C@H]2O)cc1OC 252921003 GNBOGRYHARTVJN-WCQYABFASA-N 280.368 2.026 10 10 CECE CC[C@@H](O)[C@@H](CC)NCc1c(O)cccc1OC 1971804650 XWUKDAFTARIPTO-VXGBXAGGSA-N 253.342 2.040 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1CC[C@]12CCCO2 1974348636 YVJSKGKSDYLOMA-GXTWGEPZSA-N 269.291 2.472 10 10 CECE CC[C@H](NC1CC(CS(C)(=O)=O)C1)c1ccccc1O 1974459296 QRSNQHHVAXYBHN-YIZWMMSDSA-N 297.420 2.256 10 10 CECE C[C@H](Cc1nccn1C)N[C@H](C)c1c(O)cccc1O 2148121304 DUJBFDHHRAAWLY-GHMZBOCLSA-N 275.352 2.113 10 10 CECE CN1C[C@H](CN)C[C@@H]1c1cc2c(cc1O)CCCC2 258433125 PTFKEJJHUQQZKJ-XHDPSFHLSA-N 260.381 2.223 10 10 CECE COC(=O)CCCCN1CCc2cc([C@@H](C)N)ccc21 2145825441 CUWUXSDMIHSVJE-GFCCVEGCSA-N 276.380 2.412 10 10 CECE C[C@H](C(=O)N1CCCCC1)N(C)Cc1ccc(N)cc1 35360524 QUXXZJWDUYASEY-CYBMUJFWSA-N 275.396 2.102 10 10 CECE C[C@H]1CN(CCOc2ccc(N)cc2)CC(C)(C)CO1 2148894981 GUNVPSJEPBDJHR-ZDUSSCGKSA-N 278.396 2.395 10 10 CECE CC[C@@H](C)C[C@@](N)(CO)CSc1nccs1 1995399406 DUUOABOSDIHWLK-MWLCHTKSSA-N 260.428 2.361 10 10 CECE CCCNCc1ccc(N(C)CC(=O)N(C)C)c(Cl)c1 163943494 UMASIEWMYNHRDF-UHFFFAOYSA-N 297.830 2.364 10 10 CECE Nc1ccc(C[C@@H](O)c2cnn([C@@H]3CC3(F)F)c2)cc1 2151315493 RYKSCTQOTGNRIS-CHWSQXEVSA-N 279.290 2.322 10 10 CECE NCc1cc(F)c(N2CCC[C@@H]3OCC[C@H]3C2)c(F)c1 2151887182 UTCWPIZJKKAMHT-FZMZJTMJSA-N 282.334 2.429 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1COC[C@@H]1CC1CC1 2158040794 ZVBDTPVRHHVBHR-GXFFZTMASA-N 276.336 2.194 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@]2(C)CO)cc1O 2153560586 OHHAYSHHIMBXPX-MLGOLLRUSA-N 278.396 2.414 10 10 CECE C[C@]1(O)CC[C@H](NCc2cccc(Cl)c2O)C1 2013794816 ZNQWLADFFYHVNQ-GWCFXTLKSA-N 255.745 2.439 10 10 CECE CO[C@@H]1CCO[C@@H](CN[C@H](C)c2cc(F)ccc2O)C1 2154203517 XPTJKDNAMKSRAL-RAIGVLPGSA-N 283.343 2.376 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CN)cc1Cl 2018119577 OTQIAGGKKQUYKY-SKDRFNHKSA-N 254.761 2.148 10 10 CECE c1cc(N2CCCCC2)ccc1CNCC1OCCO1 2019448268 XQQPGJZUPBAAIA-UHFFFAOYSA-N 276.380 2.139 10 10 CECE C[C@H](NC1CCN(CCF)CC1)c1c(O)cccc1O 2154496460 UYSPWGRIERHRSX-NSHDSACASA-N 282.359 2.182 10 10 CECE CCOC[C@@H](O)COc1ccc(CNC2CC2)cc1C 2155014128 SBPIEMWWLZFGMU-OAHLLOKOSA-N 279.380 2.023 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1Cl 2030271988 DHLGBOVVNGSCDN-KMLBCRHOSA-N 267.756 2.068 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@](C)(O)C(F)F 2031153459 KEHVIKPBWPRMPU-DGCLKSJQSA-N 259.296 2.449 10 10 CECE CCN[C@H](c1ccccc1O)[C@@](C)(O)C(F)(F)F 2031152012 BEVSDNKPSKAGBB-GHMZBOCLSA-N 263.259 2.356 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3C[C@H]2CO3)c(F)c1 2035543231 AYYNVDBJXLTRJS-USWWRNFRSA-N 250.317 2.213 10 10 CECE CNCc1ccc(N2C[C@H](C(N)=O)CC[C@H]2C)cc1Cl 300498842 NRIDOZTWYIMZEL-ZYHUDNBSSA-N 295.814 2.150 10 10 CECE CCC1(S(=O)(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)CC1 2038004069 DOCUOWIEJZBRQW-SNVBAGLBSA-N 272.374 2.424 10 10 CECE C[C@H]1C[C@H](CCNCc2cccc(F)c2O)CO1 2041486738 OGFMNRVNDYGQJS-QWRGUYRKSA-N 253.317 2.436 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC[C@]34CCSC4)ccc21 2158500333 OUKLLCABONOIOZ-UKRRQHHQSA-N 289.404 2.114 10 10 CECE COc1ccc(C(=O)CCc2ccc(N)cc2)cn1 401362834 CQSFSIHHZHDMPP-UHFFFAOYSA-N 256.305 2.488 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1 403676863 PFWCZFJTPLCPSL-MRVPVSSYSA-N 262.269 2.013 10 10 CECE Nc1ccc(CCc2nc(C3CSC3)no2)cc1 404677493 DXVJMUFBYTVKKS-UHFFFAOYSA-N 261.350 2.267 10 10 CECE CCCN(CCn1ccsc1=O)Cc1ccc(N)cc1 700222677 MSFPLCSCIIBSBO-UHFFFAOYSA-N 291.420 2.404 10 10 CECE CN1CCc2cc(CN[C@H]3COCC3(C)C)ccc21 313056502 BXHPMLWDZVPFEO-HNNXBMFYSA-N 260.381 2.194 10 10 CECE CSCCSC[C@H](O)COc1ccc(N)cc1 319249295 BSKQIHBXBACZLC-LLVKDONJSA-N 273.423 2.105 10 10 CECE CCc1noc(CN(C)CCCc2ccc(N)cc2)n1 2160395696 QHCGPISCNYFXOB-UHFFFAOYSA-N 274.368 2.279 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC(C)(N(C)C)C1 2160653654 GEMALQHRDQRDST-UHFFFAOYSA-N 273.424 2.387 10 10 CECE COc1cccc(O)c1CN1CC[C@H](CCN)C[C@H]1C 2160729511 VGZVKTVIXIAKDN-OLZOCXBDSA-N 278.396 2.350 10 10 CECE Cc1cc(N(C)C[C@@H]2CCCN(C)C2)ccc1CN 705106122 HXQBEEIXMKYKJR-CQSZACIVSA-N 261.413 2.232 10 10 CECE COC[C@@H]1CN(c2ccc([C@@H](C)O)cc2Cl)CCO1 705830482 RKFUNKIMOGDDTA-PWSUYJOCSA-N 285.771 2.245 10 10 CECE C[C@]12CCCC[C@@H]1CN2c1ccc2c(c1)NC(=O)[C@@H]2O 706380408 HMIQOPOAHXZVAA-HQQWDMGQSA-N 272.348 2.441 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1 710170527 GFHGJIIJCXBSLT-BQDHKBFISA-N 261.365 2.480 10 10 CECE CC(C)(C)N(CC(=O)O)Cc1cc(F)cc(F)c1O 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10 CECE c1nc(CNCc2ccc(N3CCCCC3)cc2)no1 231781037 HKFBEEMZWDZGDH-UHFFFAOYSA-N 272.352 2.350 10 10 CECE NC(=O)c1cnc(NCc2c(O)cccc2F)c(Cl)c1 1655875325 DAFUSNPFTYRXLP-UHFFFAOYSA-N 295.701 2.291 10 10 CECE O=C(NCc1cccc(O)c1O)c1cccc(F)c1 1593734147 KZVDCIDYMYQCHE-UHFFFAOYSA-N 261.252 2.167 10 10 CECE COc1cc(N2CC3(CC3)C2)ccc1C=CC(=O)O 2139682534 JGDCOIRGLNNLAN-UHFFFAOYSA-N 259.305 2.393 10 10 CECE CC(C)C[C@H](CO)CNCc1cc(F)cc(F)c1O 1962904701 UUAHNDMODDSGAP-JTQLQIEISA-N 273.323 2.415 10 10 CECE C[C@@]1(O)CCCN(c2ccc(CNC3CC3)cc2F)C1 163366377 CVVCSNAVQDVUOP-MRXNPFEDSA-N 278.371 2.429 10 10 CECE CC[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(N(C)C)cc1 152426568 BQBZUEFHGFKGEK-GOEBONIOSA-N 289.423 2.414 10 10 CECE CC[C@H](CO)CN(C)c1ccc(OC)c(C)c1OC 258925703 HFTORVSXMALYQO-LBPRGKRZSA-N 267.369 2.467 10 10 CECE Nc1ccc(F)c(NC(=O)c2cccc(O)c2O)c1 125953441 UJKDXEDLWGLHOZ-UHFFFAOYSA-N 262.240 2.071 10 10 CECE COC(=O)CCN(C)c1cc(C)c(OC)cc1C 258996307 YGWNKZRBPWUGFS-UHFFFAOYSA-N 251.326 2.311 10 10 CECE 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C[C@@H]1CCNCCN1Cc1cc(Br)ccc1O 1947794284 BOJUOINKRYKLAP-SNVBAGLBSA-N 299.212 2.339 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@@H]1[C@@H]2CCNC[C@H]21 1877517248 GFGRALOLXJVIJB-NMFUWQPSSA-N 260.381 2.241 10 10 CECE Cc1cc(CN(C)Cc2ccccc2O)c[nH]c1=N 1877530108 ZPABDORHTWUPGT-UHFFFAOYSA-N 257.337 2.140 10 10 CECE C[C@H](N)c1cc(F)c(N2CCCC[C@H](O)C2)c(F)c1 1880928258 PWQOVFKIWRSYBF-ONGXEEELSA-N 270.323 2.336 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1CCC[C@@H](O)C1 37166047 GAFIYBBQGZOSNB-NWDGAFQWSA-N 255.745 2.439 10 10 CECE CNCc1ccc(N(C)CC[C@@H]2CCOC2)c(F)c1 1885693154 AKDRVXYMLCYZCA-GFCCVEGCSA-N 266.360 2.408 10 10 CECE CN1CCc2cc([C@H](N)[C@]34C[C@H](CCO3)C4)ccc21 1886821178 KJWHQXRHRZCOJQ-KNXALSJPSA-N 258.365 2.248 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H]2CN(C)C)cc1O 251493451 DEJOQYABPJDCGP-OCCSQVGLSA-N 277.412 2.203 10 10 CECE OC[C@H]1CCC[C@@H](NCc2c(O)cccc2F)C1 1970883622 RDQWOFPPQQEACE-WDEREUQCSA-N 253.317 2.172 10 10 CECE C[C@H]1CCN(Cc2ccc3c(c2)CCN3C)C[C@H]1CN 253190948 LQHWASKRCNDKOC-XJKSGUPXSA-N 273.424 2.096 10 10 CECE CCN[C@H](c1ccccc1O)[C@](C)(O)[C@@H]1CCCCO1 2148153564 PGCPYLRNXKNSRW-ARFHVFGLSA-N 279.380 2.363 10 10 CECE COc1cc2c(cc1OC)N1C[C@H](C)CC[C@H]1C(=O)N2 2146264572 WNSDMQBASFBDIT-KOLCDFICSA-N 276.336 2.261 10 10 CECE C[C@H]1CCN(c2ccc([C@@H](C)N)cc2)[C@H]1C(=O)N(C)C 2146458230 WVIQSYOOVLOVDK-YWPYICTPSA-N 275.396 2.009 10 10 CECE OCC1CCN(c2ccc(CNC3CC3)cc2F)CC1 34824561 ZTRXQBQKKAHFPR-UHFFFAOYSA-N 278.371 2.286 10 10 CECE CC[C@@H](C)NC(=O)[C@@H](C)N(CC)Cc1ccc(N)cc1 35364048 WNRBRUQZYYVHBW-CHWSQXEVSA-N 277.412 2.394 10 10 CECE CC(C)C[C@@H]1CCN1C[C@H](O)COc1ccc(N)cc1 2148944160 RZSIDFKKUGXASX-GJZGRUSLSA-N 278.396 2.129 10 10 CECE Cc1ncccc1[C@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2147377569 CYBJVRAJXYVRDO-HOTGVXAUSA-N 271.364 2.189 10 10 CECE CN1CCc2cc(CNC[C@@H]3[C@H]4CCOC[C@H]43)ccc21 2150064051 MSGILQKIBDPLFD-BZUAXINKSA-N 272.392 2.051 10 10 CECE CN(Cc1ccccn1)C(=O)CCc1ccc(N)cc1 37991209 YGRUIECIMSKHQI-UHFFFAOYSA-N 269.348 2.255 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C1CCOCC1 38089704 APHSFCRIJIVRGC-NSHDSACASA-N 263.337 2.338 10 10 CECE CCNCc1ccc(N2CCNC(=O)C2(C)C)c(Cl)c1 164070098 GYLABOVKLYKCEW-UHFFFAOYSA-N 295.814 2.164 10 10 CECE C[C@H]1CC[C@@](NCCN=[N+]=[N-])(C(N)=O)c2ccccc21 164049299 BXYHRFJPCXMNKT-HZMBPMFUSA-N 273.340 2.164 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3[C@H](O)CCC[C@H]3C2)cc1O 2150978184 SCTRLQZYUFEDHZ-UOVKNHIHSA-N 277.364 2.043 10 10 CECE COc1ccc(CN[C@H]2COC[C@H]2CC2CC2)c(O)c1 2158044914 YQOKGFXGYFAEJQ-HIFRSBDPSA-N 277.364 2.306 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@H](F)C[C@@H]1C(=O)O 2151949907 ZGWYRVSHSYRHGN-MPKXVKKWSA-N 280.343 2.311 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)O)c(Cl)c2)[C@H]2COC[C@H]12 2158352667 IGLQMBHREAUKNJ-MOUXYMJCSA-N 297.782 2.243 10 10 CECE COCCN1CCCN(Cc2ccc(Cl)cc2O)CC1 2154736475 WENDSJWSHGOIJP-UHFFFAOYSA-N 298.814 2.200 10 10 CECE O=C(N[C@H]1CCC=C1Br)c1cccc(O)c1O 2020062078 NOVRCUVCAKIKGP-VIFPVBQESA-N 298.136 2.269 10 10 CECE CO[C@]1(C(=O)O)CCCN([C@@H](C)c2ccccc2O)C1 700368639 QOIHUGKPBIEZKY-XHDPSFHLSA-N 279.336 2.019 10 10 CECE C[C@H]1CCC[C@](CO)(NCc2ccc(O)cc2O)C1 53115771 LWOOTUINQWIGMI-NHYWBVRUSA-N 265.353 2.129 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@H]1CC1(C)C 700665469 INABRJCZRDLANK-NXEZZACHSA-N 254.334 2.254 10 10 CECE CN(Cc1ccc(Cl)cc1O)C1CC(C(=O)O)C1 2029654882 BRDLAEVMNDSADV-UHFFFAOYSA-N 269.728 2.341 10 10 CECE COc1ccc(N2C[C@@H](O)CCC2(C)C)c([N+](=O)[O-])c1 2156098164 KASSYVNXTIQQEI-JTQLQIEISA-N 280.324 2.343 10 10 CECE C[C@@H](N[C@@H](CO)C(F)(F)F)c1ccc(F)cc1O 2030008249 XTFUMRBDMHHLIM-LDWIPMOCSA-N 267.222 2.105 10 10 CECE CO[C@H](COc1ccc(N)cc1)[C@@H]1CCCOC1 2032890893 TWTFVCPHLZBLHX-BXUZGUMPSA-N 251.326 2.089 10 10 CECE COc1ccc([C@H](C)NCc2cnc(C)cn2)c(O)c1 61320322 QZCNXZGPJIBFLH-NSHDSACASA-N 273.336 2.350 10 10 CECE CCN[C@@H](c1ccccc1O)c1nn(C)cc1Cl 2033315416 IFZUOCWZRODNPV-LBPRGKRZSA-N 265.744 2.478 10 10 CECE CN(CCN1CC[C@H](CN=[N+]=[N-])C1)CC(F)(F)F 2037561020 NMNHSJJKMSIPCU-SECBINFHSA-N 265.283 2.113 10 10 CECE CC(C)OC1CN(c2ccc([C@@H](C)O)cc2F)C1 2040861596 MIDHSEWCEBNDKV-SNVBAGLBSA-N 253.317 2.493 10 10 CECE C[C@H]1C[C@@H](CCNCc2ccc(O)c(O)c2)CO1 2041487190 QXLZDPLTBNMLTJ-CMPLNLGQSA-N 251.326 2.003 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])c1ccns1 404459928 ZIVKVTFKQPOKKX-SECBINFHSA-N 269.330 2.037 10 10 CECE CC(C)(C)NC(=O)CCNCc1ccc(F)c(F)c1O 700744523 ZFSUOGYMNFJKKL-UHFFFAOYSA-N 286.322 2.065 10 10 CECE COC(=O)[C@@H](N[C@@H]1CCc2cccc(O)c21)C(C)C 311702641 MIQQLFRQEYIBPY-RISCZKNCSA-N 263.337 2.167 10 10 CECE CN(C)C1CC(NCc2ccc(Br)cc2O)C1 701499515 MSSMJTTUULOQNH-UHFFFAOYSA-N 299.212 2.337 10 10 CECE NCc1ccc(N(C2CC2)[C@H]2CCC(F)(F)[C@@H]2O)cc1 2160104756 XUSVZZNXRUXZCX-UONOGXRCSA-N 282.334 2.273 10 10 CECE CN(C)c1ccc(Cn2cncc2[C@H]2CCCN2)cc1 2160480702 OHPLWDRYMSFBDM-OAHLLOKOSA-N 270.380 2.422 10 10 CECE COc1ccc(O)c(CN[C@@H]2CCC[C@H]3OCC[C@@H]23)c1 2160438168 IRLVDKQWTFLMHV-SQWLQELKSA-N 277.364 2.448 10 10 CECE CCO[C@@H]1CCN(Cc2cc(CNC)ccc2OC)C1 701670030 VHAWSKDWWKZIDZ-OAHLLOKOSA-N 278.396 2.025 10 10 CECE Cc1cccnc1CN(C)C(=O)c1ccc(O)c(O)c1 2161701414 XOWXFYRMECCTAW-UHFFFAOYSA-N 272.304 2.073 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC(C)(N)CC1 704535743 KWCCEULLPHRTNO-JTQLQIEISA-N 252.333 2.406 10 10 CECE CS[C@@H]1CN(CCCc2ccc(N)cc2)C[C@@H]1N(C)C 2170699879 VLFXZQGFHBBPNO-JKSUJKDBSA-N 293.480 2.179 10 10 CECE COCCNCc1ccc(N2CC[C@H]3C[C@@H]32)cc1C 707092829 HNQBIZFFTSNPKU-BBRMVZONSA-N 260.381 2.330 10 10 CECE CC[C@@H](O)c1ccc(N2CC(n3cccn3)C2)cc1 707609351 REHOVYDSKKEFPJ-OAHLLOKOSA-N 257.337 2.388 10 10 CECE COc1cccc(CN(C)C[C@]2(C)CCOC2)c1O 687526700 SOOBMQAOENBGMF-HNNXBMFYSA-N 265.353 2.259 10 10 CECE CC(=O)Nc1ccc(C=C2SC(=S)NC2=O)cc1 2053493252 JOYWUPKLLQWEGW-UHFFFAOYSA-N 278.358 2.134 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](CO)CC2)cc1O 378835416 MATMRHBWGCDMGZ-NWDGAFQWSA-N 264.369 2.011 10 10 CECE C[C@@H](NCCO[C@H]1CC1(F)F)c1ccccc1O 690724258 DQSFWHOYFDLCGS-SKDRFNHKSA-N 257.280 2.467 10 10 CECE C[C@@H]1CC[C@@H](N)CN1[C@H](C)c1cc(F)ccc1O 690890110 BJPRTSGFYOIXCR-CKYFFXLPSA-N 252.333 2.404 10 10 CECE CC[C@@H](NC)c1ccc(N(CC)[C@H]2CCNC2=O)cc1 2171238192 SKGCQAFGRCLEDB-CABCVRRESA-N 275.396 2.072 10 10 CECE CN([C@H]1C[C@H]2CC[C@H]1C2)S(=O)(=O)Cc1ccc(N)cc1 382286101 PEYIHBUZQSPAGY-YDHLFZDLSA-N 294.420 2.219 10 10 CECE CCNCc1ccc(N(C)[C@H](C)C(C)(C)O)cc1 382826547 AHCJJNGGLYNZBF-GFCCVEGCSA-N 250.386 2.392 10 10 CECE CC1(C)COc2ccc(N3C[C@H](N)[C@H](C(F)F)C3)cc21 2162635838 MJOYXLUNVJCZMY-PWSUYJOCSA-N 282.334 2.385 10 10 CECE CN1CCC[C@](O)(c2ccc3c(c2)CCCN3C)CC1 2163091041 CMCGBKOZNNJCKY-QGZVFWFLSA-N 274.408 2.372 10 10 CECE CCCn1cncc1[C@@H](N)c1ccc2c(c1)CCN2C 2163140278 HPSMFLJXMVYNOZ-INIZCTEOSA-N 270.380 2.334 10 10 CECE COc1ccc([C@@H](C)NCCC2(O)CCC2)c(O)c1 397828753 JZEZJGXJVUZFKK-LLVKDONJSA-N 265.353 2.357 10 10 CECE CCNCc1ccc(OC)c(CN2CC[C@H](C)C2=O)c1 399740872 NMDYBJRGDSCPBR-LBPRGKRZSA-N 276.380 2.173 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@@H]1[C@@H]2CCO[C@H]21 2176444267 FUSRYMBLDWHLJB-ARFHVFGLSA-N 276.380 2.004 10 10 CECE Cc1cc(O)n2ncc(C(=O)N3C[C@H](C)CC[C@H]3C)c2n1 2063194855 AEQYLXSOSFIOBT-MWLCHTKSSA-N 288.351 2.004 10 10 CECE O=C(C[C@H]1CC=CCC1)NCc1c(O)cc(O)cc1O 2064435808 QKRRIAHZDOCYQW-JTQLQIEISA-N 277.320 2.166 10 10 CECE CN1CCc2cc([C@]3(O)CCC[C@H](N)C3(C)C)ccc21 2173005627 LIFZHKZKVYXMCK-DOTOQJQBSA-N 274.408 2.404 10 10 CECE CCN(CC)C(=O)CCOc1ccc(CNC)cc1C 2173774024 PSOMAKIWCQNHPF-UHFFFAOYSA-N 278.396 2.352 10 10 CECE c1cc(N2CCCCC2)ccc1CN[C@H]1[C@H]2COC[C@H]21 2174637921 CEEBGHQDDFXAGO-BJWYYQGGSA-N 272.392 2.411 10 10 CECE CN(c1c(F)cc(CN)cc1F)C1C[C@H]2C=C[C@@H](C1)O2 2175123134 AKIDFHZCOGAGPS-YOGCLGLASA-N 280.318 2.346 10 10 CECE COC[C@@H]1CN(CCOc2ccc(N)cc2)CC1(C)C 2175248242 WSNWLFZDZNRJLL-ZDUSSCGKSA-N 278.396 2.252 10 10 CECE Nc1ccc(CCC(=O)N2C(=O)[C@H]3CCCC[C@H]32)cc1 2191666440 VOJOYNGJRWOILF-UONOGXRCSA-N 272.348 2.129 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](CO)[C@@H](C)C2)c(F)c1 2194711138 UXVAOEUGIZUQQK-GARJFASQSA-N 284.350 2.439 10 10 CECE Nc1ccc(CCCN2CC[C@H]3C[C@]2(C(=O)O)C3)cc1 2192555776 DNDKDMWEMBRIDK-AKAXFMLLSA-N 274.364 2.141 10 10 CECE CN(CCOc1ccc(N)cc1)Cc1ccccc1O 2192571099 ZFTRGNKCZJEPJJ-UHFFFAOYSA-N 272.348 2.485 10 10 CECE CCOc1cccc(CN[C@H]([C@@H](C)O)C(F)(F)F)c1O 2195325212 NNTVFOPAMMMRLT-PRHODGIISA-N 293.285 2.192 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@@H]1CCN(C)C(=O)C1 2188463921 MTNGJRXPWCAXBG-ZYHUDNBSSA-N 280.343 2.145 10 10 CECE C[C@H]1C[C@@H](N(C)c2ccc(CO)c([N+](=O)[O-])c2)CCO1 2188577837 VRMIOZRATIWYCJ-GWCFXTLKSA-N 280.324 2.091 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]4CC[C@@H]4C3)ccc21 2188536377 QLEOBGXKFWVTAI-HFAKWTLXSA-N 271.364 2.136 10 10 CECE Cn1c([C@H](O)Cc2ccc(N)cc2)cnc1C(F)(F)F 2181762520 OUSGGVYKCCJBRL-LLVKDONJSA-N 285.269 2.297 10 10 CECE CN1CCCc2cc(N3C[C@@H]4CCC[C@H](C3)N4)ccc21 2182308878 YVETVCJWKVUMCH-GASCZTMLSA-N 271.408 2.400 10 10 CECE CN(c1ccc2c(c1)OC(F)(F)O2)C(C)(C)CN 2044341370 BZFFXURGOCWQKJ-UHFFFAOYSA-N 258.268 2.182 10 10 CECE Oc1c(CN[C@H]2C[C@@H](n3cccn3)C2)ccc(F)c1F 2184164673 KSWCFYVCFKYKRI-PHIMTYICSA-N 279.290 2.360 10 10 CECE C[S@@](=O)CCCCN[C@H]1CCc2cccc(O)c21 2047840869 IACSMSQZZORQII-KPZWWZAWSA-N 267.394 2.128 10 10 CECE C[C@@H](N)c1ccc(N(CCO)[C@H]2C[C@H]2C)c(F)c1 2048215025 ZGTMPSVNTUPPRO-RULNRJAQSA-N 252.333 2.053 10 10 CECE O[C@H]1CC[C@H]2CN(c3ccc4c(c3)CCC[C@H]4O)C[C@@H]12 2184687853 BFBGONVPPJIWPT-DXEWXGHRSA-N 273.376 2.263 10 10 CECE Nc1ccc(CCOc2ncnc(Cl)c2[N+](=O)[O-])cc1 2184652722 QMLRRWNBSZQDSO-UHFFFAOYSA-N 294.698 2.242 10 10 CECE CC[C@H](CN)NCc1ccc(C(F)(F)F)cc1O 2050383582 YDWOSGHBMQBAFL-SNVBAGLBSA-N 262.275 2.238 10 10 CECE N[C@@H]1CCCc2cc(N3C[C@H]4CC[C@@]3(CO)C4)ccc21 2184684656 OXCOUJRSTOXKDF-VUCTXSBTSA-N 272.392 2.374 10 10 CECE CN[C@H]1CCc2cc(N3C[C@H](CO)C(C)(C)C3)ccc21 2184723085 ILRIPXCVQLTQDO-CJNGLKHVSA-N 274.408 2.348 10 10 CECE N[C@H]1CCc2cc(N3CC4(CC[C@H]3CO)CC4)ccc21 2184736861 YQOBQXWNHLWGDC-HOCLYGCPSA-N 272.392 2.374 10 10 CECE CCCN(CCCN=[N+]=[N-])[C@H]1CCCCNC1=O 2051517712 ZHKNKUMVKILYLX-NSHDSACASA-N 253.350 2.068 10 10 CECE CCc1noc(CN(C)c2ccc3c(c2)CC[C@@H]3O)n1 2184729110 FWBZEMLTEIKWOK-ZDUSSCGKSA-N 273.336 2.248 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4CCC[C@H]4C3)ccc21 2184849142 FQJCZKLINKSTDD-PGUXBMHVSA-N 271.364 2.265 10 10 CECE NCc1cc(F)c(N2CC[C@@H](CO)C23CCC3)c(F)c1 2190352749 GZDLZYNSVCOVST-NSHDSACASA-N 282.334 2.165 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@]2(C)CCOC2)cc1O 2055447570 GQPVFFRVDXQJDW-QMTHXVAHSA-N 250.342 2.027 10 10 CECE CCNCc1ccc(N2CC=C[C@@H]2CO)c(Cl)c1 2056283326 VLZAXAJLHKAVRK-GFCCVEGCSA-N 266.772 2.187 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C(F)(F)[C@@H]2CCOC2)CC1 2185230592 MEHPGFGPTDEACA-ZJUUUORDSA-N 288.298 2.350 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)c(Cl)c1 2057969937 DFJZPDUOPKXBDP-GDLCADMTSA-N 266.772 2.019 10 10 CECE CN1CCCc2cc([C@@]3(O)CN[C@@H]3C(C)(C)C)ccc21 2196878242 HBIFQEFZIRVZKQ-WBVHZDCISA-N 274.408 2.275 10 10 CECE COC12CC(C1)N(c1ccc(C=CC(=O)O)cc1F)C2 2185470394 KZTRSBXAMJPTJE-UHFFFAOYSA-N 277.295 2.291 10 10 CECE C[C@H]1CN(CCN2CCC[C@@H]2CN=[N+]=[N-])C[C@@H]1C 2059052113 YBQGFHNKBHECQG-RWMBFGLXSA-N 251.378 2.349 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H]1C[C@@]12CC2(F)F 2059058234 HCYJGHBJZGJBKS-NQMVMOMDSA-N 256.256 2.333 10 10 CECE COCCNCc1cccc(Sc2nccs2)n1 2061248087 ZNYCBHBFYSKIPN-UHFFFAOYSA-N 281.406 2.425 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@]1(O)[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2190954875 DWSLBPDVLKTDSZ-RINWOBCUSA-N 273.376 2.450 10 10 CECE COc1ccc(N(C)CC(C)(C)C(=O)O)c([N+](=O)[O-])c1 2191161098 WPGLOMAEVHBQCR-UHFFFAOYSA-N 282.296 2.150 10 10 CECE C[C@H](N[C@@H]1CC[C@@](C)(O)C1)c1c(O)cccc1O 2066753728 OFJSWKBZLJPERI-IMSIIYSGSA-N 251.326 2.052 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@]23CCOC[C@@H]2C3)cc1O 2194556669 XZQDEEVIQNDEDX-MKBNYLNASA-N 276.380 2.275 10 10 CECE COC[C@H](CN(C)c1c(F)cc([C@H](C)O)cc1F)OC 2194520136 UEGMCEKNVWPEAR-ONGXEEELSA-N 289.322 2.116 10 10 CECE Cc1sc(N(C)Cc2ccccc2O)nc1CO 2072466335 DVDDVSNDVJEJJE-UHFFFAOYSA-N 264.350 2.286 10 10 CECE CC[C@H]1CCNC[C@H]1N(C)C(=O)Nc1ccc(N)cc1 2191502740 GQRBOBZOKXFYQD-SMDDNHRTSA-N 276.384 2.121 10 10 CECE C[C@H](N)c1ccc(N2[C@H]3CC[C@@H]2[C@H]2CC[C@H]3O2)cc1O 2198650881 FXRWGAGXMDCLMT-KPZJGCQBSA-N 274.364 2.311 10 10 CECE CN(CC[C@@H]1CCOC1)Cc1cccc(F)c1O 2075508497 ABCBFAHZLXGWBZ-LLVKDONJSA-N 253.317 2.390 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]3[C@H]2CO)ccc1CNC1CC1 2198997713 VARHJYWMLJXIMT-IAOVAPTHSA-N 272.392 2.064 10 10 CECE Nc1ccc(CN(CC2(CO)CCC2)C2CC2)cc1 2100172673 KTBJKTPWVMQSQE-UHFFFAOYSA-N 260.381 2.396 10 10 CECE CC[C@@H]1C[C@@H]1[C@H](O)[C@@H](NC)c1ccc2c(c1)CCN2C 2199884674 MQFIPAZEZQPWLE-UMPQAUOISA-N 274.408 2.346 10 10 CECE CN(CC12COC(CF)(C1)C2)c1ccc(N)cc1 2082678180 NDIBIKPWCVUIAC-UHFFFAOYSA-N 250.317 2.224 10 10 CECE CC(C)[C@H]1CNCCCN1Cc1cc(F)ccc1O 2102919909 IGTHFDWGJVLFBI-CQSZACIVSA-N 266.360 2.351 10 10 CECE C[C@H]1C[C@@H](O)CCN(c2c(F)cc(CO)cc2F)C1 2103310300 MNWLYWGKMSJMTC-ONGXEEELSA-N 271.307 2.054 10 10 CECE C[C@H]1CCC[C@@H](CN)N1Cc1ccc(F)cc1O 2084080294 RJBNXCHWHMCIAY-GWCFXTLKSA-N 252.333 2.233 10 10 CECE C[C@H]1C[C@@H](C)N(Cc2ccc(F)cc2O)CCN1 2084072405 TZZCJVHHOCVSRL-WDEREUQCSA-N 252.333 2.104 10 10 CECE CCc1cccc(CN2C[C@@H]3C[C@H](C2)CN3C)c1O 2104348773 DJWAJWLOPLHTTI-WFASDCNBSA-N 260.381 2.091 10 10 CECE Cc1cccc(O)c1CN1CC(C)(C)C[C@@H]1C(=O)O 2104508390 BFMLGTCNLWIENS-GFCCVEGCSA-N 263.337 2.386 10 10 CECE CS(=O)(=O)[C@H]1CCC[C@H]1Nc1c(N)cccc1Cl 2085176938 LRPJNOYBTOPLHR-MNOVXSKESA-N 288.800 2.300 10 10 CECE C[C@@H]1C(COC(=O)CCOc2ccc(N)cc2)[C@H]1C 2105342371 WIDCCCDHIBDPCR-QWRGUYRKSA-N 263.337 2.483 10 10 CECE COc1ccc(N2CC[C@H](C)C[C@@H]2CN)cc1OC 2106332024 PVXFCCXTIDCWMB-WCQYABFASA-N 264.369 2.267 10 10 CECE C[C@H]1CNCC[C@@H]1N(C)c1ccc2c(c1)CCCO2 2106597566 QXRGQWOOFYRSDJ-WFASDCNBSA-N 260.381 2.446 10 10 CECE CCN1CCc2cc([C@@H](N)C[C@H]3CCOC3)ccc21 2106792330 BWZBITNEZQLRAO-DOMZBBRYSA-N 260.381 2.495 10 10 CECE CCN(CC)c1ccc([C@H](N)c2cncn2C)cc1 2106833732 NAVCCXQTVBGOQB-HNNXBMFYSA-N 258.369 2.314 10 10 CECE CN1CCc2cc([C@H](N)c3nn(C)cc3Cl)ccc21 2106843438 IVKQVKWIHLOLBX-ZDUSSCGKSA-N 276.771 2.114 10 10 CECE CCCNCC[C@H](O)c1ccc2c(c1)CCCN2C 2106825393 JFDBAFXQWRNAMK-INIZCTEOSA-N 262.397 2.492 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H](C[C@@H]3O)C2)cc1 2107282126 HUMVFTVQGFVZNX-HLSYRSCKSA-N 260.381 2.174 10 10 CECE Nc1ccc(CCNCC2([C@@H]3CCCO3)CC2)cc1 2108122410 JZBZBXMDHXGPIO-HNNXBMFYSA-N 260.381 2.360 10 10 CECE COc1cccc([C@H](NN)c2ccccc2O)c1F 2090036370 BRQPBBIOTRKSPF-CQSZACIVSA-N 262.284 2.093 10 10 CECE COc1ccc(O)c([C@@H](C)NCCc2ccon2)c1 2090429515 CVXHBRRQPDILQV-SNVBAGLBSA-N 262.309 2.282 10 10 CECE CC(C)C(NC(=O)COc1ccc(N)cc1)C(C)C 2090412877 XWLQMVURPVVYMH-UHFFFAOYSA-N 264.369 2.444 10 10 CECE Cc1cc(CNCCc2ccc(O)c(O)c2)ccn1 2091765100 VLSHDSBKUHMPGQ-UHFFFAOYSA-N 258.321 2.134 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1C[C@@H]2CCCCN2C1 2092468301 DEYYHRFPCACWOE-JKSUJKDBSA-N 259.397 2.327 10 10 CECE CO[C@@H]1CCC[C@H]2CN(c3ccc(CN)cc3)C[C@H]21 2094544547 FHWWRCODHMZKMK-NUEKZKHPSA-N 260.381 2.397 10 10 CECE C[C@]12C[C@@H]1CN(c1cc3c(cc1Cl)[C@@H](N)C(=O)N3)C2 2096162146 YCCFHYSLYVZHLF-QVCNTJRGSA-N 277.755 2.138 10 10 CECE CCN[C@@H]1CCCN([C@@H](C)c2cc(O)ccc2O)C1 2096690772 SHCYUWSXKSVKRF-NWDGAFQWSA-N 264.369 2.233 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N(C)C[C@@H]1CCNC1 2098263704 QAKIBRXMHDHWGQ-UONOGXRCSA-N 261.413 2.355 10 10 CECE CN1CCC[C@@]1(C)CNCc1ccc(F)c(F)c1O 2098731680 HDIJKJHLTJOGIF-AWEZNQCLSA-N 270.323 2.244 10 10 CECE Nc1ccc(NC(=O)CCN2Cc3ncsc3C2)cc1 2201380106 HJXWZXPRCXVFPM-UHFFFAOYSA-N 288.376 2.070 10 10 CECE COc1cc(N2CC[C@H](OC)[C@@H]2C2CC2)ccc1CN 2204560235 ZTRHBECTFFWHAN-HOCLYGCPSA-N 276.380 2.158 10 10 CECE CC[C@@H]1CCOCCN1c1ccc(CNC)c(OC)c1 2204541186 JALBFEHCFCACGO-CQSZACIVSA-N 278.396 2.420 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1O 2204626636 RANGLWLBAHDAAO-NMKXLXIOSA-N 277.364 2.376 10 10 CECE CSc1ncc(CNC(=O)[C@@H]2C[C@@H](C)NC[C@H]2C)s1 2269198913 KVPRWTPBHVOJJE-FXPVBKGRSA-N 299.465 2.115 10 10 CECE CCCCn1ccc(=NCCc2ccc(N)cc2)[nH]1 2269556759 RARHYUZBHHGWLO-UHFFFAOYSA-N 258.369 2.342 10 10 CECE CCN1CC[C@H](NCc2cnc(SC)s2)C1 2208568401 LDLLMSBLVVSAKY-VIFPVBQESA-N 257.428 2.049 10 10 CECE CCc1nnsc1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2218745108 OVZPGJQHVOOPEE-JGVFFNPUSA-N 266.330 2.062 10 10 CECE Cc1ccc(CN[C@H](C(F)F)[C@H]2CCOC2)c(O)c1 2231054596 PQPOEZUWELLYMM-AAEUAGOBSA-N 271.307 2.460 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@@H](C)[C@@](C)(CO)C1 2232011873 IVWOWIANAAKTJZ-DVOMOZLQSA-N 262.397 2.469 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H]2CF)c(C)c1 2232100078 HSYARLLRRRYVSG-OCCSQVGLSA-N 266.360 2.450 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2OC[C@@H]3CCC[C@@H]32)cc1 2233194698 XZWKEJNHCBZXQL-QCEMKRCNSA-N 275.396 2.072 10 10 CECE C[C@H](O)c1ccc(N(C)CCc2cnn(C)c2)c(F)c1 2234106303 MODAVPYDCIVOSZ-NSHDSACASA-N 277.343 2.291 10 10 CECE CN[C@@H]1CCCc2cc(N(C)[C@H]3C[C@@H](O)C3)ccc21 2224214605 UCOGBKWEIDFIQD-IJEWVQPXSA-N 260.381 2.243 10 10 CECE CCN1CCc2cc(N3C[C@H]4C[C@@H](O)C[C@H]4C3)ccc21 2235038925 QIOUAVSLLBLKJW-MIFYACCESA-N 272.392 2.276 10 10 CECE COCCN(CCO)c1ccc2c(c1)CCC(C)(C)O2 2235127939 XCSYZLFOEFINNG-UHFFFAOYSA-N 279.380 2.235 10 10 CECE CC1(C)[C@H](O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)[C@H]21 2235101526 NUZLTZFWTFVUHK-KCPJHIHWSA-N 275.348 2.053 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3[C@H]2C[C@@]3(C)O)c(F)c1 2225452347 HOFFTUXCWZYPRW-NZQZLILVSA-N 265.328 2.229 10 10 CECE COc1ccc(N(C)Cc2ccncc2F)c(CO)c1 2235960031 ANDUTENNHLXTAZ-UHFFFAOYSA-N 276.311 2.358 10 10 CECE COc1ccc(N2CC[C@@H](OC)C[C@H]2C)c(C(=O)O)c1 2235948455 RNGHVHAJJNSQJV-ZYHUDNBSSA-N 279.336 2.397 10 10 CECE COCCC1CN(c2ccc(OC)cc2C[C@@H](C)N)C1 2235980902 JTXFPNDCTCMXAO-GFCCVEGCSA-N 278.396 2.058 10 10 CECE C[C@@H]1CC[C@H]1CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 2236136622 ZYMRZOVRABNOJY-JRPNMDOOSA-N 273.380 2.145 10 10 CECE CO[C@@H]1CC[C@@H]1CC(=O)[C@@H](O)c1ccc(N(C)C)cc1 2236202333 OOYGYJAYMXRGQQ-WQVCFCJDSA-N 277.364 2.170 10 10 CECE COc1ccc(N2CCCC[C@H](CO)C2)c(OC)c1 2226809901 QPMWGEHBVCORGG-LBPRGKRZSA-N 265.353 2.303 10 10 CECE COc1ccc(N2C[C@H](C)[C@@H](O)[C@H](C)C2)cc1OC 2226801370 CJCJGFZDJWGXAH-HBYGRHMLSA-N 265.353 2.157 10 10 CECE COc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)c(C=O)c1 2227704985 DQHLQMJFRYLRIX-PJXYFTJBSA-N 267.275 2.455 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1ccc2nc(O)[nH]c2c1 2238145903 PEEHJHHKVMHRCE-UHFFFAOYSA-N 271.276 2.374 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@](=O)[C@H]1C[C@@H]2C[C@@H]2C1 2285659826 HKIRETDLKINXJB-BOZAYROOSA-N 292.404 2.143 10 10 CECE CC[C@@H](CCO)SCC(=O)c1ccc(O)c(O)c1 2260833787 BHLGCCDSEAFUTG-JTQLQIEISA-N 270.350 2.175 10 10 CECE CNC[C@H]1CCCN1c1ccc(OC(F)F)cc1 2263919163 SWVWECFUROEJMT-LLVKDONJSA-N 256.296 2.476 10 10 CECE CN(c1ccc(OCF)cc1)[C@@H]1CNCC12CC2 2263914345 SVLGGMSVBUHKSB-CYBMUJFWSA-N 250.317 2.181 10 10 CECE COc1ccc(O)c([C@H](C)NCC[C@@H]2CCO2)c1 2264021284 IUMMTMLBQPLCAD-WDEREUQCSA-N 251.326 2.230 10 10 CECE C[C@H](O)c1ccc(N2CCC=C[C@]2(C)CO)c(F)c1 2264386240 CJENPUDIOWSEGR-XHDPSFHLSA-N 265.328 2.396 10 10 CECE CSc1ncc(CNC(=O)CCC2CCNCC2)s1 2269195101 BZTNKAXAGKUHRN-UHFFFAOYSA-N 299.465 2.261 10 10 CECE C[C@@H](CN[C@H](C)c1c(O)cccc1O)Cc1cn[nH]c1 2290440193 QFWJJJQVJBNSDG-GHMZBOCLSA-N 275.352 2.350 10 10 CECE COc1ccc(COC(=O)c2ccc(O)c(O)c2)cc1 2283477833 QHJIGAPLUMTUBP-UHFFFAOYSA-N 274.272 2.463 10 10 CECE O=C(O)CC[C@H]1CN(Cc2ccc(Cl)cc2O)CCO1 2295061800 HPDVVZYRZMADOV-LBPRGKRZSA-N 299.754 2.111 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2CCCCNCC2)cc1 2295217791 WUAKLWBSQCOFSS-GFCCVEGCSA-N 276.384 2.170 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)cc1C 2285144604 UYGBJYRYGATMBQ-IXKJSCDLSA-N 274.408 2.483 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](O)C[C@H]3C2)c(OC)c1C 2295378561 QQDDAAKHBSGLIB-ITGUQSILSA-N 277.364 2.219 10 10 CECE Oc1ccc(CNCCN2CCC3(CC2)CC3)cc1O 2287119712 MBQWPPGPOIEQFR-UHFFFAOYSA-N 276.380 2.063 10 10 CECE O=C(N[C@]12CCCC[C@H]1CC2)c1cc(O)c(O)c(O)c1 2289025710 CPIQWUTWPIALJC-BONVTDFDSA-N 277.320 2.256 10 10 CECE CC1(C)[C@H]2NCC[C@H]2[C@@H]1NCc1ccc2c(c1)CCO2 2296967452 YCDWMPVQGMVUSK-KBMXLJTQSA-N 272.392 2.098 10 10 CECE CS[C@H]1C[C@@H](C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2299300682 LULPGSPIJQIWJW-LPEHRKFASA-N 254.359 2.429 10 10 CECE Cc1ccc(CN2CC[C@@H]2[C@@H](C)N)c(O)c1Br 2307569046 GVVZPHAPDGHVFA-MWLCHTKSSA-N 299.212 2.385 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@@H]3CO)c(F)c1 2312395105 RWNIQXSBKYGWNO-BREBYQMCSA-N 251.301 2.184 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCOC[C@H](F)C2)c1 2315079746 XTXWYQWLBSZHHX-NWDGAFQWSA-N 253.317 2.432 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccc(F)cc1N 2315990407 MHCRKURODCEVCH-UHFFFAOYSA-N 251.265 2.180 10 10 CECE CO[C@@H]1C[C@@]2([C@@H](N)c3ccc4c(c3)CCN4C)C[C@@H]12 2329489028 SXETVNRMNGUHOH-UKMLZYKCSA-N 258.365 2.104 10 10 CECE C[C@H]1C[C@@H]2CN(c3ccc(CO)cc3[N+](=O)[O-])C[C@H]12 2333305015 RJDNWPZMWNSXIL-MVWJERBFSA-N 262.309 2.179 10 10 CECE C[C@H]1Cc2cc(N3CC[C@H]4C[C@]3(CO)C4)ccc2O1 2336782635 HQRUMKRKHCVDDB-MQIPJXDCSA-N 259.349 2.361 10 10 CECE Nc1ccc(OCCN2Cc3cccnc3C2)cc1 2336972188 VWQFTKOKKAOVBQ-UHFFFAOYSA-N 255.321 2.058 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC(CN(C)C)C2)c1C 2340860606 YXMLYPXQYHYEJU-CYBMUJFWSA-N 261.413 2.321 10 10 CECE CNC1C[C@@H]2CC[C@H](C1)N2c1ccc(CO)c(F)c1 2341925152 YLZOKFNDGVNOLP-YHWZYXNKSA-N 264.344 2.037 10 10 CECE C[C@H]1CC2CC(C(=O)N3CCC(N=[N+]=[N-])CC3)(C2)O1 2342324416 SITNKSFHDWHPLW-JBLZRFIASA-N 264.329 2.245 10 10 CECE OCc1ccc(N2CCCC[C@@H]2c2ncno2)cc1 2352919626 PURIZQSMTBHVAS-CYBMUJFWSA-N 259.309 2.294 10 10 CECE CCN[C@H](c1ccccc1O)C1(O)CC2(CSC2)C1 2353393281 YGLFFXWOXGBUKD-CYBMUJFWSA-N 279.405 2.301 10 10 CECE COc1ccc(CN[C@@H]2C[C@H]3C[C@@H]2C[C@H]3OC)c(O)c1 2354392409 CAXIMLGLZCACJS-ZNEHSRBWSA-N 277.364 2.304 10 10 CECE CC(C)N(C(=O)c1cc(O)c(O)c(O)c1)C(C)C 170190506 UOZVQVPICDBCPR-UHFFFAOYSA-N 253.298 2.062 10 10 CECE NC1C[C@H]2CCC[C@H](C1)N2c1ccc2c(c1)OCCO2 107895671 LZFJZSLYMWCNTI-CHWSQXEVSA-N 274.364 2.306 10 10 CECE COc1cccc(CNC(=O)NCCCCSC)c1O 175080334 XPTFLLRATDMAHK-UHFFFAOYSA-N 298.408 2.343 10 10 CECE C[C@H]1CN(c2ccc(CN)c(Cl)c2)C[C@H](C)O1 61845499 UEUKSIRJBZIQGH-UWVGGRQHSA-N 254.761 2.412 10 10 CECE Oc1cccc(CNC[C@@H]2C[C@@]23CCCOC3)c1O 1894128598 NVNZUDZSCBXBLU-SWLSCSKDSA-N 263.337 2.004 10 10 CECE 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CCC[C@@H](C)NC(=O)CN(c1ccc(CN)cc1)C1CC1 49287720 QBHPBJFPHZJXFC-CYBMUJFWSA-N 289.423 2.419 10 10 CECE CC(C)N(CC(=O)O)[C@@H](C)c1cc(F)ccc1O 94622200 SBYYMVTVYVKMFR-VIFPVBQESA-N 255.289 2.387 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1ccccc1F 90259279 XIZHTLPHLCSFTN-NSHDSACASA-N 266.276 2.330 10 10 CECE CC(C)CN1C(=O)N=C(N)[C@H]1c1ccc2c(c1)CCN2C 94514161 XBLGLCDIZPKJRP-CQSZACIVSA-N 286.379 2.169 10 10 CECE Cc1cc(O)c(CN2CCS(=O)(=O)[C@H](C)[C@H]2C)cc1C 246592133 CGUAVLZGRVCDAM-CHWSQXEVSA-N 297.420 2.016 10 10 CECE C[C@H](c1cc(O)ccc1O)N(C)[C@@H]1CCC[C@H]1CN 251237440 CUUJHKVLJVEYPL-UHIISALHSA-N 264.369 2.218 10 10 CECE CC[C@@H](c1ccccc1O)N1C[C@H](C(=O)O)C(F)(F)C1 700552171 KFUKWVCYORFQMN-MNOVXSKESA-N 285.290 2.495 10 10 CECE O=C(O)/C=C/c1ccc(N2CCN3CC[C@H]2C3)cc1Cl 381937317 STMSUBHBFOXUTJ-OHVSUOQFSA-N 292.766 2.332 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1CC(C)(C)CO1 2166270674 ZRPRHOMCJYOMJD-CQSZACIVSA-N 276.380 2.432 10 10 CECE C[C@H](Nc1cnc2nccn2c1)c1ccc(O)cc1O 2167593214 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[N-]=[N+]=NC1CN(C(=O)[C@H]2CCc3ccccc3C2)C1 1912191648 UPCPHAOEBPQSGH-LBPRGKRZSA-N 256.309 2.313 10 10 CECE C[C@@H](NC(=O)CN1CC[C@H](N=[N+]=[N-])C1)c1cccs1 1912163777 NNXPZRIYEPWWLK-ZJUUUORDSA-N 279.369 2.310 10 10 CECE COCc1ccccc1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912205459 AFUIMHZDRQRZOG-NSHDSACASA-N 260.297 2.358 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])c1cccs1 1912203865 GYFSGJQZWHNDHP-LLVKDONJSA-N 268.342 2.426 10 10 CECE Cc1cc(N(C)CCN(C)C)ccc1CNC(C)C 111140378 AWWVYLGJCMPEDB-UHFFFAOYSA-N 263.429 2.491 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](C)OC(C)(C)C2)cc1O 225206704 DXYSKWCPWORUBC-MNOVXSKESA-N 264.369 2.416 10 10 CECE Cc1ccc(O)c(CN[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)c1 115603596 FTDKJCOMHRECIP-LWWSYDQCSA-N 275.348 2.290 10 10 CECE CC(C)(C)OC(=O)N1CCO[C@H](CCN=[N+]=[N-])C1 1535949095 DFBNHVQMBCTTJV-SECBINFHSA-N 256.306 2.323 10 10 CECE C[C@@H](CNC(C)(C)C)NCc1ccc2c(c1)CCO2 229138144 AGDNJQOFSVVNRW-LBPRGKRZSA-N 262.397 2.488 10 10 CECE COc1ccc(CNC(=O)c2cc(F)ccc2N)c(O)c1 1635042704 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CECE CN1C[C@H](CN)C[C@H]1c1cc(C(F)F)ccc1O 258426398 QKRCMXRSZJLJOY-KWQFWETISA-N 256.296 2.281 10 10 CECE Nc1ccc(N2CC[C@@]3(CCCOC3)OC2=O)cc1 258409670 FRKFGJLRUBFGPE-CQSZACIVSA-N 262.309 2.165 10 10 CECE COC(=O)c1cc2cc(C)c(O)c(CN(C)C)c2[nH]1 259827922 QDDBJHLCZSMQRL-UHFFFAOYSA-N 262.309 2.030 10 10 CECE C[C@H](N)c1ccc(N2CCC23COC3)cc1Cl 2004410934 DDWVOVSOPTZDNJ-VIFPVBQESA-N 252.745 2.339 10 10 CECE COc1ccc([C@H](C)Nc2ccc(=O)n(C)c2)c(O)c1 37785933 XJRJBCDFZYJESR-JTQLQIEISA-N 274.320 2.273 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCNC[C@@]1(C)C1CC1 2151089257 LKMRAUAIFPYVQA-BZNIZROVSA-N 276.380 2.233 10 10 CECE Nc1ccc(OCCNC(=O)Nc2ccccc2)cc1 38079631 JWFUJCVNLJEFQC-UHFFFAOYSA-N 271.320 2.469 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@@](CN)(C2CC2)C1 2149601213 LOUAHZHFJORNNU-BZNIZROVSA-N 276.380 2.220 10 10 CECE C[C@@H](CC(N)=O)N(C)c1ccc(C=CC(=O)O)cc1Cl 2151338979 UATQQILTYHUJID-VIFPVBQESA-N 296.754 2.138 10 10 CECE Nc1ccc(CN2C(=O)CC3(CCCC3)CC2=O)cc1 40223624 RFTYXMMRPDYHHC-UHFFFAOYSA-N 272.348 2.478 10 10 CECE COC[C@]1(OC)CCN([C@@H](C)c2ccc(F)cc2O)C1 2151857525 SPEZKWYHVCUTOW-NHYWBVRUSA-N 283.343 2.330 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CCCC[C@@H](F)C3)ccc21 2152296082 OYBGLAFERNITNO-QMTHXVAHSA-N 277.343 2.228 10 10 CECE CC(C)[C@@H](C(N)=S)N(C)Cc1ccccc1O 2017501630 HJOBCWCZUNAFEU-LBPRGKRZSA-N 252.383 2.135 10 10 CECE OCC[C@H]1C[C@@H](NCc2ccc(Cl)cc2O)C1 2021845945 ULFDKCWQJAMZEZ-WVSHTKLVSA-N 255.745 2.296 10 10 CECE CCCN[C@@](CC)(CSc1nccs1)C(=O)O 2026504696 DSEZZVRQMYSRNX-NSHDSACASA-N 274.411 2.468 10 10 CECE Cc1nc[nH]c1CCNCc1cccc(Cl)c1O 2029139105 GHSIYAZSSJGALO-UHFFFAOYSA-N 265.744 2.409 10 10 CECE C[C@@H](O)c1ccc(N2CC(C)(C)[C@@H]2CO)c(F)c1 2031674998 IVKGICVTURNMLT-RNCFNFMXSA-N 253.317 2.086 10 10 CECE OC[C@H]1CCN1c1ccc(CNC2CC2)c(Cl)c1 2031686840 QAQUHZIXGNWJNG-CYBMUJFWSA-N 266.772 2.163 10 10 CECE Oc1ccc(CNC[C@H]2CC[C@H](F)C2)c(O)c1O 2032981379 RLTOTYZUKAWTIB-WPRPVWTQSA-N 255.289 2.031 10 10 CECE C[C@H](NC[C@@H]1OCC[C@@H]1C)c1c(O)cccc1O 2034982437 FRMSPFOGVKBKON-KWBADKCTSA-N 251.326 2.173 10 10 CECE C[C@H](N[C@H]1COCC[C@H]1C)c1cc(O)ccc1O 2035125577 PQOPYTOIJYYGTE-NRUUGDAUSA-N 251.326 2.173 10 10 CECE NCc1ccc(N2CC3(CC3)C[C@@H]2CO)c(Cl)c1 2037835996 HJRSXQDFKHYZDS-LLVKDONJSA-N 266.772 2.150 10 10 CECE Nc1ccc(OCCNC(=O)C(C2CC2)C2CC2)cc1 312382266 NHDYKNKLEVWQDN-UHFFFAOYSA-N 274.364 2.200 10 10 CECE CN(C)C1CC(NCc2ccc(N3CCCC3)cc2)C1 701468691 ROIYYADBIAMQGG-UHFFFAOYSA-N 273.424 2.469 10 10 CECE Nc1ccc(CC(=O)NCC2(O)CCCCCC2)cc1 87088567 PPGSDWODLJDRIO-UHFFFAOYSA-N 276.380 2.013 10 10 CECE CC(C)CC1(NC(=O)COc2ccc(N)cc2)CC1 701446096 XAZLZJSOPHBLGO-UHFFFAOYSA-N 262.353 2.343 10 10 CECE Cc1ncc(CN(C)c2c(F)cc(CN)cc2F)n1C 701618230 KOCUPVBCWNYGFL-UHFFFAOYSA-N 280.322 2.102 10 10 CECE C[C@H](NCC1(O)CCSCC1)c1cc(O)ccc1O 702238770 FYMVQNFTLVFFAD-JTQLQIEISA-N 283.393 2.007 10 10 CECE C[C@@H]1C[C@@H](O)CCN1c1ccc(CN)c(Cl)c1 705622277 JGMADUAKUWASFW-SKDRFNHKSA-N 254.761 2.148 10 10 CECE C[C@@H]1NCCN(Cc2c(O)cccc2Br)[C@@H]1C 706861301 GNUMIXKFKUCIMJ-VHSXEESVSA-N 299.212 2.337 10 10 CECE CNCc1cc(F)c(N2CCOCC23CCC3)c(F)c1 707248183 WKGDAHQURFHBPZ-UHFFFAOYSA-N 282.334 2.444 10 10 CECE FC1(F)Oc2ccc(N3CC[C@H]4CNC[C@@H]4C3)cc2O1 2162622979 NHYYYOJLMYQHTA-VHSXEESVSA-N 282.290 2.054 10 10 CECE CNCc1ccc(N2CCCC[C@H]2[C@H](C)O)cc1C 688757424 YPPDUIMAWZYZPU-BBRMVZONSA-N 262.397 2.454 10 10 CECE CNCC1CCN(c2ccc3c(c2)OCCCO3)CC1 2162627124 YKRLRNPROAAWJS-UHFFFAOYSA-N 276.380 2.284 10 10 CECE CCN(C(=O)[C@@H]1C[C@@H](C)O[C@H]1C)c1ccc(N)cc1 686451465 RZNZZUARXMDZSG-UHIISALHSA-N 262.353 2.435 10 10 CECE CCN(CCN(C)C)[C@H](C)c1ccc(OC)cc1O 708341056 NBMJEGWEAWDKFQ-GFCCVEGCSA-N 266.385 2.345 10 10 CECE COc1cc(NCc2cc(F)cc(F)c2O)nn1C 708497320 RKJBXRZOOPXTMM-UHFFFAOYSA-N 269.251 2.025 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@@](C)(N)C1CC1 687104479 IRERITQCTDCTTG-BDJLRTHQSA-N 276.380 2.429 10 10 CECE C[C@@H](N[C@@H]1COC2(CCC2)C1)c1c(O)cccc1O 688287397 PYSBRCGMRDKHTO-MNOVXSKESA-N 263.337 2.460 10 10 CECE CC[C@@H]1C[C@H](N(C)c2ccc([C@@H](C)O)c(O)c2)CO1 688495802 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CC[C@H]1C[C@H](NC(=O)NCc2cc(C)ccc2O)CCO1 858547510 HVAALJLAUXXLSQ-KGLIPLIRSA-N 292.379 2.457 10 10 CECE C[C@@H](NC1CCC(N)CC1)c1cc(O)ccc1O 51693631 FMPSWJXBPSDNHK-KPPDAEKUSA-N 250.342 2.018 10 10 CECE COc1ccc(N2CC[C@H](NC[C@@H]3CCCOC3)C2)cc1 850346266 DLNTYRRGFKDSOW-GJZGRUSLSA-N 290.407 2.290 10 10 CECE C[C@H](N[C@H]1CCN(CC(C)(C)O)C1)c1cc(F)ccc1O 866413784 WGIARTMOFULALZ-AAEUAGOBSA-N 296.386 2.027 10 10 CECE C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)C(F)(F)F 931787394 UWNDDBVKGJJQKN-SSDOTTSWSA-N 274.242 2.368 10 10 CECE O=C(c1cc2cc(O)c(O)cc2s1)N1CC(F)(F)C1 1119625098 SNLJNSVPDPEKDS-UHFFFAOYSA-N 285.271 2.404 10 10 CECE CCN[C@H]1CCCN(c2ccc3c(c2)OCCO3)C1 71198551 BVFKGGMNEWQJOD-LBPRGKRZSA-N 262.353 2.036 10 10 CECE Cc1nc2ccccc2n(CCOc2ccc(N)cc2)c1=O 76883162 RWCYLFJLXKEOHO-UHFFFAOYSA-N 295.342 2.366 10 10 CECE Cc1cccc([C@H](N)c2nnc(CC(C)C)o2)c1O 83447410 WDTRZEYHRKTGOX-LBPRGKRZSA-N 261.325 2.330 10 10 CECE Oc1cc2c(c(O)c1O)CCN[C@H]2c1cccs1 83658169 JMFWMZOVRSBXKL-LLVKDONJSA-N 263.318 2.100 10 10 CECE 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258.347 2.015 10 10 CECE CNCc1ccc(N2CCSC[C@H]2CCO)c(C)c1 689869169 AYRPDBTXLGIILA-CQSZACIVSA-N 280.437 2.019 10 10 CECE O=C(NCCC[C@H]1CCCC[C@@H]1O)c1cccc(O)c1O 790898096 UTCRJTFWVIYGDX-YPMHNXCESA-N 293.363 2.159 10 10 CECE C[C@@H]1CN(c2ccc(CO)cc2Cl)C[C@@H](C)C1O 688083438 IGHGHUACURCTKY-NXEZZACHSA-N 269.772 2.285 10 10 CECE Oc1ccc(CN2CCNCC23CCCCC3)c(O)c1 88395596 SFTXBMMSFSOROB-UHFFFAOYSA-N 276.380 2.206 10 10 CECE CCN(CC)C(=O)[C@H](C)N[C@H](C)c1cc(F)ccc1O 94617488 CVWMOBFSFHZVPP-MNOVXSKESA-N 282.359 2.439 10 10 CECE CN(C)[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ccc(CO)cc1 2118321553 DNWDVDVZVIDGFX-ZSHCYNCHSA-N 260.381 2.240 10 10 CECE CN(c1cc2c(cc1N)OCCO2)[C@H]1CCC[C@@H]1F 2118950697 LMQUULQZAKOBFO-ONGXEEELSA-N 266.316 2.367 10 10 CECE C[C@H](C[S@@](C)=O)N(C)c1ccc2c(c1)CCC[C@H]2N 2128278935 IYPLNGGNIFMJPX-PRIMNGNOSA-N 280.437 2.226 10 10 CECE C[C@]1(CO)CCCCN1c1ccc2c(c1)CC[C@@H]2N 2128327411 MSVVCFRPHCRZHE-JKSUJKDBSA-N 260.381 2.374 10 10 CECE O[C@H]1CCc2cc(N3CC4(CC=CCO4)C3)ccc21 2128315414 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C[C@H](O)[C@@H](C)SCCCC(=O)Nc1ccc(N)cc1 235541478 FKFSTKFKUVZYSQ-WDEREUQCSA-N 282.409 2.490 10 10 CECE CC(C)(C)[C@](CSc1nccs1)(NC1CC1)C(N)=O 2142818760 HVPDZLWKGOEKHX-CYBMUJFWSA-N 299.465 2.257 10 10 CECE C[C@]12CC[C@H]1CN(c1ccc([N+](=O)[O-])c(CO)c1)C2 2143202254 MDVUGKTWOMYYRN-SMDDNHRTSA-N 262.309 2.323 10 10 CECE CN(Cc1ccc(Br)cc1O)C[C@H]1CCNC1 1948871868 LSYDYUMTGHOFBO-JTQLQIEISA-N 299.212 2.196 10 10 CECE Cc1cccc(CNC[C@H]2C[C@H](O)C23CCC3)c1O 1875443754 NPVHVOOETRDHGS-KGLIPLIRSA-N 261.365 2.341 10 10 CECE O=C1Nc2cc(N3[C@H]4CCC[C@@H]3C4)c(Cl)cc2[C@@H]1O 1899668267 HJWDGKBYMSSVAB-DAROEXNTSA-N 278.739 2.457 10 10 CECE C[C@@H](NCc1[nH]ccc1C(=O)O)c1ccccc1O 1877584077 AHQBOFWHZJRZFA-SECBINFHSA-N 260.293 2.269 10 10 CECE CN(Cc1ccccc1O)c1ccc(C(=O)O)nc1 1877524000 OVHMUIOZHUFQQY-UHFFFAOYSA-N 258.277 2.122 10 10 CECE CC[C@H](C)[C@H](N)CC(=O)N[C@@H](C)c1ccccc1O 1877587846 PQLXJWULUNBAQV-GMXVVIOVSA-N 264.369 2.333 10 10 CECE CCCC[C@@H](N)CC(=O)N[C@@H](C)c1ccccc1O 1877590721 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10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](C)OC[C@H]2C)c1 245514530 FYCAOYSGLMRZAK-VXGBXAGGSA-N 265.353 2.400 10 10 CECE Nc1cc(-c2c(O)c(O)cc(Br)c2F)no1 258538235 MKBAZJDDOCEKMF-UHFFFAOYSA-N 289.060 2.237 10 10 CECE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1CCC1 277430888 RQMWYMITOWDESE-UHFFFAOYSA-N 294.738 2.362 10 10 CECE CCNCc1ccc(N2CCC[C@H](O)CC2)cc1C 381213158 MKEQDYKZYRIRNP-INIZCTEOSA-N 262.397 2.456 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)C[C@H]1C[C@@H](O)C1 703820654 FXUAJCFJQHPPQQ-FZNQNYSPSA-N 274.408 2.454 10 10 CECE CNCc1ccc(N2CC[C@@H]3OCC[C@@H]3C2)cc1C 724808130 FIRLBBZUWBSHKJ-ZBFHGGJFSA-N 260.381 2.330 10 10 CECE Oc1ccc(-c2ccccc2)cc1CN1CCOC[C@@H](O)C1 294864931 UFBHXGUPWLRDKS-KRWDZBQOSA-N 299.370 2.252 10 10 CECE COc1cc(CN2CCC[C@@H](N=[N+]=[N-])C2)cc(OC)n1 2167086984 HSKYJBNHUJEFPP-LLVKDONJSA-N 277.328 2.374 10 10 CECE CN(C)c1ccc([C@]2(N)CCCN3CCSC[C@H]32)cc1 2163060429 BPTJTXZBYDTZQD-JKSUJKDBSA-N 291.464 2.118 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@H]4OCCC[C@@H]43)ccc21 2163066627 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Cc1ccc(O)c(CN[C@H]2C[C@H]3C[C@H]2C[C@@H]3C(=O)O)c1 2151592239 PLFGKVMWEHGPBX-XWUBHJNHSA-N 275.348 2.290 10 10 CECE Oc1ccc(Cl)cc1CN[C@@H]1[C@H]2CCCO[C@H]21 2007560898 WWYHLIYAUNKSTB-RAIGVLPGSA-N 253.729 2.313 10 10 CECE Nc1ccc(CCN2CCC3(CCC3)[C@H](CO)C2)cc1 2151656580 UPJYFDDUDHQCTL-HNNXBMFYSA-N 274.408 2.296 10 10 CECE O=c1c2c(ccn1Cc1cccc(F)c1Cl)CCNC2 2150799111 BXTUQPJVJFJAKB-UHFFFAOYSA-N 292.741 2.335 10 10 CECE COc1ccc(O)c(CN(C)CC2CCOCC2)c1 156026972 FXKZJGWKYNSSLF-UHFFFAOYSA-N 265.353 2.259 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](CO)C(F)(F)C2)cc1 2146376097 WERUOTJCLFUSOU-AAEUAGOBSA-N 284.350 2.421 10 10 CECE Nc1ccc(COc2ccnc(Br)n2)cc1 1986578102 MZRSYZOUMBGACG-UHFFFAOYSA-N 280.125 2.400 10 10 CECE COc1ccc(O)c(CNc2cnccc2N(C)C)c1 36940211 LJIBAZSBCVBCNC-UHFFFAOYSA-N 273.336 2.474 10 10 CECE CN[C@H]([C@@H](C)CCOC)[C@H](O)c1ccc(N(C)C)cc1 2148044756 HRBFLUSWFCYEDZ-APHBMKBZSA-N 280.412 2.047 10 10 CECE C[C@@](O)(COc1ccccc1)[C@@H](N)c1ccccc1O 2148166315 WNJLUGMNODVSEW-JKSUJKDBSA-N 273.332 2.222 10 10 CECE CC[C@H](c1ccccc1O)N1CCC[C@H]1CS(C)(=O)=O 2151229806 BRSKYAQXHMSQNB-GXTWGEPZSA-N 297.420 2.352 10 10 CECE Nc1ccc(CCC(=O)N2CC[C@@H]3[C@H](C2)C3(F)F)cc1 2152117449 CKVIGNXFUDDEES-OLZOCXBDSA-N 280.318 2.315 10 10 CECE CN(Cc1cc(N)ccc1O)CC12CCCN1CCC2 2154957950 FYKVLOYOAAPBQE-UHFFFAOYSA-N 275.396 2.035 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@H](N)C2(CCC2)C1 2155073984 CMKUKTYQKWIINO-FZMZJTMJSA-N 276.380 2.362 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3COC[C@H]32)c(Cl)c1 2013473603 FFUAEBCBHATCOS-GMOODISLSA-N 252.745 2.195 10 10 CECE C[C@@H]1[C@H](CN(C)c2ccc3c(c2)N(C)C(=O)[C@@H]3O)[C@@H]1C 2161528580 CBPDTIQZVZSXGK-YJKIEOBBSA-N 274.364 2.035 10 10 CECE CC1CCN(CCNCc2ccc(F)cc2O)CC1 294391472 VKZSQYDYUSBBGA-UHFFFAOYSA-N 266.360 2.353 10 10 CECE CC(C)[C@@H](C)NC(=O)CNCc1ccc(N(C)C)cc1 2160470027 NNFXNZBPYLHBTF-CYBMUJFWSA-N 277.412 2.003 10 10 CECE CC[C@@]1(O)CCN(c2ccc(CNC)c(Cl)c2)C1 2033348190 FUHNRWMGEZRHME-CQSZACIVSA-N 268.788 2.411 10 10 CECE Oc1c(CN[C@H]2CCC[C@@H](O)C2)ccc(F)c1F 700736980 DNJCUNYJCVINCA-VHSXEESVSA-N 257.280 2.064 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H]2[C@@H]3CCOC[C@H]32)CC1 2038009116 GNMKLCBMDRAMJS-YVECIDJPSA-N 250.346 2.434 10 10 CECE C[C@H](N[C@H]1CC[C@H]1N(C)C)c1cc(F)ccc1O 2039961154 ZAZKIVPFQRBUOS-TVYUQYBPSA-N 252.333 2.275 10 10 CECE Cn1ncc2c1CCC[C@H]2NCc1c(O)cccc1F 2160795275 VJEOXUOUXBVZQZ-CYBMUJFWSA-N 275.327 2.432 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cnc(Cl)cn2)C1 701320201 XPNGAKGZLGLVAU-SSDOTTSWSA-N 266.692 2.045 10 10 CECE COC(=O)NCCN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 308157943 SMQLYAIPDYRYFX-GHMZBOCLSA-N 278.352 2.195 10 10 CECE O=C(NC[C@@H]1CC[C@@H]2C[C@@H]2C1)c1ccc(O)c(O)c1 403494645 WLICAPRXQUPLOQ-FOGDFJRCSA-N 261.321 2.264 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)C2CCSCC2)C1 403648031 SHGVHEFSMBWFOC-SNVBAGLBSA-N 254.359 2.431 10 10 CECE CC[C@@H]1CN(c2ccc([C@@H](C)N)c(O)c2)[C@H](C)CO1 403772285 RTYDOPGYXVSGKU-NQBHXWOUSA-N 264.369 2.416 10 10 CECE NCc1cc(F)c(N2CCC[C@]23CCOC3)c(F)c1 311592349 ATUQRIQZAHHOQC-CQSZACIVSA-N 268.307 2.183 10 10 CECE CN1CC[C@@H]2CN(c3ccc(CN)cc3Cl)C[C@@H]2C1 311836560 PXSLHVKORLZLKA-OLZOCXBDSA-N 279.815 2.187 10 10 CECE COc1ccc(CNC[C@H]2CCC[C@@H](CO)C2)c(O)c1 312319414 RMJKJJQWYRIBDE-QWHCGFSZSA-N 279.380 2.289 10 10 CECE Cc1c(C(=O)O)cc(CNCc2ccccc2O)n1C 312431792 AUROVHBZQJDBMZ-UHFFFAOYSA-N 274.320 2.027 10 10 CECE C[C@@H](c1ccccc1O)N1CCC[C@@]12CCS(=O)(=O)C2 2158456690 FREYLYPZURZBJE-WFASDCNBSA-N 295.404 2.106 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC[C@H]2CNC[C@@H]2C1 312590019 CUGZBOQSWVASLD-VNQPRFMTSA-N 273.424 2.355 10 10 CECE CNCc1ccc(N2CCC[C@@]23CC[S@@](=O)C3)c(C)c1 2158465692 SFGZQBAKQQPHPQ-OXJNMPFZSA-N 292.448 2.206 10 10 CECE C[C@H](c1cc(O)ccc1O)N1[C@H]2CC[C@@H]1C[C@@H](CN)C2 2159184176 HTARAMHTPAXCJO-LPWJVIDDSA-N 276.380 2.361 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@H](CN)C2 2159211266 PINYWMOKZDEODZ-FVCCEPFGSA-N 276.380 2.361 10 10 CECE C[C@@H](NCc1ccc(F)c(F)c1O)c1cnn(C)c1 703211719 BJWPUPXQSZFQPX-MRVPVSSYSA-N 267.279 2.255 10 10 CECE CCN1CCc2cc(N3CC[C@H]4CCN[C@H]4C3)ccc21 2163065229 YQKAIPPXLDMPAP-CJNGLKHVSA-N 271.408 2.257 10 10 CECE COC(C[C@](C)(N)c1ccc(N2CCCC2)cc1)OC 2163144508 MVKWEHDBUXDXAW-INIZCTEOSA-N 278.396 2.470 10 10 CECE C[C@H](C1CC1)[C@@H](O)[C@@H](N)c1ccc2c(c1)CCCN2C 2163232468 ZWKLLEZGTQWGJT-ZTFRIQLXSA-N 274.408 2.476 10 10 CECE C[C@H](C1CC1)[C@H](O)[C@@H](N)c1ccc2c(c1)CCCN2C 2163232466 ZWKLLEZGTQWGJT-NVGVWMPQSA-N 274.408 2.476 10 10 CECE C[C@H](O)[C@@H]1CCCCN1c1ccc(CN)c(F)c1F 688682877 DRHQNFDOQVWJJD-ONGXEEELSA-N 270.323 2.163 10 10 CECE COc1ccc(N2CCO[C@H](C(F)(F)F)CC2)c(N)c1 687567405 ISEIFFQAZPWFPZ-LBPRGKRZSA-N 290.285 2.435 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H](C)[C@@H](O)[C@H](C)C2)cc1 710903571 ZOGNSPSHQYNCPD-RSUWNVLCSA-N 262.397 2.420 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H](CF)C3)c(Cl)cc21 711404962 AYYXHORVHLNNLK-MADCSZMMSA-N 283.734 2.088 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CCCC[C@H]32)cc1 712382494 CXAKFMPBBDASCK-NILFDRSVSA-N 274.364 2.343 10 10 CECE 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2319744383 XCFFCTUQTGUQGD-JTQLQIEISA-N 252.333 2.134 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@@H](F)C2)c(CO)c1 2327460605 HQCCKNUXMSAGMR-KLPPZKSPSA-N 253.317 2.372 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CC[C@H]2SC)cc1 2328232309 WTBOFHQAPKMBSZ-ZIAGYGMSSA-N 266.410 2.354 10 10 CECE CSc1cc(N2C[C@@H](C)C[C@@H](O)C2)ccc1CN 2328536275 LBFNXOXZCYLJJY-GXFFZTMASA-N 266.410 2.074 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(SC)c2)CCO1 2328547321 ZCXOLWUPUQETKP-ZDUSSCGKSA-N 266.410 2.482 10 10 CECE COC[C@@]1(C)CCN1c1ccc(CN)c(SC)c1 2328544071 ZPRRHGLVEZGXNB-CQSZACIVSA-N 266.410 2.482 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@H]2C[C@@H]3OCC[C@@H]3O2)CC1 2329493087 DUBKNMWHXYIAIY-RNJOBUHISA-N 266.345 2.098 10 10 CECE C[C@H]1C[C@]2(CCN(c3ccc(CO)cc3F)C2)CO1 2335470667 KNEVHZTXKMJZGT-NHYWBVRUSA-N 265.328 2.323 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)c1C 2340859253 INXFOLKLDNKIIX-GMZLATJGSA-N 260.381 2.140 10 10 CECE Oc1ccc(CN[C@@H]2CCC[C@]34C[C@H](CO3)[C@H]24)cc1O 2354167113 CUYAAROXYXMLEV-CZPYZCIJSA-N 275.348 2.145 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CC[C@@H]3[C@H]2C3(F)F)cc1 2354371475 SBDOIUWCYKZQOQ-QKCSRTOESA-N 280.318 2.219 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@]1(O)C[C@H]2C=C[C@@H]1C2 2354609806 ORCSNMOEDDLBOH-LBRJOISOSA-N 272.392 2.340 10 10 CECE COc1cc(Cl)cc(CN[C@H]2C[C@@H]3C[C@H]2C[C@H]3O)c1O 2355718308 BCLVLXWUDVYRDL-WTTBSCSTSA-N 297.782 2.303 10 10 CECE CC[C@@H](N[C@H](C)c1ccc(F)cc1O)C(=O)OC 306114034 XTFJWEUCYOZTHI-LDYMZIIASA-N 255.289 2.134 10 10 CECE COc1cc(CC(=O)Cc2ccc(N)cc2)sn1 401167363 QZFRLIKMXNDGSI-UHFFFAOYSA-N 262.334 2.088 10 10 CECE CCn1ccnc(N(Cc2ccc(N)cc2)C2CC2)c1=O 61768639 WHEKCDAENHPNCY-UHFFFAOYSA-N 284.363 2.014 10 10 CECE C[C@@H](O)C[C@@H]1CCCN1c1ccc(CN)c(F)c1 306101815 PTIIFXSWUBKJTI-PWSUYJOCSA-N 252.333 2.024 10 10 CECE COc1cc(Br)c(O)c([C@@H](C)N)c1OC 213442345 IRZLICADCDLGQQ-RXMQYKEDSA-N 276.130 2.192 10 10 CECE Oc1cccc(CNc2ccc(-n3cncn3)cc2)c1O 41117727 FYSFYXVWCQBMFM-UHFFFAOYSA-N 282.303 2.291 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](CO)OC(C)(C)C2)cc1 228914495 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CCc1nc([C@@H](C)N[C@H](C)c2cc(OC)ccc2O)n[nH]1 273546606 ZLKFYBXBTYUZEW-NXEZZACHSA-N 290.367 2.493 10 10 CECE Oc1cc(F)c(Cl)cc1CNCc1nnc2n1CCC2 294208214 LDFGFZHCBVZHAO-UHFFFAOYSA-N 296.733 2.012 10 10 CECE CN1CCCc2cc([C@H](O)[C@@](C)(N)C(F)(F)F)ccc21 2163109317 YCDBWUCEKRZYFY-QWHCGFSZSA-N 288.313 2.382 10 10 CECE CN[C@@H](c1ccc(N2CCCC2)cc1)c1ncccn1 2163111915 XEJPLTVORMKZNH-HNNXBMFYSA-N 268.364 2.386 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H](O)[C@H]3CC3(C)C)ccc21 2163129990 CTAUKJLJSQDDON-KBMXLJTQSA-N 274.408 2.476 10 10 CECE CCc1nn(C)cc1[C@@H](N)c1ccc2c(c1)CCN2C 2163138445 NAUCJPUKDUZXNL-INIZCTEOSA-N 270.380 2.023 10 10 CECE CN1CCc2cc([C@H](N)c3cncn3C3CC3)ccc21 2163144441 MMFNNTFXVUTGPL-INIZCTEOSA-N 268.364 2.258 10 10 CECE CC[C@H](OC)[C@H](O)[C@@H](N)c1ccc(N(CC)CC)cc1 2163150139 RBUSWSGHEKXAOI-JYJNAYRXSA-N 280.412 2.319 10 10 CECE CCC[C@H](CN)NC(=O)/C=C\c1ccc(N(C)C)cc1 701397928 BLOLQCGLJUOZSH-KOTGUFOOSA-N 275.396 2.009 10 10 CECE CCOCC1CN(c2ccc(C=CC(=O)O)cc2F)C1 2165856741 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C[C@H](O)c1ccc(N(C)C[C@H]2C[C@H]2F)c([N+](=O)[O-])c1 2131784816 RUYDKGGCTPUTNV-JMJZKYOTSA-N 268.288 2.442 10 10 CECE CC(C)NC(=O)[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 827680947 RKEIMURZKRFTHG-GFCCVEGCSA-N 294.370 2.268 10 10 CECE CCCN(Cc1ccccc1O)C(=O)c1n[nH]cc1F 901053717 QIIIVIJETDKKED-UHFFFAOYSA-N 277.299 2.307 10 10 CECE C[C@@H]1C[C@H](NC/C=C/c2ccc(N(C)C)cc2)CCN1 841064115 YJFWMNFKZKOOIX-ATQQARJTSA-N 273.424 2.496 10 10 CECE COc1ccc2c(c1)CCN2Cc1ccc(C)nn1 840908955 ZJBRBQMWQSEGPL-UHFFFAOYSA-N 255.321 2.356 10 10 CECE Oc1c(CN2CCn3nncc3C2)ccc2ccccc12 848921961 KKVWCGUDUGVSIV-UHFFFAOYSA-N 280.331 2.153 10 10 CECE CC(C)C[C@H](N)c1noc(Cc2ccc(N)cc2)n1 842588642 NRRLRBZEXFPQRX-LBPRGKRZSA-N 260.341 2.289 10 10 CECE COCCC1(C(=O)NCc2c(O)cccc2F)CCC1 928706123 RETMRVPLAPPMQO-UHFFFAOYSA-N 281.327 2.354 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)NCc1c(O)cccc1F 928712364 SHYWTLAYQATLRN-GRYCIOLGSA-N 294.370 2.409 10 10 CECE CC[S@](=O)CCN[C@@H](C)c1cc(Cl)ccc1O 756578042 VQAUDESUXOXYQY-XYZCENFISA-N 275.801 2.465 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H]3C[C@H](C)O[C@H]3C)C2)cc1 850347859 ZGTQNBKVUUQQHZ-AYMQEEERSA-N 290.407 2.429 10 10 CECE COc1ccc(N(C)C[C@@H]2CCC3(CNC3)O2)cc1Cl 852745885 CPWPGSBBHKQAHE-LBPRGKRZSA-N 296.798 2.306 10 10 CECE CCOC(=O)[C@@H]1C[C@H]1CN(C)c1ccc(OC)cc1OC 930080885 DKORIYTZFPWUQS-WCQYABFASA-N 293.363 2.339 10 10 CECE Cc1cc(C)n(CCC(=O)N2Cc3cccc(O)c3C2)n1 871198682 MZZTYVWZPITKSY-UHFFFAOYSA-N 285.347 2.138 10 10 CECE C[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)c1ccncc1 779528154 KCRZXYKQVXXGIC-FHMRSRPSSA-N 298.342 2.426 10 10 CECE Cc1cc(Cl)cc(CN2CCC(OCCO)CC2)c1O 775733633 WLXMJAAHWRJWJV-UHFFFAOYSA-N 299.798 2.327 10 10 CECE Cc1ccc(O)c2c1[C@H](c1ccc(O)c(O)c1)NCC2 83625406 UAQORBPHVBOPLD-INIZCTEOSA-N 271.316 2.347 10 10 CECE Oc1ccc([C@H]2NCCc3cc(F)ccc32)c(O)c1 83621754 VIHYHILIUPZIKX-HNNXBMFYSA-N 259.280 2.472 10 10 CECE CNCc1ccc(N2CCC[C@H]3COC[C@@H]32)c(C)c1 702082244 UWNPMUFSNNYEDJ-HOCLYGCPSA-N 260.381 2.330 10 10 CECE OC[C@H](NCc1ccc(F)c(F)c1O)c1ccccc1 703257413 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COc1cccc(CN[C@H](CO)c2cccs2)c1O 2119009508 LRWRETUITVMQFP-LLVKDONJSA-N 279.361 2.286 10 10 CECE COc1ccc(CN[C@H](CO)c2cscn2)cc1C 2119000718 CUXRFGIMUOSSBF-GFCCVEGCSA-N 278.377 2.283 10 10 CECE Nc1ccc(CCOc2nncc3ncsc23)cc1 2119806160 VPCOYZZHWBSKNH-UHFFFAOYSA-N 272.333 2.290 10 10 CECE CN[C@H](C)c1ccc(N2CC(CCN(C)C)C2)cc1 2120160378 MSTUZFLNDZWLHA-CYBMUJFWSA-N 261.413 2.355 10 10 CECE C[C@@H](O)c1ccc(N2CCC3(CC2)COC3)cc1O 2121065718 HCWUJESPHNBRLQ-LLVKDONJSA-N 263.337 2.062 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@H]4C[C@H]3CO4)ccc21 2128278183 BODNUYSFCCSGBS-SQWLQELKSA-N 258.365 2.261 10 10 CECE CCCN[C@H]1CCc2cc(N(C)C[C@@H](C)O)ccc21 2128326902 BUOMWKZGLXGPDM-WBMJQRKESA-N 262.397 2.491 10 10 CECE CN[C@@H]1CCc2cc(N3CC(C(C)(C)O)C3)ccc21 2128309509 TZSTXUZXTQLFRQ-OAHLLOKOSA-N 260.381 2.100 10 10 CECE C[C@@H]1CC[C@H](CO)CN1c1ccc2c(c1)CC[C@@H]2N 2128324820 KNWWSWNXBTZKDH-WQGACYEGSA-N 260.381 2.230 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@H]1COC2(CCC2)C1 2122476122 DWMRDSBJWIRCKN-CYBMUJFWSA-N 264.344 2.432 10 10 CECE COc1cccc(C)c1[C@H](NCCN=[N+]=[N-])C(=O)O 2126927405 IRJNJWXXHVAXQB-NSHDSACASA-N 264.285 2.029 10 10 CECE COC(=O)c1cc(C)nc(NCc2c(O)cccc2F)n1 1187677904 QLGOECQKAUSHNR-UHFFFAOYSA-N 291.282 2.028 10 10 CECE CCNCc1ccc(OC[C@@H]2[C@H]3COC[C@H]32)c(C)c1 2132397681 QKMJEYJGTCQRRD-FICVDOATSA-N 261.365 2.376 10 10 CECE COCC(COC)CN(C)Cc1cc(C)ccc1O 1910205537 TWTBMVVTHLSJQG-UHFFFAOYSA-N 267.369 2.041 10 10 CECE CO[C@@H]1CCN(c2ccc([C@@H](C)N)c(O)c2)[C@@H]1C 1914270176 YMXKYTUUJNKOCQ-GPCCPHFNSA-N 250.342 2.026 10 10 CECE CN(c1ccc(CNC2CC2)cc1Cl)C1COC1 1915680584 OIKLSODSRMFWHS-UHFFFAOYSA-N 266.772 2.427 10 10 CECE CCNCc1ccc(N(C)C2CC(O)C2)cc1Cl 1914595722 HMIPVDGDVSIIGA-UHFFFAOYSA-N 268.788 2.409 10 10 CECE CN1CCC(CC(=O)N2CCC[C@H](N=[N+]=[N-])C2)CC1 1912156465 MJDZKIMAXPPPEG-LBPRGKRZSA-N 265.361 2.020 10 10 CECE CN(CCCN=[N+]=[N-])C[C@@H]1CC2(CCOCC2)CO1 1912151471 IAVSGKXFLVYCMK-LBPRGKRZSA-N 268.361 2.204 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C[C@H](C(=O)O)c2ccccc2)C1 1912145993 NYVBBTXKRLRMRS-YPMHNXCESA-N 274.324 2.487 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)COc2cccc(F)c2)C1 1912164307 VPLXERXKDNPURC-JTQLQIEISA-N 264.260 2.116 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@H]2CCCCNC2=O)CC1 2134668061 AHGZXXLJAZWYLN-NEPJUHHUSA-N 265.361 2.068 10 10 CECE CCCCCNC(=O)[C@@H](C)N1CC[C@H](N=[N+]=[N-])C1 1912200773 LCBMFAIROSFEIX-MNOVXSKESA-N 253.350 2.066 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@H]1C[C@@H]1C1CCOCC1 2135423792 LQICUNLJRPJMIK-VXGBXAGGSA-N 266.345 2.256 10 10 CECE C[C@H]1COCC[C@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1466855266 GALWMTKKKFRBQM-JOYOIKCWSA-N 290.323 2.004 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCSC[C@H]2C(=O)O)c1 2136339235 LORVZHATQHLXIO-PWSUYJOCSA-N 281.377 2.264 10 10 CECE CN(C)[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(N)cc1 1921767156 BNSAYRJRVANLHH-UONOGXRCSA-N 276.384 2.263 10 10 CECE CCNCc1ccc(N2CCOCC2)c(OCC)c1 211990991 MJDNCSYPTWVBAX-UHFFFAOYSA-N 264.369 2.031 10 10 CECE CNCc1ccc(N2CCCC[C@@H]2CCO)c(OC)c1 212651410 RFNFYOBFAHKQQJ-CQSZACIVSA-N 278.396 2.156 10 10 CECE CN(C)c1ccc(CNC2CC(O)(C(F)(F)F)C2)cc1 1923067404 BYJHSVCVBAKYJC-UHFFFAOYSA-N 288.313 2.298 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)CC(C)(C)C2)c(F)c1 1923176098 VKBHNYQMSUZIJP-ZYHUDNBSSA-N 267.344 2.476 10 10 CECE CC1(C)C[C@H](O)CN(c2ccc(CO)c(Cl)c2)C1 1923166627 BOOGRBRYULGLTF-LBPRGKRZSA-N 269.772 2.430 10 10 CECE CN(C)c1ccc(CNC(=O)c2coc(C=O)c2)cc1 1540417534 RECGBOWPSRRNPW-UHFFFAOYSA-N 272.304 2.088 10 10 CECE COc1ccc(CN[C@@]23CCC[C@@H](C2)OC3)c(O)c1 1925100381 UWCHCZXFMGSUSI-ZFWWWQNUSA-N 263.337 2.202 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](O)CC3(CC3)C2)cc1 1926413761 JZGMHZFHSIAXJS-WFASDCNBSA-N 260.381 2.318 10 10 CECE CN=c1cc(CSc2nccs2)cc(OC)[nH]1 2252946435 BMPLNAIAUGFXJY-UHFFFAOYSA-N 267.379 2.303 10 10 CECE Cc1ccc(S(=O)(=O)Nc2ccc(N)cc2)c(Cl)n1 2137721197 MEMNYCUEEHKXFQ-UHFFFAOYSA-N 297.767 2.426 10 10 CECE C[C@@](O)(COCc1ccccc1)[C@H](N)c1ccccc1O 1929438296 KPFGUGZOICGSPQ-IAGOWNOFSA-N 287.359 2.360 10 10 CECE CN(C[C@]12CO[C@](CF)(C1)C2)c1ccc(CO)cc1 2138090895 CVLJAXUFQBZWBE-GASCZTMLSA-N 265.328 2.134 10 10 CECE CCOCCN(CCOCC)c1ccc(CN)c(C)c1 123526568 FYWLNLDJDOVQIP-UHFFFAOYSA-N 280.412 2.333 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H]3C(=O)NC[C@@H]32)c(Cl)c1 232290344 YHPRHNWYPJZEEN-CHIMOYNISA-N 293.798 2.075 10 10 CECE CC1CCN(CCN[C@@H](C)c2c(O)cccc2O)CC1 232830171 ANDRVFMBAHXEOX-ZDUSSCGKSA-N 278.396 2.480 10 10 CECE CCNCc1ccc(N2CCCOCC2)cc1OC 2139687428 YPSVQDFJVYOKQK-UHFFFAOYSA-N 264.369 2.031 10 10 CECE CCNCc1ccc(N(C)[C@H](C)CCO)cc1OC 2139697260 SJCUTCMQVXPFTD-GFCCVEGCSA-N 266.385 2.012 10 10 CECE Cc1cccc(CNC(=O)[C@H](C)[C@@H]2CCCO2)c1O 2139742075 AKOVIMZTMLVRMO-YPMHNXCESA-N 263.337 2.132 10 10 CECE Cc1ccc(CNCCn2cnc(C)c2C)c(O)c1 2139767248 JMPONJKFSRAAOD-UHFFFAOYSA-N 259.353 2.304 10 10 CECE CN(CCc1ccccn1)c1ccc(CN)c(F)c1 135220479 RHETWIBMVOAXBX-UHFFFAOYSA-N 259.328 2.358 10 10 CECE Nc1ccc(OCC(=O)OC[C@]2(Cl)CC2(F)F)cc1 2140753623 XVZUHZHLWOIEBQ-LLVKDONJSA-N 291.681 2.207 10 10 CECE CCN1N=C(C)/C(=C\c2ccc([N+](=O)[O-])cc2)C1=O 1865680111 XXNFCODCJDXUNM-XYOKQWHBSA-N 259.265 2.216 10 10 CECE CC[C@@H]1OCC[C@H]1CNCc1cccc(OC)c1O 233922422 ZRKUIMUMTOIHEE-AAEUAGOBSA-N 265.353 2.306 10 10 CECE CCc1cccc(CNC[C@H]2C[C@@H](N(C)C)C2)c1O 848923527 MHTWSZZGKXTWNZ-JNSHFYNHSA-N 262.397 2.384 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1S(=O)(=O)Nc1ccc(O)c(Cl)c1 1945732934 PDYVHFFNCSJQGR-IIDWOEFGSA-N 275.757 2.442 10 10 CECE CN1CCc2cc([C@H](N)C34CCC(CC3)O4)ccc21 1876807825 VDBYITDEEGJLNW-SIWZUTFBSA-N 258.365 2.390 10 10 CECE COc1ccnc(N(C)[C@@H](C)c2ccccc2O)n1 1877538944 QKOKCVRLXDMVTI-JTQLQIEISA-N 259.309 2.388 10 10 CECE CN(CC12CC(CO1)C2)c1c(F)cc(CO)cc1F 1878442231 WEIJGQQMZXVGII-UHFFFAOYSA-N 269.291 2.072 10 10 CECE COc1ccc([C@@H](CO)N=[N+]=[N-])c(OC)c1OC 1951360000 WXMVHWJZHIBALS-MRVPVSSYSA-N 253.258 2.056 10 10 CECE CN(C)C1(CNCc2c(O)cccc2F)CCC1 1964045334 NBKXSLGPTZDJGW-UHFFFAOYSA-N 252.333 2.105 10 10 CECE CN(C)c1ccc([C@H](N)c2ccnn2C2CC2)cc1 1879747038 XSFLOSOKESLQQY-HNNXBMFYSA-N 256.353 2.332 10 10 CECE OCc1cc(F)c(N2CC[C@@H]3C[C@H](O)CC[C@@H]32)c(F)c1 2143966091 JBRCNBCBSIKSMN-GYSYKLTISA-N 283.318 2.197 10 10 CECE CC[C@H](N[C@@H]1CCS(=O)(=O)[C@@H](C)C1)c1ccccc1O 2143954207 RRKKFPFDJICMHX-SCRDCRAPSA-N 297.420 2.399 10 10 CECE CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1885562243 COCGWKGXWRWDRT-NXEZZACHSA-N 297.359 2.201 10 10 CECE C[C@@H]1OCC[C@@H]1CCN1CCc2cc(CN)ccc21 1885649532 RLWVOKTWRZSJHR-JSGCOSHPSA-N 260.381 2.323 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[C@H]2CO)c(F)c1 250272220 HIWCKHSHEFOWHY-YPMHNXCESA-N 266.360 2.457 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H](CC)CCO 1886768560 OPAINERLAZZHGS-JTQLQIEISA-N 266.341 2.018 10 10 CECE COc1cccc(O)c1CN1CC[C@]2(CCCO2)C1 1967822422 MKITWMGNOAXSHQ-OAHLLOKOSA-N 263.337 2.156 10 10 CECE CC[C@H]1CN(c2ccc(OC)cc2[N+](=O)[O-])CC[C@H]1N 251654970 GRMGGNNZLMUTEZ-CMPLNLGQSA-N 279.340 2.167 10 10 CECE C[C@@H](NC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1c(O)cccc1O 2145215911 GSOTXXFCZZUBHP-YRORDHRNSA-N 277.364 2.300 10 10 CECE CC[C@@H]1CCN[C@@H]1c1nc(-c2ccc(O)c(O)c2)no1 2151490943 BBBXXDMYPZUDAB-PELKAZGASA-N 275.308 2.208 10 10 CECE Fc1cc([C@@H]2CCCCN2)ccc1N1CCOCC1 258397118 KAKDDAYUXUDQIT-AWEZNQCLSA-N 264.344 2.477 10 10 CECE C[C@@H](OC1(C)CCOCC1)C(=O)Nc1ccc(N)cc1 2146254583 OALZANKLRHPMJH-LLVKDONJSA-N 278.352 2.182 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CCC[C@@H](C(N)=O)C2)c1 2146213070 ZYBROZVTAOIGLJ-XQQFMLRXSA-N 276.380 2.395 10 10 CECE COC(=O)c1cc(N)c(-c2ccc(N(C)C)cc2)[nH]1 259671932 KDYDHHSSAYNIOM-UHFFFAOYSA-N 259.309 2.117 10 10 CECE COc1ccc(O)c(CN[C@@H]2CCCC[C@@H]2CCO)c1 2146733307 DXGQCKOXTYUUBG-IUODEOHRSA-N 279.380 2.432 10 10 CECE Cc1ncc(C(=O)[C@H](O)c2ccc3c(c2)CCN3C)s1 2147115110 GTEQTIBFJINTND-CQSZACIVSA-N 288.372 2.360 10 10 CECE CC[C@@H](O)c1ccc(N2CCC[C@H]2CS(C)(=O)=O)cc1 2151277374 WOODQWWRSFAHTL-LSDHHAIUSA-N 297.420 2.143 10 10 CECE CCCN[C@H]1CCN(c2ccc3c(c2)OCCO3)C1 37241287 KRANJHLTAOWCSC-LBPRGKRZSA-N 262.353 2.036 10 10 CECE Nc1ccc(CN2C(=O)CC3(CCCC3)C2=O)cc1 37666364 CNCDGIGHKQTSKB-UHFFFAOYSA-N 258.321 2.088 10 10 CECE CCN[C@@H](C)c1ccc2c(c1)CCCN2C[C@@H](C)O 162256787 PGFXEPIKOZFAAQ-OLZOCXBDSA-N 262.397 2.491 10 10 CECE Oc1ccc(CNC[C@H]2Cc3ccccc3O2)c(O)c1 38009490 SBPBVWBAINSHOD-CQSZACIVSA-N 271.316 2.191 10 10 CECE COc1ccc(C)c([C@@H](O)[C@@H](N)c2ccccc2O)c1 2148153909 HHXJPRNOLYVMJZ-JKSUJKDBSA-N 273.332 2.443 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CCO[C@@H](C(C)C)C1 2148159004 CVIGCZLMKMQGHP-OAGGEKHMSA-N 279.380 2.219 10 10 CECE CC(C)N(CC1CC1)c1cc2c(cc1N)OCC(=O)N2 42579593 ZFUIQFIYTLIREB-UHFFFAOYSA-N 275.352 2.225 10 10 CECE C[C@H]1CC[C@H](CN(C)CC(=O)c2ccc(O)c(O)c2)S1 2151683341 OMEHCBVKQBOXFN-CMPLNLGQSA-N 295.404 2.496 10 10 CECE CCOC(=O)c1c[nH]nc1CSc1nccs1 2001653427 YWAUBXKIFPYQKR-UHFFFAOYSA-N 269.351 2.335 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N1CCOC[C@H]1CN(C)C 2153248368 RCESBJFRMPMFNQ-DGCLKSJQSA-N 298.814 2.369 10 10 CECE COC[C@H](O)COc1ccc(CNC(C)(C)C)cc1C 2155018523 GZUHTAFZQJWGQW-AWEZNQCLSA-N 281.396 2.269 10 10 CECE C[C@@H](c1ccccc1O)N(C)CCCC(N)=S 2017501167 DMEDXKNZPGEGMM-JTQLQIEISA-N 252.383 2.451 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H](CO)C(C)(C)C)c1 289731460 OWRLMZZQWXNZTC-YGRLFVJLSA-N 267.369 2.458 10 10 CECE C[C@H](CCC(F)F)NC(=O)c1ccc(O)c(O)c1 2029460709 BRYPPRHTPBKZNG-SSDOTTSWSA-N 259.252 2.261 10 10 CECE CC[C@@H](C)N(CCO)CCCc1ccc(N)cc1 2030157351 NUTPMWQTVMKVMJ-CYBMUJFWSA-N 250.386 2.294 10 10 CECE CO[C@H]1CCN(c2ccc(CN)cc2F)C[C@@H]1C 2031977353 KFDHCBMDQUBBBV-HZMBPMFUSA-N 252.333 2.146 10 10 CECE Cc1cc(NS(=O)(=O)C2[C@H](C)[C@H]2C)c(C)cc1O 2033547075 HRIZYWKUGIFFIQ-NXEZZACHSA-N 269.366 2.405 10 10 CECE C[C@H]1CCN(C(=O)Nc2ccc(N)cc2)C[C@@H]1F 2034801653 GPYMBRNCYFTCOA-CABZTGNLSA-N 251.305 2.481 10 10 CECE COC(=O)[C@](C)(Cc1ccc(C)cc1)NCCN=[N+]=[N-] 2159828863 OTKSPRJUYKPJCM-AWEZNQCLSA-N 276.340 2.369 10 10 CECE NCc1ccc(N2CC(F)(F)C[C@H]2CO)c(Cl)c1 2041115324 KZIWQPQDHABGDY-VIFPVBQESA-N 276.714 2.005 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)CCOC2CC2)CC1 2038003059 SIAJQLAYQHEBEK-SNVBAGLBSA-N 252.318 2.247 10 10 CECE Cc1cc([C@](C)(N)c2ccc(N(C)C)cc2)c(C)nn1 2157934507 FLCYQXAZTOMYIP-MRXNPFEDSA-N 270.380 2.382 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1[C@H](CN)CCC[C@H]1C 70150395 BOZZXWSEXHAHRG-WOPDTQHZSA-N 264.369 2.361 10 10 CECE CN(CCCC1CC1)c1cc2c(cc1N)OCC(=O)N2 400722609 YWILEHPZEAWRES-UHFFFAOYSA-N 275.352 2.226 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)C[C@H]1CCOC1 401446607 NNWKCJKRCCUUAD-CYBMUJFWSA-N 262.353 2.044 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1ccc(O)cc1F 404118477 LCMVHGCXGCWFLJ-LLVKDONJSA-N 282.275 2.035 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@](O)(C(F)(F)F)C2)cc1 311673029 LYWMYMFQUOZDKK-CABZTGNLSA-N 274.286 2.210 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@]23CC[S@](=O)C3)c(F)c1 2158464724 KBYCKCWXMDZZNM-ORBZYBPHSA-N 296.411 2.337 10 10 CECE Cc1cc(CN)ccc1N1CCC12CC(CN(C)C)C2 2160889243 FODRVTGPYSPFNZ-UHFFFAOYSA-N 273.424 2.374 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H](C(=O)O)OC(C)(C)C1 2160962386 BUSCTVIQXXQHAY-MFKMUULPSA-N 279.336 2.017 10 10 CECE COc1ccc(O)c(CN[C@H]2CC[C@@H]2SC)c1 701991715 FBPCCXLDXIKABV-AAEUAGOBSA-N 253.367 2.384 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCC(C)(N)CC1 704535744 KWCCEULLPHRTNO-SNVBAGLBSA-N 252.333 2.406 10 10 CECE CN(C)c1ccc([C@H](O)CCCCS(C)(=O)=O)cc1 705707132 RBZLICQMFHFGJP-CQSZACIVSA-N 285.409 2.001 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@H]2CCC[C@@H]21 706731546 QLKCHIDJWYDZMH-GYSYKLTISA-N 259.353 2.080 10 10 CECE NC1CCN(c2ccc(O[C@H]3CCCO3)cc2)CC1 686718446 ZHHIWVGUUGXUHK-HNNXBMFYSA-N 262.353 2.129 10 10 CECE OCC[C@@H]1CSCCN1c1ccc(CO)c(Cl)c1 689349527 QSTIHCUKJSGKHR-GFCCVEGCSA-N 287.812 2.137 10 10 CECE Nc1ccc(OCCCN2CCC[C@@H]3COC[C@@H]32)cc1 690377246 TWIJLDUQSGGXDJ-CJNGLKHVSA-N 276.380 2.149 10 10 CECE CN(C1CC1)C1CN(c2ccc(C=CC(=O)O)cc2)C1 2172998507 ZIOYUWYZDLRXSG-UHFFFAOYSA-N 272.348 2.067 10 10 CECE COc1ccc(S(=O)(=O)N2CCC[C@@H]2CN=[N+]=[N-])cc1 692896645 WNMHQTYEEAYZPI-SNVBAGLBSA-N 296.352 2.159 10 10 CECE CO[C@@H](CN[C@@H](C)c1cc(O)ccc1O)C(C)C 381926525 QDWBPCUNGODBAA-HZMBPMFUSA-N 253.342 2.419 10 10 CECE COC1(C)CN(c2ccc(CN)cc2C(F)(F)F)C1 382624435 LFYDVKORNLXHRU-UHFFFAOYSA-N 274.286 2.389 10 10 CECE CN(c1c(F)cc(CO)cc1F)[C@@H]1CN(C)C(C)(C)C1 694149972 RJAWNUNFMKGMME-NSHDSACASA-N 284.350 2.376 10 10 CECE C[C@H](N[C@@H](CO)C1CCCC1)c1c(O)cccc1O 386119701 BZCLKWYSEXZMAB-JQWIXIFHSA-N 265.353 2.300 10 10 CECE CCN(C(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(N)cc1 386734268 CRXYMDJMFKHOML-HZSPNIEDSA-N 260.337 2.189 10 10 CECE Oc1ccc(CNCc2ncc(Cl)s2)c(O)c1O 719402460 RENIGJCRBZIHQE-UHFFFAOYSA-N 286.740 2.203 10 10 CECE CN(C)c1ccc(CNCCn2cc(Cl)cn2)cc1 388356516 GTEBSHJNDCYWEX-UHFFFAOYSA-N 278.787 2.392 10 10 CECE CCc1nnc(CN[C@@H](C)c2cc(O)ccc2O)s1 391931865 HPHKFPNPUKWFKE-QMMMGPOBSA-N 279.365 2.363 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@@H](C(=O)O)C[C@@H](C)C1 398839738 JTNZQXQLJCKEKX-WOPDTQHZSA-N 263.337 2.496 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@H](O)CC[C@H]2C)c1O 399380155 WHZCRXPGFYUQLV-NOZJJQNGSA-N 281.327 2.079 10 10 CECE COCCN1CCC[C@@H](Nc2c(C)cccc2N)C1 399540007 XYZUYXQLRQBECK-CYBMUJFWSA-N 263.385 2.100 10 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COc1cc(Cl)cc(CN[C@H]2CC[C@H]2N(C)C)c1O 2101502265 GYVKKKKNLBGIGQ-NWDGAFQWSA-N 284.787 2.236 10 10 CECE Cc1cc(N2CCC[C@]3(C)COC[C@@H]23)ccc1CO 2103587809 GNHMCAWPEQSWTL-HZPDHXFCSA-N 261.365 2.493 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H](C(=O)O)C[C@@H]1C 2104484339 ROOSPONYHSKHGZ-NWDGAFQWSA-N 263.337 2.386 10 10 CECE CCN1CC[C@@H](N(CC)Cc2c(O)cccc2F)C1 2104476365 NCIYPIDBQYTUTN-GFCCVEGCSA-N 266.360 2.447 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@]2(C)CCO)c(F)c1 2084699115 DBZBDAJZPKFPNT-YGRLFVJLSA-N 253.317 2.230 10 10 CECE C[C@@H]1Cc2cc(N(CC3CC3)C3CNC3)ccc2O1 2106351142 QNUCKAXTIOVTDB-LLVKDONJSA-N 258.365 2.198 10 10 CECE C[C@@H]1C[C@@H](CN)CCN1c1ccc2c(c1)OCCO2 2106381489 FDYXLOOVNCVPOY-NEPJUHHUSA-N 262.353 2.021 10 10 CECE CN(c1ccc2c(c1)COCC2)[C@H]1CCC[C@H]1CN 2106341662 NZIOBCPXKZTMGP-BBRMVZONSA-N 260.381 2.323 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2CN3CCC2CC3)cc1 2106795115 DGYXLGDQQHEGKG-CVEARBPZSA-N 260.381 2.128 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H]3CSCCO3)ccc21 2106792443 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CCC1CC(N(C)c2ccc3c(c2)NC(=O)[C@@H]3O)C1 2096918780 AGCUEJBCBFJFMF-PFMWSLTASA-N 260.337 2.297 10 10 CECE C[C@@H](O)C12CCC(CC1)N2c1ccc(CN)cc1F 2097063836 CBQDUKQFNXPLAA-CKQAKLJMSA-N 264.344 2.167 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CC[C@H]2CO)CC3)cc1 2097889519 BWNXQAJIEOAXRT-DOMZBBRYSA-N 261.365 2.481 10 10 CECE CCc1nnc(CN2CCC[C@H](N=[N+]=[N-])CC2)n1C 2099341930 QXDRNLUMIIBNMI-JTQLQIEISA-N 263.349 2.042 10 10 CECE CN[C@H](C)c1ccc(N2CCCC[C@H](O)C2)c(F)c1 2112918541 MAPYEDGUAKHWNW-YPMHNXCESA-N 266.360 2.457 10 10 CECE Cc1cc(CN)ccc1N1CCS[C@H]2COCC[C@@H]21 2114093727 YJRZQGSOAJVHLJ-GJZGRUSLSA-N 278.421 2.164 10 10 CECE Cc1cccc(O)c1CN1CC[C@H]2CN(C)CC[C@H]21 2114505089 FMOHXCWKFKVQST-DZGCQCFKSA-N 260.381 2.227 10 10 CECE COc1cc(N(CCO)C2CC2)ccc1CNC(C)C 2204556912 JQHQAJNZPFRFLQ-UHFFFAOYSA-N 278.396 2.154 10 10 CECE COc1cc(N(C)CC[C@H]2CC[C@@H]2OC)ccc1CN 2204548381 OIRNEGSAOIZQNT-DOMZBBRYSA-N 278.396 2.405 10 10 CECE Cc1cccc(CN2C(=O)[C@H]3[C@@H](CC3(C)C)C2=O)c1O 2204608965 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C[C@]1(O)C[C@H]2[C@H]1CCN2c1ccc2c(c1)CCC[C@@H]2O 2233826809 OXBLTLUHEZPKMU-QZWWFDLISA-N 273.376 2.406 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)Cc2sccc2C(=O)O)C1 2234166793 QKSHOSZQGBGZPH-MRVPVSSYSA-N 294.336 2.148 10 10 CECE COC[C@@](C)(CO)N(C)c1ccc(OC(F)(F)F)cc1 2234896085 YESRKZSUVURTMV-GFCCVEGCSA-N 293.285 2.419 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)OCCCO3)C[C@@]1(C)O 2235130669 BXPMEODXHZOGMN-BLLLJJGKSA-N 277.364 2.445 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H](CO)C3)c(OC)c1 2235120439 DONFPYHMRUWWRU-CLLJXQQHSA-N 277.364 2.444 10 10 CECE CCN1CCc2cc([C@H](N)[C@H](O)[C@@H]3CC3(F)F)ccc21 2235309808 DDYWKABFPGTQMN-FPMFFAJLSA-N 282.334 2.085 10 10 CECE COc1ccc(N(C)[C@H]2CCN3CC[C@H]2C3)c(C=O)c1 2235999465 JRIXUYCVQLJMMY-LRDDRELGSA-N 274.364 2.038 10 10 CECE COc1ccc(N2CC[C@@H]3CCOC[C@H]3C2)c(C=O)c1 2235992599 PFMKMOLGCRQEPL-TZMCWYRMSA-N 275.348 2.371 10 10 CECE COCCN(c1ccc(OC)cc1CO)[C@@H](C)C1CC1 2236000470 VJVODBVLAXBIIC-LBPRGKRZSA-N 279.380 2.439 10 10 CECE 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CECE C[C@H](NCc1ccc(O)cc1O)C1CCOCC1 230223908 GLSJDSBOOUOQDX-JTQLQIEISA-N 251.326 2.003 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2CCc3cccnc32)cc1 97760869 AJDVYMKDTRAQNX-WBVHZDCISA-N 282.391 2.382 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1ccccc1C 90257505 GMOUOPNYHFBRPU-GFCCVEGCSA-N 262.313 2.499 10 10 CECE CC(C)Cn1ncnc1C[C@H](N)c1ccc(N(C)C)cc1 97278464 YEWZHVLHYMAJMY-HNNXBMFYSA-N 287.411 2.243 10 10 CECE CNCc1ccc(N(CCO)C2CC2)cc1Cl 234420287 BLBPDZWERJVDEH-UHFFFAOYSA-N 254.761 2.021 10 10 CECE COC(=O)C[C@H](C)N[C@@H](C)c1ccc(C)cc1O 385464142 IRSHGJGOHATAMO-QWRGUYRKSA-N 251.326 2.303 10 10 CECE CCOc1ccc(O)c(CN2CC[C@H](O)C(C)(C)C2)c1 275850380 HXGQUTSXLVLFRF-HNNXBMFYSA-N 279.380 2.384 10 10 CECE COC(=O)CN(Cc1cc(Cl)c(F)cc1O)C1CC1 294145512 HRXPLJQKTHGDSQ-UHFFFAOYSA-N 287.718 2.322 10 10 CECE C[C@@H](N)c1ccc(N(C)CC(=O)N2CCCC2)c(Cl)c1 723200751 XYNUDTWQAOMHRK-LLVKDONJSA-N 295.814 2.418 10 10 CECE CCN1CCc2cc([C@H](N)c3ccnnc3C)ccc21 2163071222 MPAHDVVTDCKYAZ-INIZCTEOSA-N 268.364 2.216 10 10 CECE 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NCc1ccc(N2CCO[C@H]3CCC[C@@H]32)c(F)c1 44420314 HGBPUKWRFCITRA-KBPBESRZSA-N 250.317 2.042 10 10 CECE COc1cccc(CN2CCS[C@@H](C)C2)c1O 131388471 QGSYNYXPNOTGEK-JTQLQIEISA-N 253.367 2.338 10 10 CECE CCN(Cc1ccc(N)cc1)S(=O)(=O)CC(C)C 83805444 CAGNVMHDMCRPBY-UHFFFAOYSA-N 270.398 2.077 10 10 CECE N[C@]1(CO)CCC[C@H]1CCSc1nccs1 86548483 CSZTUWPCMWYJGL-ONGXEEELSA-N 258.412 2.115 10 10 CECE CCc1cnc(CNCc2ccc(O)c(O)c2)s1 226759458 HNSAHBHDQNUMJB-UHFFFAOYSA-N 264.350 2.407 10 10 CECE COCCN(CCOC)c1ccc(CNC2CC2)cc1F 48895571 OXEWHXBVSMWIRB-UHFFFAOYSA-N 296.386 2.177 10 10 CECE CN(Cc1cc(Cl)ccc1O)C[C@H]1CCCN1 234328949 AQZHAJQCWGQECY-GFCCVEGCSA-N 254.761 2.229 10 10 CECE COc1cccc(CNC(=O)[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)c1O 246885583 IJZUCBCNYCLPPC-FQOPFDEGSA-N 287.359 2.309 10 10 CECE CO[C@@H]1CCN([C@@H](C)c2ccc(N(C)C)cc2)[C@H](CN)C1 252781121 UDUOJJPKAGEFJE-RRQGHBQHSA-N 291.439 2.252 10 10 CECE COc1cc2c(cc1Cl)N(C)C[C@@H]2N1CCCNCC1 527414294 BMYVVQWQOSKXNK-AWEZNQCLSA-N 295.814 2.135 10 10 CECE 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251.660 2.364 10 10 CECE Oc1cccc(Cl)c1CN1CCC2(CCN2)CC1 817865100 GWNBFVKLKMIYLM-UHFFFAOYSA-N 266.772 2.374 10 10 CECE CO[C@@H]1CC[C@@H]1NCc1cc(Br)ccc1O 724184512 JUFPXRYJYFJCEW-CMPLNLGQSA-N 286.169 2.422 10 10 CECE Cc1cccc(CN2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c1O 825124771 XTYFQZDLKPTZBW-DGCLKSJQSA-N 289.297 2.446 10 10 CECE COC1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 843889829 PWXQEXUBDHNWBP-UHFFFAOYSA-N 290.146 2.494 10 10 CECE COc1ccc(N(C)CCN(C)Cc2cncnc2)cc1 846051659 KCZDTPAOAWYCGA-UHFFFAOYSA-N 286.379 2.053 10 10 CECE COc1ccc(N(C)Cc2cncnc2OC)cc1OC 843404357 SFCWQMJKFQBRKS-UHFFFAOYSA-N 289.335 2.139 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@@H]1CCSC1 62710440 HBKZNRWZZAYYIK-SECBINFHSA-N 258.337 2.365 10 10 CECE CN(C)c1cc(F)c(CNCC2=CCOCC2)cc1F 858171343 PWPITPOZUCCPDR-UHFFFAOYSA-N 282.334 2.467 10 10 CECE CN(C)c1ccc(CN2C[C@@H]3COC[C@]3(C)C2)cc1 852534299 KAJVCGOUFBVWEX-ZBFHGGJFSA-N 260.381 2.221 10 10 CECE Cc1ccc(C(=O)NC2(c3ncccn3)CCC2)c(O)c1O 920770380 RRNJNUCSHCOBOT-UHFFFAOYSA-N 299.330 2.005 10 10 CECE O=C1Nc2cc(N3CC[C@@H]4C[C@@H]4C3)c(Cl)cc2[C@@H]1O 699173993 FAZUIGAYMXXPJC-RBDZCENOSA-N 278.739 2.172 10 10 CECE CC(=O)C(=O)COC(=O)CC(C)(C)c1ccc(F)cc1 869860709 JNAVKOMHCUFXCE-UHFFFAOYSA-N 280.295 2.195 10 10 CECE C[C@@H](NC(=O)c1ncccc1N)c1ccc(N(C)C)cc1 867504482 WQHPGHRLDXIHMQ-LLVKDONJSA-N 284.363 2.221 10 10 CECE COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](C)[C@@H](F)C2)c1O 775058643 VUYPUEZRLUGKGT-KOLCDFICSA-N 298.314 2.489 10 10 CECE CCN(CC(C)(C)CN)C(=O)Nc1ccc(N)cc1 1876153282 QSYILGXONHOABS-UHFFFAOYSA-N 264.373 2.108 10 10 CECE Cc1cc(=NC(=O)Nc2ccc(N)cc2)c(C)c[nH]1 1876174085 IFWOQQTVIANLPH-UHFFFAOYSA-N 256.309 2.347 10 10 CECE OCC[C@@H]1CCC[C@H]1NCc1ccc(F)c(F)c1O 877442574 OPFZBAZCPQSCQG-JOYOIKCWSA-N 271.307 2.311 10 10 CECE NC(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1Cl 1136816007 MQJIVJHOGCVDSD-UHFFFAOYSA-N 296.735 2.458 10 10 CECE CC(C)[C@@H](C(=N)NO)N(C)[C@H](C)c1ccccc1O 1877539684 YFPXBSRTYPJQEI-MFKMUULPSA-N 265.357 2.366 10 10 CECE Cc1ccnnc1CNCc1ccc(F)c(F)c1O 1877785473 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CCN1C[C@H](C(C)C)Oc2ccc(N3CCNCC3)cc21 77017022 QOKFKQIJLSCOGR-QGZVFWFLSA-N 289.423 2.340 10 10 CECE CCCCCNC(=O)[C@@H](N)c1cccc(C)c1O 83383163 LZJLSGSHFLZGKR-LBPRGKRZSA-N 250.342 2.007 10 10 CECE C[C@H]1CCN(Cc2ccc(Cl)cc2O)[C@H]1C(=O)O 1963117529 XAIFKMYTCTZUEQ-QPUJVOFHSA-N 269.728 2.341 10 10 CECE COc1ccc2c(c1O)[C@@H](c1cccc(C)n1)NCC2 83708420 DUUVDOTUUSYVLV-OAHLLOKOSA-N 270.332 2.339 10 10 CECE Oc1c(CNCC2(O)CCCC2)ccc(F)c1F 703277490 WKKYPKWSZJLJRN-UHFFFAOYSA-N 257.280 2.065 10 10 CECE [N-]=[N+]=NCCNC1(C(N)=O)CCC(C2CCC2)CC1 829189089 YFLQMVRXEOYJIO-UHFFFAOYSA-N 265.361 2.101 10 10 CECE Cc1cc(O[C@@H]2CCCO2)ccc1N1CCCNCC1 686716146 INMKGQXSYGJTRR-MRXNPFEDSA-N 276.380 2.310 10 10 CECE C[C@H](c1ccccc1O)N1C[C@H](C)[C@](C)(C(=O)O)C1 710264911 FOFDHODNLHKUCG-FIXISWKDSA-N 263.337 2.496 10 10 CECE CO[C@@H]1CC[C@H](C)N(C(=O)CCc2ccc(N)cc2)C1 687213393 IPRJWAZRNKLQRA-SWLSCSKDSA-N 276.380 2.227 10 10 CECE CC(C)(C)N1CCN(c2c(F)cc(CN)cc2F)CC1 62712230 PFIJMYAMSKZORD-UHFFFAOYSA-N 283.366 2.344 10 10 CECE 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10 10 CECE CC1(C)[C@H]2CNC[C@@H]2CN1Cc1cc(Cl)ccc1O 90334534 IKXIQOKLDPJHKC-YPMHNXCESA-N 280.799 2.475 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CCC23COC3)c1O 2115272468 UZZPIDCLJQPURR-UHFFFAOYSA-N 281.739 2.223 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cc(F)c(F)cc2N)c1 1453646935 DALWVYJXHVVLLL-UHFFFAOYSA-N 292.285 2.491 10 10 CECE CN1CCCc2c1ccc1c2C[C@H](CC(=O)O)CO1 211902682 LHXGBIRPCREAKW-SNVBAGLBSA-N 261.321 2.095 10 10 CECE CCN(CC)c1ccc(CNCC(=O)O)cc1OC(C)C 212134497 KDVLCRBELWADLC-UHFFFAOYSA-N 294.395 2.494 10 10 CECE Cc1ncc(/C=C/C(=O)N(C)c2nccnc2C)s1 1533984927 BEVMKMBGBTUEFW-SNAWJCMRSA-N 274.349 2.226 10 10 CECE C[C@@H]1CC(=O)N(c2c(Cl)cc(N)cc2Cl)C1=O 1905551509 POIXVRUYHDJCGA-RXMQYKEDSA-N 273.119 2.475 10 10 CECE CN1CCc2cc([C@H](O)[C@@](C)(N)CC(F)F)ccc21 2118479150 SWFZRBAOQLWURU-KBPBESRZSA-N 270.323 2.085 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@@H]1CCO[C@@H]1C 2121149819 ASALTQBVFVAEBN-ZOWXZIJZSA-N 260.381 2.494 10 10 CECE CC[C@@]1(O)CCCN(c2ccc(OC)c(OC)c2)C1 1542991953 DIXPUDKXWKNFNV-OAHLLOKOSA-N 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10 10 CECE Nc1ccc(CCN2CCc3ncsc3CC2)cc1 2271643336 ZDMMDGNYHDBGQJ-UHFFFAOYSA-N 273.405 2.369 10 10 CECE CN[C@H]1CCc2cc(N3CC(CCCO)C3)ccc21 2230506801 DCNWRHLTULIQBH-INIZCTEOSA-N 260.381 2.102 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC[C@H](O)C2)cc1C 2231458550 IWKVQMNNZXZQHY-CJNGLKHVSA-N 262.397 2.454 10 10 CECE CNc1snnc1COc1ccc(N(C)C)cc1 2221876150 MILFPLKZUPGZKJ-UHFFFAOYSA-N 264.354 2.225 10 10 CECE CCN1C[C@@H]2C[C@H]1CN2c1ccc([C@H](C)O)cc1C 2232100416 LYOHYWCAMULJIV-QEJZJMRPSA-N 260.381 2.331 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2OC[C@H]3CCCC[C@@H]32)cc1 2233179863 ZDRXCAKUYOXTSE-VHDGCEQUSA-N 274.364 2.090 10 10 CECE C[C@@H](Nc1cccn(C)c1=O)c1ccc(F)cc1O 2224794864 SQERKTMDVKAVKF-SECBINFHSA-N 262.284 2.403 10 10 CECE OC[C@@H]1[C@H]2C[C@@H]2CN1c1ccc(OCC(F)(F)F)cc1 2235089259 VZPPTVPRWKFLGI-JIMOISOXSA-N 287.281 2.445 10 10 CECE O[C@@H]1C[C@@H]2OCCN(c3ccc4c(c3)CCCC4)[C@@H]2C1 2235095108 WLYJFOWULFFLFG-BBWFWOEESA-N 273.376 2.294 10 10 CECE CC(C)Oc1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)cc1 2235107914 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C[C@H]1Cc2cc(N3CC[C@@H](O)C4(CC4)C3)ccc2O1 2226699165 FNHJQQGHELCCEZ-XHDPSFHLSA-N 259.349 2.361 10 10 CECE O[C@H]1CN(c2ccc(OCC(F)F)cc2)CC12CC2 2226739884 JZFKWAGMPQDBFV-LBPRGKRZSA-N 269.291 2.292 10 10 CECE OC[C@H]1CCCCN1c1ccc2c(c1)OC(F)(F)O2 2226700564 RJGDFUIPWQSBSM-SNVBAGLBSA-N 271.263 2.359 10 10 CECE O[C@@H]1CCCN(c2ccc3c(c2)OCCCO3)CC1 2226815360 TUZDKQHEIHOIEC-CYBMUJFWSA-N 263.337 2.199 10 10 CECE CCN[C@](C)(CO)CCCOc1ccc(N(C)C)cc1 2237693343 GJQCOXZPHPOPDU-INIZCTEOSA-N 280.412 2.272 10 10 CECE CNCc1ccc(COc2ccc(N(C)C)cc2)nc1 2237697028 BOGISXCDWPGXNW-UHFFFAOYSA-N 271.364 2.446 10 10 CECE COc1ccc(N(C)[C@@H]2C3C[C@@H]4C2[C@@H]4C3)c(CN)c1 2227676810 WHQFNWADWIZWSC-VGRPQNDASA-N 258.365 2.245 10 10 CECE COc1ccc(N2C[C@H](C)OCC[C@H]2C)c(CN)c1 2227673102 MVULJDOKOJHLEL-NEPJUHHUSA-N 264.369 2.158 10 10 CECE CCOC[C@H]1CCN(c2ccc(OC)cc2C=O)C1 2227695589 JAWLNPRZCIAERS-LBPRGKRZSA-N 263.337 2.371 10 10 CECE COc1ccc(N2CCO[C@@H](C(C)C)C2)c(CO)c1 2227709152 QOOCEPCNFIPVFM-OAHLLOKOSA-N 265.353 2.049 10 10 CECE C[C@H](NCC12COCC(C1)C2)c1ccc(O)cc1O 2228116679 TYTGSPVAYJSAHT-NLTNOIMHSA-N 263.337 2.175 10 10 CECE O[C@@H]1CC[C@H]2CC[C@H]1N2c1ccc(CNC2CC2)cc1 2238214822 JPBZSALRKCDJOL-BRWVUGGUSA-N 272.392 2.431 10 10 CECE OC[C@]1(F)CCN(c2ccc(CNC3CCC3)cc2)C1 2240008611 ZBJRFBUNHGEWOP-INIZCTEOSA-N 278.371 2.239 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)C[C@@]1(C)COCCO1 2240741372 AXAOGPAMWQXUPA-CJNGLKHVSA-N 278.396 2.256 10 10 CECE CSc1ncc(CNCc2ccc(CO)o2)s1 2248709934 CVHMNEPMDXLRMW-UHFFFAOYSA-N 270.379 2.240 10 10 CECE CNCC[C@@H](C)N(C)c1cc(OC)c(OC)cc1OC 2289367673 QZTJOBJJYXELOX-LLVKDONJSA-N 282.384 2.147 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1c(F)cc([C@@H](C)N)cc1F 2273223572 BDVNILUDJHWYOD-BZHVJNSISA-N 270.323 2.334 10 10 CECE O=C(O)[C@@H]1CCN(Cc2ccccc2O)[C@H]1C1CC1 2264692001 VQALNLIWZVGPPG-OCCSQVGLSA-N 261.321 2.077 10 10 CECE Cc1cc(N2CCN(C)C[C@@H](C)C2)ccc1[C@@H](C)N 2269662815 UHNHDQJLLBOAKS-TZMCWYRMSA-N 261.413 2.403 10 10 CECE Cc1cc(N2CC(O)(C(F)(F)F)C2)ccc1[C@@H](C)O 2269672093 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COc1cc(Cl)c(N2CCC[C@H]2CN)c(OC)c1 2319558919 DSZLLQRORQEJRJ-VIFPVBQESA-N 270.760 2.285 10 10 CECE COC(=O)[C@](CC1CC1)(NCCN=[N+]=[N-])C1CC1 2320783762 JMXOKCQCCISUTE-GFCCVEGCSA-N 252.318 2.008 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@]3(C)O)c1O 2330900490 FBXZBOGSAPTGRW-RZLSGREXSA-N 261.365 2.340 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2O)c1ccc(F)cc1O 2330916317 OSIBNDCURZIUEJ-YHMRHEDISA-N 265.328 2.341 10 10 CECE OC[C@]12C[C@H]1CC[C@@H]2N[C@@H]1CCc2cccc(O)c21 2331790961 XGZKNBCGSYGLNM-UNIGVISCSA-N 259.349 2.130 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H]4C[C@H](N)C[C@@H]3C4)ccc2O1 2332110638 DWNNZYAVNUWLHV-MPXAEWJHSA-N 258.365 2.326 10 10 CECE CC1(C)[C@@H](O)[C@H]2CCN(c3ccc(CN)cc3Cl)[C@H]21 2333286606 AFIHDEAOVPEBPA-GDLCADMTSA-N 280.799 2.394 10 10 CECE CC[C@H]1[C@H](O)CCN1c1ccc(CN)c(C2CC2)c1 2339166108 NYJLHTQDXGLPDZ-JKSUJKDBSA-N 260.381 2.372 10 10 CECE COc1cc(Cl)c(N2C[C@@H]3C[C@H]3[C@H]2CN)c(OC)c1 2342435924 FURDIQIOCNKVJQ-MKPLZMMCSA-N 282.771 2.141 10 10 CECE 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279.303 2.102 10 10 CECE CCOc1ccc(NC(=O)c2cc(O)nc(O)c2)cc1 170223183 WOXRYCXEKJKRBC-UHFFFAOYSA-N 274.276 2.144 10 10 CECE CSCCCN(C)C(=O)Cc1ccc(N)cc1 306048382 YVFGNPURGDCFJA-UHFFFAOYSA-N 252.383 2.023 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)NCCN(C)C)c1 22144711 UMDCWYJDRDFEQL-LBPRGKRZSA-N 293.411 2.343 10 10 CECE COCCNCc1ccc(N(C)Cc2cccnc2)cc1 62735937 RUHDZWCNJPWDOA-UHFFFAOYSA-N 285.391 2.454 10 10 CECE Cc1ccc(O)c(CN2CCC[C@H](Cn3cncn3)C2)c1 128504636 PABJSIYVFNWGDR-AWEZNQCLSA-N 286.379 2.204 10 10 CECE CCO[C@H]1C[C@@](O)(CNCc2ccccc2O)C1(C)C 188913446 RWJDVONKODWYEB-GOEBONIOSA-N 279.380 2.048 10 10 CECE NCc1ccc(N2CCCC[C@H]2CCO)cc1F 135220275 PARAEWCNGORREJ-LBPRGKRZSA-N 252.333 2.026 10 10 CECE COc1c(N)cccc1C(=O)N(C)Cc1ccccc1O 137325172 FJRDVKPGAOFXLG-UHFFFAOYSA-N 286.331 2.255 10 10 CECE COc1ccc(CN(CCO)c2ccccc2)c(O)c1 191970106 VXDDYBBFGBFZKU-UHFFFAOYSA-N 273.332 2.400 10 10 CECE Cn1nccc1CNCc1cc(Br)ccc1O 227437146 SHMAOKKEPXDETA-UHFFFAOYSA-N 296.168 2.178 10 10 CECE C[C@H]1CC[C@H](C)N(S(=O)(=O)Cc2ccc(N)cc2)C1 88702625 IWXQJRDJEGZOQH-RYUDHWBXSA-N 282.409 2.219 10 10 CECE CCCNCc1ccc(N2CCC(NC(C)=O)CC2)cc1 228303794 SBPUIPSTWXWROJ-UHFFFAOYSA-N 289.423 2.291 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1ccccc1F 90259278 XIZHTLPHLCSFTN-LLVKDONJSA-N 266.276 2.330 10 10 CECE Cc1ccc([C@H](NCCCN=[N+]=[N-])C(=O)O)s1 90258903 PATHJYHXWZFQSS-VIFPVBQESA-N 254.315 2.472 10 10 CECE COc1ccc(CNC[C@](C)(O)CC(C)C)c(O)c1 90267253 SCBUDRNIIXSQSO-OAHLLOKOSA-N 267.369 2.288 10 10 CECE CCN(CCn1ccnc1C)c1ccc(CN)cc1 49329624 OBARPLVPODPLAH-UHFFFAOYSA-N 258.369 2.177 10 10 CECE CCNCc1ccc(N2CC[C@@](C)(O)C2)c(Cl)c1 233539783 CHJPHOMYJOFLGC-CQSZACIVSA-N 268.788 2.411 10 10 CECE CN1C(=O)/C(=C\c2c[nH]c3ccccc23)C(=S)N(C)C1=O 98032906 IMAJBNIUMXKCIY-YRNVUSSQSA-N 299.355 2.403 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCCC12CC2 528864888 UFXMXWUMZBRHDF-NSHDSACASA-N 261.321 2.294 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H]2CO)cc1Cl 251440326 BBOSVDMSYRDHSJ-KOLCDFICSA-N 254.761 2.321 10 10 CECE 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CCN(CC)c1ccc([C@H]2NCCCC2=O)c(O)c1 1952529242 IZXWEEYQJIRHIG-OAHLLOKOSA-N 262.353 2.232 10 10 CECE CC[C@H]1CCCCN1c1ccc2c(c1)NC(=O)[C@H]2N 252421819 ZTGPGIIXRXYFEB-HZMBPMFUSA-N 259.353 2.407 10 10 CECE CC[C@@H](c1ccccc1O)N(C)C[C@H]1CCS(=O)(=O)C1 2148788165 SEHTYUOXBZUEBQ-OCCSQVGLSA-N 297.420 2.210 10 10 CECE CN[C@H](C)c1ccc(N2CCC(C)(O)CC2)cc1O 168540206 FASTUATVHGHIDQ-LLVKDONJSA-N 264.369 2.024 10 10 CECE C[C@@H](NCc1ccc(F)c(F)c1O)C12CC(CO1)C2 1973565710 DLKZBYQKMHFQRP-NQTXRORDSA-N 269.291 2.328 10 10 CECE CCCN(CCN(C)C)C(=O)Nc1ccc(N)cc1 41681713 JOJQJMYYLASIIG-UHFFFAOYSA-N 264.373 2.074 10 10 CECE Cc1nc(C(=O)[C@@H](O)c2ccc3c(c2)CCN3C)cs1 2147118947 TWRFYYRHVFBWOS-AWEZNQCLSA-N 288.372 2.360 10 10 CECE Cc1ccc(O)c(CN2C[C@@H]3CCCN3C[C@@H]2C)c1 156075026 QCMPRORBXMTPCZ-ZFWWWQNUSA-N 260.381 2.369 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H](C3CNC3)C2)cc1 2149006993 GQNOSOHRJXGQLE-OAHLLOKOSA-N 273.424 2.184 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H]3C[C@]32C(=O)O)cc1 2143930580 ZSNJRVIKDJXIRC-CZUORRHYSA-N 274.364 2.192 10 10 CECE Nc1ccc(O)c(CN(CCO)C2CCCCC2)c1 42483509 NPQXBYFLNLPMAY-UHFFFAOYSA-N 264.369 2.101 10 10 CECE CC[C@H](C)NC(=O)[C@H](C)N(CC)c1ccc(CN)cc1 34654514 VGHPNQOHKNRDAX-STQMWFEESA-N 277.412 2.275 10 10 CECE Cc1ccc2nc(NCc3ccc(N)cc3)nn2c1 159524952 WOLHLRJTUCOEEZ-UHFFFAOYSA-N 253.309 2.232 10 10 CECE CN(C)[C@@H]1CC[C@H]1NCc1ccc(Cl)cc1O 1996063918 VCJCQVVRYQRMAF-VXGBXAGGSA-N 254.761 2.228 10 10 CECE C[C@@H]1C[C@H](C(=O)N2CC[C@H](N=[N+]=[N-])C2)CCS1 1997334594 FAVGKOQUCMWAGO-BBBLOLIVSA-N 254.359 2.429 10 10 CECE CN(C)c1ccc(CN2CCC[C@H]3[C@H]2[C@@H]3C(=O)O)cc1 2151013460 IKCMRXFENATZGN-KFWWJZLASA-N 274.364 2.048 10 10 CECE Oc1cccc(Cl)c1CNC[C@H]1[C@H]2OCC[C@H]12 2007576421 IECZKPUHCVOUSO-KKFJDGPESA-N 253.729 2.170 10 10 CECE Cc1ccc(CN2CC(CCN)C2)c(O)c1Br 2307566512 HBZBNDOAISOXMO-UHFFFAOYSA-N 299.212 2.244 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C[C@@H]1CC[C@H]2C[C@H]21 2157909501 LSQTXEHREITXEF-WCFLWFBJSA-N 275.348 2.258 10 10 CECE CCOc1cccc(CN2CC[C@H](C)[C@@H](N)[C@@H]2C)c1O 2152054405 FJLUCBQNDUJMGL-SLEUVZQESA-N 278.396 2.349 10 10 CECE C[C@H](O)[C@H]1CCN1c1ccc([C@@H](C)N)cc1Br 2011144748 JDLMGYJDUNTSKB-VDDIYKPWSA-N 299.212 2.428 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1ccc(=N)[nH]c1 2152588476 NPZRPANUTIZWJX-JTQLQIEISA-N 271.320 2.033 10 10 CECE CN(CCOc1ccc(N)cc1)Cc1ccc(O)cc1 2152889195 ZRJMLYLLFLVCNA-UHFFFAOYSA-N 272.348 2.485 10 10 CECE CCNCc1ccc(N(C)Cc2cnn(C)c2)c(C)c1 50561486 JRQDXUFAIHAONS-UHFFFAOYSA-N 272.396 2.474 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCSC[C@@H](C(=O)O)C1 2153601492 BNMLIRMVGRAWTH-UWVGGRQHSA-N 299.367 2.342 10 10 CECE Cc1ccnc(SCC(=O)N(C)c2ccc(N)cc2)n1 51331172 AXWXAQMJCWNXBN-UHFFFAOYSA-N 288.376 2.122 10 10 CECE CN(CP(C)(C)=O)c1ccc(CN)c(F)c1F 2021440333 FUHCOZFKZYAPNT-UHFFFAOYSA-N 262.240 2.440 10 10 CECE C[C@@H](N)c1ccc(N2CCn3ncc(Cl)c3C2)cc1O 2154040290 JULNZHAMPAYTQJ-SECBINFHSA-N 292.770 2.282 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@H](F)C2)cc1Cl 2027971872 HQJICNIKLQALAV-OXHMUOHRSA-N 272.751 2.269 10 10 CECE CC(C)[C@H](O)CCN[C@H](C)c1ccc(O)cc1O 2029928302 RCJPBRUGMSGSLN-ZWNOBZJWSA-N 253.342 2.155 10 10 CECE CCNCc1ccc(OC[C@@H](O)COC(C)C)c(C)c1 2155013810 QZUMIKYHXYWVJO-HNNXBMFYSA-N 281.396 2.269 10 10 CECE Nc1ccc(CCCN2CCCC[C@H]2C2OCCO2)cc1 2032271205 FXSNUQPOIQNTEX-INIZCTEOSA-N 290.407 2.429 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](C2)C3(F)F)cc1 2034644521 RKBLQXVNQIECAJ-OLZOCXBDSA-N 252.308 2.497 10 10 CECE CNCc1ccc(N2CC[C@@]3(CCO3)C2)c(Cl)c1 2035805408 YYGJAGFUMRTECU-CQSZACIVSA-N 266.772 2.429 10 10 CECE CC(C)CN1CCN(c2c(F)cc(CN)cc2F)CC1 62719111 UGVUBYATNREPEU-UHFFFAOYSA-N 283.366 2.202 10 10 CECE CCOC(=O)[C@H](C)CN1CCC[C@H](N=[N+]=[N-])CC1 2038008024 UYLCJKBQZXCUBI-MNOVXSKESA-N 254.334 2.350 10 10 CECE CC(C)(CO)[C@H]1CCCN1c1c(F)cc(CN)cc1F 2155832502 ULHLTASYKSPAMN-CYBMUJFWSA-N 284.350 2.411 10 10 CECE C[C@@H](O)c1ccc(N2CC(=O)N3CCC[C@@H]3C2)c(Cl)c1 2158196123 OJSDALGEDFKTGN-ZYHUDNBSSA-N 294.782 2.204 10 10 CECE C[C@H]1C[C@H](O)CN(c2ccc(CN)cc2C(F)(F)F)C1 401775012 YMUCZHSLZUKARP-ONGXEEELSA-N 288.313 2.371 10 10 CECE CC(C)OC(=O)CN[C@H](C)c1cc(F)ccc1O 308755510 KPRRHEISCUVWFP-SECBINFHSA-N 255.289 2.134 10 10 CECE N[C@]1(C(=O)O)CCC[C@H](CSc2nccs2)C1 403869086 KSYYEMUEEXQFQS-GZMMTYOYSA-N 272.395 2.208 10 10 CECE C[C@@H](CC(F)F)NC(=O)CCc1ccc(N)cc1 311062632 IXHJEIIUOXEHJM-VIFPVBQESA-N 256.296 2.361 10 10 CECE CO[C@@H](COCCOc1ccc(N)cc1)C(C)C 311048938 HZAJNXFSSCIUEQ-AWEZNQCLSA-N 253.342 2.335 10 10 CECE CCNCc1cc(F)c(N2CC[C@@H](O)C2(C)C)c(F)c1 312867612 SWVSGAOOJQVRAO-CYBMUJFWSA-N 284.350 2.424 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)[C@@H]1CN2CCC1CC2 312965380 UOULOXPSAUIGAZ-WCQYABFASA-N 276.380 2.185 10 10 CECE C[C@@H](NCc1cc2c(cc1O)OCO2)c1cscn1 700444367 PYQIDVBHCGXGGA-MRVPVSSYSA-N 278.333 2.428 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)[C@H]1C[C@@H]2CC[C@H](C1)N2 2159677493 YXLYHUPAZBAINQ-RVMXOQNASA-N 276.380 2.374 10 10 CECE C[C@@H](Cc1cnn(C)c1)N[C@@H](C)c1cc(O)ccc1O 2159830274 UPTMVNJDUASAQJ-QWRGUYRKSA-N 275.352 2.113 10 10 CECE CCCN1CC[C@H](N(C)Cc2cccc(OC)c2O)C1 2160041596 VQSQBEZFZGRLDV-AWEZNQCLSA-N 278.396 2.317 10 10 CECE COc1ccc(N(C)Cc2ccc(C(=N)N)nc2)cc1 2160251180 LESQLBGQPCHSKQ-UHFFFAOYSA-N 270.336 2.011 10 10 CECE COc1cccc(O)c1CN(CCCC(=O)O)C(C)C 2160701668 VQSSZQFASFBWKS-UHFFFAOYSA-N 281.352 2.476 10 10 CECE CN(Cc1ccsc1)C(=O)CN(C)c1ccc(N)cc1 702092225 CTTIKLXEUJQQBM-UHFFFAOYSA-N 289.404 2.425 10 10 CECE CCOc1cc(O)c(O)cc1I 2054936883 UAAPWOJVTZENJQ-UHFFFAOYSA-N 280.061 2.101 10 10 CECE C[C@@]1(CO)CCCN(CCCOc2ccc(N)cc2)C1 688718215 BQWJFUFDPOLOFJ-MRXNPFEDSA-N 278.396 2.132 10 10 CECE CCOC[C@H]1CN([C@@H](C)c2cc(F)ccc2O)CCO1 705851644 FETCPUYPRORYCW-WCQYABFASA-N 283.343 2.330 10 10 CECE C[C@@H]1CC[C@H](N)CN1Cc1c(O)cccc1Br 706875319 URKSOKBZIFVRRI-ZJUUUORDSA-N 299.212 2.466 10 10 CECE CCCN(C)CCNCc1cccc(CC)c1O 688624173 AYPMXCDJCBQIIA-UHFFFAOYSA-N 250.386 2.386 10 10 CECE C[C@H](O)[C@H]1CCCCN1c1ccc(CN)c(F)c1 688677808 XYFIXDZQKLYFNJ-IINYFYTJSA-N 252.333 2.024 10 10 CECE C[C@@H]1CN(C)CCN(Cc2cc(F)cc(F)c2O)C1 708382088 DUQUOEOUELJJEH-SNVBAGLBSA-N 270.323 2.054 10 10 CECE COc1ncc(NCc2cc(F)cc(F)c2O)cn1 708501814 JTWVNQAXUKBDQC-UHFFFAOYSA-N 267.235 2.081 10 10 CECE O=C1NC(=S)SC1=Cc1csc([N+](=O)[O-])c1 2053606847 UFEYRFVXQZWZTN-UHFFFAOYSA-N 272.332 2.145 10 10 CECE Cc1cc(CN)ccc1N1CCC(C)(N(C)C)CC1 709798347 XLQPGPHVCPLXAI-UHFFFAOYSA-N 261.413 2.374 10 10 CECE CN1CCc2cc(CNC[C@@H]3C[C@H]4CC[C@H]3O4)ccc21 380169270 AXWQJUZSVFWJRC-ZMSDIMECSA-N 272.392 2.336 10 10 CECE CCN1CC[C@@H]1CN[C@@H](C)c1cc(F)ccc1O 712541339 DPKFGAYMTDJWEP-CMPLNLGQSA-N 252.333 2.276 10 10 CECE CCCN1CC(NCc2ccc3c(c2)CCCN3C)C1 380956563 BKZYEXLNRPZOPA-UHFFFAOYSA-N 273.424 2.253 10 10 CECE CCCNCc1ccc(N2CC[C@H]3C[C@]3(O)C2)cc1C 2171025711 IDAYSIFKKYCEGG-RDJZCZTQSA-N 274.408 2.456 10 10 CECE CS[C@H]1CCCN(C(=O)c2cccc(O)c2O)CC1 381728808 LRLWMSGELKPBNG-JTQLQIEISA-N 281.377 2.456 10 10 CECE COc1ccc(O)c(CNC[C@@H]2CCC[C@H](CO)C2)c1 383774360 JXPIPTXKGIZHGV-OLZOCXBDSA-N 279.380 2.289 10 10 CECE CO[C@H]1CCC[C@@H](Nc2c(N)cccc2C(N)=O)CC1 718328132 OQFIUNWIIQITON-MNOVXSKESA-N 277.368 2.127 10 10 CECE CO[C@H]1CCC[C@@H](NC(=O)c2cccc(O)c2O)CC1 718351631 CFXOPTPABVVWTQ-MNOVXSKESA-N 279.336 2.175 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)[C@H](O)C2)cc1Br 388242988 CWBPILWLOPMXAR-MWODSPESSA-N 299.212 2.286 10 10 CECE CC(C)(CO)CCCNCc1cc2c(cc1O)OCO2 393431011 QDPALELVCSWUMS-UHFFFAOYSA-N 281.352 2.009 10 10 CECE C[C@H](NCC1([S@@](C)=O)CCC1)c1cc(O)ccc1O 393696233 MBQFHXUSXRKEGA-APBUJDDRSA-N 283.393 2.050 10 10 CECE CCC1(CN[C@H](C)c2cc(O)ccc2O)COC1 393969256 XEOVYNBBBMYFRB-SNVBAGLBSA-N 251.326 2.175 10 10 CECE CCOc1cccc(CN[C@H]2CC[C@@H]2OC)c1O 724187383 JFSUGHFUSCBKDL-RYUDHWBXSA-N 251.326 2.058 10 10 CECE COc1ncc(NCc2cc(Cl)cc(OC)c2O)cn1 395155716 QFFRRVOIMIRZQP-UHFFFAOYSA-N 295.726 2.465 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1ccc(C)nn1 2163139020 UCCOCACBKZXXFG-MRXNPFEDSA-N 268.364 2.086 10 10 CECE CC[C@@H]1CN2CCC[C@H]2CN1c1ccc(CNC)cc1 2171525196 NRBGHCWFMDJAPD-WBVHZDCISA-N 273.424 2.469 10 10 CECE CN(C[C@@H]1CCOC1)c1ccc(CNC2CC2)cc1 398979767 JNJDDHKPNPZVNO-AWEZNQCLSA-N 260.381 2.411 10 10 CECE CN(C[C@H]1CCOC1)c1ccc(CN)cc1Br 399489186 UKOKHOMWWKNBLL-LLVKDONJSA-N 299.212 2.381 10 10 CECE C[C@H]1COCCCN1c1ccc(CN)c(Cl)c1 399420047 UNIWCYBRBYHRIA-JTQLQIEISA-N 254.761 2.414 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@@H](CCO)C2)c(Cl)c1 2172871495 MTYZGTVYCSTETM-AAEUAGOBSA-N 298.814 2.208 10 10 CECE CN(C[C@@H]1CC2(CC2)CO1)C(=O)Nc1ccc(N)cc1 2166401605 LFUDAICDHGWTIC-ZDUSSCGKSA-N 275.352 2.302 10 10 CECE COc1ccc([C@H](C)n2ncnc2Br)c(O)c1 2070027099 SYRWTTYHBKAQHA-ZETCQYMHSA-N 298.140 2.364 10 10 CECE CCc1cc(CNC)n(Cc2cc(C)ccc2O)n1 2070165527 SSUKKSMDMXHIEG-UHFFFAOYSA-N 259.353 2.227 10 10 CECE CSc1cnn([C@H](C)c2cc([N+](=O)[O-])ccc2O)c1N 2070218725 DMPBCDUYDNMTPZ-SSDOTTSWSA-N 294.336 2.410 10 10 CECE CN(CCOc1ccc(N)cc1)Cc1c(Cl)cnn1C 2168136477 BFMLHNNCVTZTNL-UHFFFAOYSA-N 294.786 2.167 10 10 CECE CCN1CCc2cc(N3C[C@@H]4CNCC[C@H]4C3)ccc21 2168790203 MOLKXLYOHGAPRN-GJZGRUSLSA-N 271.408 2.115 10 10 CECE O=C([C@@H]1CNc2ccccc2N1)N1CC[C@H]2CC[C@H]1C2 2168814038 MCPZGDGUCBNJGC-XUJVJEKNSA-N 271.364 2.294 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H](O)[C@H]3CCCS3)ccc21 2191435604 YKEZYWXZAJCZTE-PMPSAXMXSA-N 292.448 2.325 10 10 CECE Nc1ccc(CCCN2[C@H]3CC[C@@H](C3)[C@H]2C(=O)O)cc1 2179708782 SMEGERWSOLSIAS-QEJZJMRPSA-N 274.364 2.139 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H](C3CC3)[C@@H](O)C2)c(F)c1 2194513303 OJMYVAPQDJEYHP-UPLXVJCVSA-N 283.318 2.225 10 10 CECE CC(C)Oc1ccc(N2CC(C)(C)OC[C@H]2CN)cc1 2194659800 YATGKXPDNPLJAT-CQSZACIVSA-N 278.396 2.416 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CC3(CC(O)C3)C2)c(F)c1 2194700250 QBDAEOAEDBRRIW-VIFPVBQESA-N 282.334 2.206 10 10 CECE CP(C)(=O)[C@@H]1CCN(c2ccc(CO)cc2[N+](=O)[O-])C1 2181637415 GPYJZWWROPAZAG-LLVKDONJSA-N 298.279 2.289 10 10 CECE C[C@H](NC(=O)[C@H]1CCNC12CCC2)c1ccccc1O 2192623834 DCNXTTSXXRPGDU-WCQYABFASA-N 274.364 2.102 10 10 CECE C[C@H](O)c1ccc(N(C2CC2)C2COC2)c(F)c1 2043070054 NMBSLOJJVKEBJW-VIFPVBQESA-N 251.301 2.247 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CC3(CCCC3)O2)cc1 2189487339 WUOZBDWXTXSRKT-CQSZACIVSA-N 274.364 2.029 10 10 CECE N[C@H]1CN(c2ccc3c(c2)CCC3)C[C@H]1C(F)F 2044304202 GFVOQAYGJVFQOO-OLZOCXBDSA-N 252.308 2.204 10 10 CECE CN(C[C@H](O)c1cccs1)c1ccc(CN)cc1 2050543453 SLRNGZHTKUHYLA-ZDUSSCGKSA-N 262.378 2.377 10 10 CECE CN[C@@H]1CCCc2cc(N(C)CC3CC(O)C3)ccc21 2184692789 HORGJWIXRZGZKI-MWHAMWOXSA-N 274.408 2.491 10 10 CECE Oc1cccc(CN[C@@H]2[C@@H]3CCC(F)(F)[C@H]32)c1O 2051227602 CCJOMVWZMXRYCW-FBIMIBRVSA-N 255.264 2.231 10 10 CECE N[C@H]1CCc2cc(N3CCN(CCCF)CC3)ccc21 2184738040 OWGIKJNQMYOWJY-INIZCTEOSA-N 277.387 2.114 10 10 CECE Oc1ccc(F)cc1CN[C@H]1C[C@H](Cn2ccnc2)C1 2184776349 ANJIUCWYBBGITF-YEORSEQZSA-N 275.327 2.296 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2C[C@@H]2F)cc1 2055592658 QUFJHEYEWRNWRW-RDBSUJKOSA-N 251.349 2.395 10 10 CECE COC(=O)[C@@](C)(CCC(F)F)NCCCN=[N+]=[N-] 2057733150 YXPDBIVPCGPSCE-SNVBAGLBSA-N 264.276 2.253 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](CCO)C(F)F)cc1 2058237921 VEKSGAGCBLQXNR-BXKDBHETSA-N 259.296 2.192 10 10 CECE CCCCNC(=O)[C@@H](C)N1CCC[C@@H]1CN=[N+]=[N-] 2059054694 ZLUOCIYZXABSJX-GHMZBOCLSA-N 253.350 2.066 10 10 CECE CCN[C@H](c1ccccc1O)[C@]12COC[C@@H]1C2(F)F 2105604698 AWRCHKMJCZDFGK-XQQFMLRXSA-N 269.291 2.325 10 10 CECE NCc1ccc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)c(Cl)c1 2065484012 DMHDRJYLRLQCNS-ZSBIGDGJSA-N 266.772 2.006 10 10 CECE CN(c1ccc(CO)c([N+](=O)[O-])c1)[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2190883610 APUBGLNPWPTJSQ-OEOBOFROSA-N 274.320 2.178 10 10 CECE CCN(c1c(F)cc([C@H](C)O)cc1F)C1COC1 2074081858 LYFGNKCDMLZOJG-QMMMGPOBSA-N 257.280 2.243 10 10 CECE CCn1nnc(CN(C)c2ccc([C@@H](C)O)cc2Cl)n1 2197855307 YPOHRRPHXKUEEZ-SECBINFHSA-N 295.774 2.036 10 10 CECE CCCOc1cc(N2C[C@@H]3CCC[C@]3(N)C2)ccc1N 2198067397 NVIAKMHSZGVDSM-LRDDRELGSA-N 275.396 2.375 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@@H]3[C@@H]2CO)cc1C 2198998638 XNSBQXCJBZVKGX-XIRDDKMYSA-N 274.408 2.312 10 10 CECE CCOc1cccc(CNC[C@H]2CO[C@H](C)C2)c1O 2101845346 BCLNWXWHLZYDQS-NEPJUHHUSA-N 265.353 2.306 10 10 CECE COc1ccc(N2CC[C@@H](N)C[C@@H]2C)c(F)c1F 2081860449 FDUSRMGITLBBHK-DTWKUNHWSA-N 256.296 2.289 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ncoc2C2CC2)C1 2104139088 NQGJOUDZPSYCFV-VIFPVBQESA-N 261.285 2.467 10 10 CECE CN(Cc1ccc(F)cc1O)C(C)(C)CC(=O)O 2084073841 OMMIVRJXVXQSAN-UHFFFAOYSA-N 255.289 2.216 10 10 CECE COc1cccc(O)c1CN1CCCC[C@H]1[C@@H](C)N 2104440224 VXRITQRSPFVDFD-YPMHNXCESA-N 264.369 2.103 10 10 CECE CCOC(=O)C(C)(C)CN(C)c1ccc(CN)cc1 2104979431 MVBPXCCSYHBKGK-UHFFFAOYSA-N 264.369 2.171 10 10 CECE Cc1ccc(O)c(CN2C[C@H](C(=O)O)CC2(C)C)c1 2105848867 QIILSXWJJXFSNU-GFCCVEGCSA-N 263.337 2.386 10 10 CECE NCC[C@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)C1 2106393397 YUZJOAJMRJBEQT-VIFPVBQESA-N 270.279 2.183 10 10 CECE CN1CC[C@H]([C@H](O)c2ccc3c(c2)CCCN3C)C1 2106830540 HSMBSKOSWGHUHG-GOEBONIOSA-N 260.381 2.054 10 10 CECE COCC1(C[C@@H](NN)c2ccc(N(C)C)cc2)CC1 2106823019 LBELPOTZKQYJKI-CQSZACIVSA-N 263.385 2.074 10 10 CECE CCN(CC)c1ccc([C@@]2(O)CNCC[C@H]2C)cc1 2107376658 GZNUYCIPEBXCDS-CZUORRHYSA-N 262.397 2.350 10 10 CECE CC1CC(CO)(N(C)c2c(F)cc(CO)cc2F)C1 2108314177 CGWNMWSLTNETHX-UHFFFAOYSA-N 271.307 2.054 10 10 CECE CN1CCCCCN(c2ccc(CO)cc2)CCC1 2088709258 IIMJXWCZRXLRPD-UHFFFAOYSA-N 262.397 2.491 10 10 CECE Cc1nc[nH]c1CCN[C@H](C)c1c(O)cccc1O 2089615057 DWTIXRIMIRYNHO-SNVBAGLBSA-N 261.325 2.023 10 10 CECE CN[C@@H](Cc1c(C)nn(C)c1C)c1ccccc1O 2090036377 BTGXTCZQVMEDBA-AWEZNQCLSA-N 259.353 2.246 10 10 CECE CC12CC(CN1c1cc3c(cc1Cl)[C@@H](O)C(=O)N3)C2 2090762840 GOCMBHMYVOAJJE-BWQPLIALSA-N 278.739 2.314 10 10 CECE O=C(N[C@H]1[C@H]2CCCCC[C@H]21)c1cccc(O)c1O 2110965717 GFBGKXBORYMYDI-DDFAGTSDSA-N 261.321 2.406 10 10 CECE CC[C@@H](NCCc1ccc(O)c(O)c1)[C@@H]1CCOC1 2091749477 YIZVJFCPBUEWBA-CHWSQXEVSA-N 265.353 2.045 10 10 CECE CC(C)C[C@@H]1CCN1CC(=O)c1ccc(O)c(O)c1 2092467093 SDMJTYAVGKBAMG-LBPRGKRZSA-N 263.337 2.401 10 10 CECE Oc1ccc(Cl)cc1CN1CCC[C@H](C2CNC2)C1 2092577573 DUOOVSXKXUVHJB-NSHDSACASA-N 280.799 2.477 10 10 CECE CN[C@H](C)c1ccc(N(C)CCn2ccnc2)cc1 2093007460 BJBCGWVTXWHQIT-CYBMUJFWSA-N 258.369 2.300 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@@H](N)C2(CC2)C1 2095839154 IVOKKUFMZLPIMU-IUODEOHRSA-N 259.397 2.237 10 10 CECE CC[C@H](NC)c1ccc(N2CC(N3CCC3)C2)cc1 2095923649 FZPRCHYRMLKMFQ-INIZCTEOSA-N 259.397 2.251 10 10 CECE O=C(O)C[C@@H]1CC2(CC2)CN1Cc1ccccc1O 2096348081 PBNYHRDNONTBIH-GFCCVEGCSA-N 261.321 2.221 10 10 CECE NCc1ccc(N2CCOC3(CCCC3)C2)cc1F 2096405985 KDNFJWNQLMIWTE-UHFFFAOYSA-N 264.344 2.434 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@]1(C)CO 2097241144 JHEDVRLLMDCTKJ-MRXNPFEDSA-N 260.381 2.208 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)C1CC2(CC2)C1 2097538826 QTWZKAYAMFVREK-UHFFFAOYSA-N 280.393 2.368 10 10 CECE CO[C@@H]1COC[C@@H]1CN[C@H](C)c1cc(C)ccc1O 2097868591 UFDLIDNQTHTZSV-TYNCELHUSA-N 265.353 2.013 10 10 CECE Cc1cc(CN(C)c2ccc(CO)cc2C)n(C)n1 2099122962 OWOJLDSEESRHHU-UHFFFAOYSA-N 259.353 2.166 10 10 CECE C[C@H](N[C@H]1C[C@H](CN(C)C)C1)c1cc(O)ccc1O 2113150208 RMYBSOOLKPONNM-SRVKXCTJSA-N 264.369 2.089 10 10 CECE Cc1nscc1C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2213582324 GXENOGQULUYJPP-DTWKUNHWSA-N 251.315 2.413 10 10 CECE CNCc1ccc(N(C)[C@H](CO)C(C)(C)C)cc1OC 2204546030 WZBYWTMLDBMLBZ-OAHLLOKOSA-N 280.412 2.258 10 10 CECE CO[C@H]1CC(N(C)Cc2ccc(C)cc2O)C[C@@H]1OC 2204662655 LMIAPQCLTTVSGN-HOTGVXAUSA-N 279.380 2.325 10 10 CECE Cc1cccc(CNCc2ccc(O)c(O)c2O)c1O 2204625868 SZWFQLBWGPBIKB-UHFFFAOYSA-N 275.304 2.107 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CCC[C@H]2S(C)(=O)=O)c1 2205995447 KBTOZGREUAPPGT-CORIIIEPSA-N 297.420 2.317 10 10 CECE CSc1ncc(CNCCCc2cnn(C)c2)s1 2208474760 GBMSTMAKBYATSO-UHFFFAOYSA-N 282.438 2.321 10 10 CECE C[C@@H](NCc1ncccc1O)c1ccc(O)cc1O 2230925939 QDYJKPGIEANUBK-SECBINFHSA-N 260.293 2.049 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1C[C@@H](O)[C@@H]1C 2231450518 MLKODHNFAOVKMD-BLLLJJGKSA-N 260.381 2.207 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC(N(C)C2CC2)C1 2232010970 CZUNERWKPZCBFB-LBPRGKRZSA-N 259.397 2.298 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC(C[C@@H](C)CO)C1 2232097478 CHUMAPRETADFNB-DGCLKSJQSA-N 262.397 2.469 10 10 CECE Nc1ccc(CCN2C[C@@H](O)CC23CCCC3)cc1 2232258556 FOXBEQDTXDPYLU-HNNXBMFYSA-N 260.381 2.191 10 10 CECE CN(C)C[C@H]1C=CCN1c1ccc(CO)cc1Cl 2222821374 YLNZHTSOHBPBJR-GFCCVEGCSA-N 266.772 2.139 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@H]2CC[C@H](C(=O)O)C2)CC1 2234173603 YODMTRPKYCEDJI-QWRGUYRKSA-N 280.328 2.036 10 10 CECE CN(Cc1ccccc1O)c1nccn2ccnc12 2224555382 AGTIYKFSPHWCJS-UHFFFAOYSA-N 254.293 2.071 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1c(O)cccc1F 2225797518 FSJNNSBPUMZAJB-DTWKUNHWSA-N 264.260 2.493 10 10 CECE COc1ccc(N2CC[C@H](OC)[C@H](C)C2)c(C(=O)O)c1 2235957242 INGMEEFXALHELN-YGRLFVJLSA-N 279.336 2.255 10 10 CECE COc1ccc(F)c([C@@H](O)[C@@H](N)c2ccccc2O)c1 2235982718 ZSPNCMLNYCLUMT-LSDHHAIUSA-N 277.295 2.273 10 10 CECE C[C@H]1C[C@H]1CCN(C)c1cc2c(cc1N)OCC(=O)N2 2236515243 PQIINTSSXDMEIR-VHSXEESVSA-N 275.352 2.082 10 10 CECE C[C@@H]1C[C@H](O)CN(c2ccc3c(c2)CCCN3C)C1 2226658229 YZXDWQQVXSFEHJ-DOMZBBRYSA-N 260.381 2.276 10 10 CECE COc1ccc(N(CCO)CC(F)(F)F)cc1OC 2226797765 JGCBOIMSWYOURN-UHFFFAOYSA-N 279.258 2.065 10 10 CECE COc1ccc(N2CC3(C2)CC(C)(O)C3)c(OC)c1 2226802426 PAVBLIDRMKTHTB-UHFFFAOYSA-N 263.337 2.055 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCN3C)C[C@H]1CO 2226811263 YDKQMEUAZWWJJI-OCCSQVGLSA-N 260.381 2.134 10 10 CECE CNCc1cccc(COc2ccc(N(C)C)cc2)n1 2237698189 NQHUMDBGOIQGMU-UHFFFAOYSA-N 271.364 2.446 10 10 CECE COC[C@@H]1CC[C@H]1N(C)c1ccc(OC)cc1CO 2227682195 NNEXOVPAZYMUCP-SMDDNHRTSA-N 265.353 2.049 10 10 CECE COc1ccc(N(C)C2[C@@H]3CCC[C@@H]23)c(CCN)c1 2227685339 FDHVTFLTEIALKW-ZIAGYGMSSA-N 260.381 2.431 10 10 CECE COc1ccc(N2CC[C@@H](C(C)(C)O)C2)c(C=O)c1 2227705427 YXLVKXQDKRYGES-GFCCVEGCSA-N 263.337 2.105 10 10 CECE CCC=CCCOC[C@@H](O)COc1ccc(N)cc1 2228256105 NXUWBIOLEPYVJZ-CQSZACIVSA-N 265.353 2.381 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)[C@@H]1CC[C@H]2[C@H]1C2(F)F 2238690718 VXQYJZORNMUEJP-OUCADQQQSA-N 280.318 2.313 10 10 CECE CO[C@]12CC[C@@H]1CN(c1ccc(C=CC(=O)O)cc1)C2 2239071257 JDGRDSHGFMSYTL-CJNGLKHVSA-N 273.332 2.400 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1CC(N(C)C)C1 2240041434 AXKKAAYHWJEADT-UHFFFAOYSA-N 273.424 2.387 10 10 CECE CCN[C@H](C)c1ccc(N(CCO)CCOC)c(C)c1 2240746900 YGLRZIJMLLFYLY-CQSZACIVSA-N 280.412 2.111 10 10 CECE CNC(=O)[C@@H]1CCCN(c2ccc([C@@H](C)O)cc2C)C1 2240828084 ATKIWPZIVYTFPN-TZMCWYRMSA-N 276.380 2.011 10 10 CECE COC[C@H]1CCOCCN1c1ccc([C@@H](C)O)cc1C 2240835765 KRWJBDNDHSTTJQ-UKRRQHHQSA-N 279.380 2.290 10 10 CECE CC[C@@H](CC(=N)NO)N(C)c1ccc(OC)cc1 2253396479 JIGRJJRBWFKLDD-JTQLQIEISA-N 251.330 2.256 10 10 CECE CSc1ncc(CN=c2[nH]c(CO)c(C)s2)s1 2248616413 KUVKTIRQMUZQMO-UHFFFAOYSA-N 287.435 2.156 10 10 CECE Cc1cc(O)c([C@H](C)N2CC[C@H](C(N)=O)C2)cc1Cl 2270962712 AWPRMVNEQLVWJD-UWVGGRQHSA-N 282.771 2.222 10 10 CECE Oc1cc(Cl)ccc1CNCCN1CC[C@H]2C[C@H]21 2261451653 VIKABBPCXOQUQY-GXFFZTMASA-N 266.772 2.229 10 10 CECE CCCN[C@H](CCNC)c1ccc2c(c1)CCN2C 2271953954 QKOXBCYNCDEPAE-OAHLLOKOSA-N 261.413 2.329 10 10 CECE CN[C@H]1CCCc2cc(N3CC[C@H](O)[C@@H]3C)ccc21 2273272262 TXUWNZFADXVKSO-UVBJJODRSA-N 260.381 2.243 10 10 CECE Cc1cc(N2[C@H]3CC[C@H]2CN(C)C3)ccc1[C@H](C)O 2269679742 SZPYSIWMSQHYLS-QEJZJMRPSA-N 260.381 2.331 10 10 CECE CNC(=O)[C@H]1CCCCN1c1ccc([C@H](C)N)c(C)c1 2285130117 QHIOPGVNZPRFIA-SWLSCSKDSA-N 275.396 2.120 10 10 CECE CCCN(c1ccc([C@@H](C)N)c(C)c1)[C@H]1CCNC1=O 2285126875 HQDVNQBTPDYCQO-DOMZBBRYSA-N 275.396 2.120 10 10 CECE Cc1cc(N2C[C@H](C(N)=O)CC[C@H]2C)ccc1[C@H](C)N 2285135126 SQEAIOGFCJWGGS-FRRDWIJNSA-N 275.396 2.105 10 10 CECE Cc1cc(N2C[C@H](C)S(=O)(=O)[C@H](C)C2)ccc1[C@@H](C)N 2285134953 FJRNLLUCXAJDTA-FRRDWIJNSA-N 296.436 2.027 10 10 CECE C[C@@H](CNCc1ccc(F)cc1O)Cc1cnn(C)c1 2295454659 YIIWSQHJUBZEFL-LLVKDONJSA-N 277.343 2.233 10 10 CECE COc1ccc(N2CC(F)(F)C[C@H]2CN)c(OC)c1C 2296499756 JUCCLLYIXJFHJA-JTQLQIEISA-N 286.322 2.185 10 10 CECE CON(CCCC(=O)Nc1ccc(N)cc1)CC1CC1 2288901924 URQPMIQTOOJYGD-UHFFFAOYSA-N 277.368 2.261 10 10 CECE NC[C@@H]1CCCC[C@]1(Sc1nccs1)C(=O)O 2307032472 BVBDFCLQUPDEJH-GZMMTYOYSA-N 272.395 2.208 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2CC[C@H]1[C@H]2N 2310483986 JFPCSYPMANYHDN-YYESSMSJSA-N 250.317 2.014 10 10 CECE 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2184692566 DNJZZDAMRCJJQA-SUMWQHHRSA-N 273.424 2.411 10 10 CECE N[C@@H]1CCCc2cc(N3C[C@H](O)C4(CCC4)C3)ccc21 2184689812 TYCLEXVAZXJUDY-CVEARBPZSA-N 272.392 2.374 10 10 CECE CN[C@@H]1CCCc2cc(N(C)[C@@H]3CCN(C)C3)ccc21 2184693885 XPFSYIMUBDMHHN-NVXWUHKLSA-N 273.424 2.424 10 10 CECE O[C@H]1CCc2cc(N3C[C@H]4CC[C@@H](O)C[C@H]4C3)ccc21 2184734447 SWIUIGVTCSDLNF-CXUGXGMPSA-N 273.376 2.263 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](O)C[C@H](C)C3)ccc21 2184711312 QADGPVWQKYTZCM-YLQAJVPDSA-N 274.408 2.491 10 10 CECE N[C@@H]1CCc2cc(N3CC4(CCC(O)CC4)C3)ccc21 2184726120 MZAZGPRLSKZERE-MRXNPFEDSA-N 272.392 2.374 10 10 CECE CCN1CCN(c2ccc3c(c2)CC[C@@H]3NC)C[C@H]1C 2184721060 HZALCFOQAKNQMX-DYVFJYSZSA-N 273.424 2.424 10 10 CECE CSC[C@@H](N)[C@H](O)c1ccc(N2CCCC2)cc1 2044730879 RRLUPLPGLTWBJZ-ZIAGYGMSSA-N 266.410 2.011 10 10 CECE C[C@H]1CNCCC[C@@]1(O)c1ccc(N2CCCC2)cc1 2190712283 LCJPNJXXQFWBCR-YOEHRIQHSA-N 274.408 2.494 10 10 CECE Cc1ccc(O)c([C@H](C)NCC[C@@H]2CCN(C)C2=O)c1 2194699049 DAFUVRHCFBHEPY-QWHCGFSZSA-N 276.380 2.220 10 10 CECE CCCCOC[C@H](NN)c1ccc(N(C)C)cc1 2054564589 NBVAMJJRFGULBB-AWEZNQCLSA-N 251.374 2.074 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2CCC[C@H]2F)cc1 2055355791 ZJHRCMGQELMSKN-OLZOCXBDSA-N 250.317 2.208 10 10 CECE CCN[C@]1(C(=O)O)CC[C@H](Sc2nccs2)[C@@H]1C 2058690786 JPYZTLACCULDKG-HOTUBEGUSA-N 286.422 2.467 10 10 CECE CCN(CC)C(=O)[C@H](C)N1CCC[C@H]1CN=[N+]=[N-] 2059057438 FVCIVYRZHRZFNM-QWRGUYRKSA-N 253.350 2.018 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@@]2(OC)CCOC2)cc1 2186275548 GJCBGHRTOFIVPK-BBRMVZONSA-N 278.396 2.209 10 10 CECE CCCN(C[C@H]1CCCNC1)c1ccc(OC)cc1N 2191582566 ICBBKVWOUPVFDS-ZDUSSCGKSA-N 277.412 2.493 10 10 CECE CCC[C@H](N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21)C(N)=O 2186501744 RMANFJIJDUPSGJ-GRYCIOLGSA-N 276.380 2.493 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])C1CC2(CC2)C1 2064637064 CCYPYZUGULVRJT-NSHDSACASA-N 252.318 2.008 10 10 CECE Oc1c(F)cccc1CN1CC[C@@H]2CCO[C@@H]2C1 2065204577 WZZDRTJJPARYMM-ZWNOBZJWSA-N 251.301 2.142 10 10 CECE CC(=O)N1C[C@@H]2C[C@H]1CN2[C@H](C)c1cc(Cl)ccc1O 2192239571 QYNKWJRAADVCDY-ICCXJUOJSA-N 294.782 2.412 10 10 CECE CO[C@@]1(C)CN(c2ccc(CO)cc2)CC[C@@]1(C)OC 2199613088 ONGJVFMVJGOOSD-CVEARBPZSA-N 279.380 2.199 10 10 CECE CC(C)(C)C[C@@H](CO)CNCc1ccc(O)cc1O 2100101566 HUMHTVDEZLTVJG-LLVKDONJSA-N 267.369 2.232 10 10 CECE C[C@H](c1ccccc1O)N1CCC[C@]12CC[S@](=O)C2 2102291592 OFVCOHKNUMVFOV-PEELUZDISA-N 279.405 2.440 10 10 CECE Cc1cccc(O)c1CN[C@H](C)Cc1nccn1C 2104510777 MKSQHQIATVMUFC-GFCCVEGCSA-N 259.353 2.155 10 10 CECE CNCCCCN(C)c1ccc2c(c1)OC(F)(F)O2 2106379027 ZOCWKDYKOXNGJU-UHFFFAOYSA-N 272.295 2.444 10 10 CECE CCN[C@H](CN1CCCC1)c1ccc(N(C)C)cc1 2106793957 RYFOJTFJFZYEIA-MRXNPFEDSA-N 261.413 2.499 10 10 CECE CN1CCc2cc([C@@](C)(O)C3CCOCC3)ccc21 2106795638 IWWNSJJNCWLIQI-INIZCTEOSA-N 261.365 2.313 10 10 CECE CN1CCCc2cc([C@H](O)CNC(C)(C)C)ccc21 2106833763 NNBYAYFQMFINAU-OAHLLOKOSA-N 262.397 2.491 10 10 CECE CCN1CCc2cc([C@H](N)[C@H](O)C3CCC3)ccc21 2106858317 VHZBNDSVYDSCCX-JKSUJKDBSA-N 260.381 2.230 10 10 CECE CCOCCN(C)c1ccc(OCCN(C)C)cc1 2087061804 HUGADBSJADZLJE-UHFFFAOYSA-N 266.385 2.100 10 10 CECE C[C@@H](CN(C)C(=O)COc1ccc(N)cc1)C1CC1 2108185285 JPNHDGPLTBKVCN-NSHDSACASA-N 262.353 2.152 10 10 CECE CN1CCCc2cc([C@@H](O)CC[C@H]3CCN3)ccc21 2109409869 FYXZJEVEWAMVKU-HOCLYGCPSA-N 260.381 2.245 10 10 CECE NCc1ccc(N2C[C@@]34CC[C@]3(COC4)C2)cc1Cl 2090379205 JLFORHHEMWDHJV-HUUCEWRRSA-N 278.783 2.416 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@@H](O)C1CCCC1 2111352130 XIEWRGOKFIWKOO-MRXNPFEDSA-N 263.381 2.475 10 10 CECE COC1(CN(C)C(=O)Nc2ccc(N)cc2)CCC1 2111582545 DNELBAOVEBPREZ-UHFFFAOYSA-N 263.341 2.302 10 10 CECE CC[C@]1([C@@H](O)[C@@H](N)c2ccccc2O)CCCCO1 2091859572 PAZHZCAJVZXJON-SOUVJXGZSA-N 265.353 2.102 10 10 CECE C[C@H]1c2c(cnn2C)CN1c1ccc(CO)cc1F 2112199415 HXZORRZQNFEVCU-VIFPVBQESA-N 261.300 2.133 10 10 CECE CCN(C)CCN1CCc2cc([C@H](C)NC)ccc21 2092384987 SCFILGLGQAGFLX-ZDUSSCGKSA-N 261.413 2.281 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC[C@@H](C3CNC3)C2)c1 2093483225 PDBCDEUSCKKMIX-QWHCGFSZSA-N 260.381 2.303 10 10 CECE C[C@H](NC[C@@H]1[C@@H]2CCOC[C@H]21)c1cc(F)ccc1O 2093642146 KADYGUNTXMSEJW-BNQQVVLKSA-N 265.328 2.464 10 10 CECE O=C(N[C@@H]1CCC[C@H]1C1CC1)c1ccc(O)c(O)c1 2093674819 SVYNFPLVXFLHHP-NWDGAFQWSA-N 261.321 2.406 10 10 CECE Nc1ccc(N2C(=O)CC(C(F)F)CC2=O)cc1Cl 2094491261 LKRUUHOAAWCFRR-UHFFFAOYSA-N 288.681 2.457 10 10 CECE C[C@H]1CCN(C(=O)CCc2ccc(N)cc2)C[C@H]1F 2095933746 LBVLBKOOSNAJHA-SMDDNHRTSA-N 264.344 2.408 10 10 CECE COCCC1CN(c2ccc(C=CC(=O)O)cc2)C1 2095927038 HBHJDLKFQJGLBI-UHFFFAOYSA-N 261.321 2.257 10 10 CECE C[C@@H]1[C@H](CNCc2cc3c(cc2O)OCO3)C1(F)F 2097237431 OWZJISPRNKCSBL-APPZFPTMSA-N 271.263 2.112 10 10 CECE CN1CCc2cc([C@@H](N)CC[C@H]3CCOC3)ccc21 2098413382 ZFZNTXZYORGOFC-WFASDCNBSA-N 260.381 2.495 10 10 CECE C[C@H](O)C[C@@H](C)N1CCOc2cc(N(C)C)ccc21 2098645326 BKMHHGTXSMJSOR-NEPJUHHUSA-N 264.369 2.111 10 10 CECE Cc1ccc(CN[C@@H]2CCN(C3CCC3)C2)c(O)c1 2113252711 IARJKGMCPOWTAP-CQSZACIVSA-N 260.381 2.417 10 10 CECE Nc1ccc(CCN2CC3(CO)CCC2CC3)cc1 2122351097 PXKFYNIKXCGPCV-UHFFFAOYSA-N 260.381 2.048 10 10 CECE CN(C)c1ccc(CNC(=O)[C@](C)(N)C(C)(C)C)cc1 2204141348 AQGDKOKVOLXPJM-INIZCTEOSA-N 277.412 2.132 10 10 CECE COc1cc(N2[C@H]3CCC[C@H]2CC(O)C3)ccc1CN 2204558049 XKLVIGWTQRLQRO-STQMWFEESA-N 276.380 2.036 10 10 CECE COc1ccc(CNC[C@H]2CCC3(CC3)CO2)c(O)c1 2205211100 HWOYIFWPUKAOAK-CQSZACIVSA-N 277.364 2.450 10 10 CECE CN(C)c1ccc([C@@]2(O)C[C@H]3CC[C@H]2C[C@H]3N)cc1 2269482326 MXLKFDOGWSILAV-JMGFVUJMSA-N 260.381 2.088 10 10 CECE CCCOc1ccc(N2CC[C@H](O)[C@H](F)C2)cc1 2219594026 BFVILNPLIPLSDN-KGLIPLIRSA-N 253.317 2.385 10 10 CECE COc1ccc(N2CC[C@H](O)C[C@H]2C)cc1OC 2219641555 UDYHCGCBNOFVEH-PWSUYJOCSA-N 251.326 2.053 10 10 CECE CN(C)CCN(C)c1ccc(CNC2CCC2)cc1 2231457110 RJNVTCFNRMXXTD-UHFFFAOYSA-N 261.413 2.327 10 10 CECE CC(C)[C@@H]1COCCN1CCOc1ccc(N)cc1 2231593621 KEMLBXIXDBMWQX-HNNXBMFYSA-N 264.369 2.004 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[C@H]1c1ncon1 2232098502 OPHCGFYSSJQDIX-GWCFXTLKSA-N 259.309 2.383 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@H](C)[C@@](C)(CO)C1 2232011874 IVWOWIANAAKTJZ-HEHGZKQESA-N 262.397 2.469 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@]2(C)C[C@]2(CO)C1 2232105264 SWYWRMPAYGCEIT-UHOFOFEASA-N 261.365 2.257 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@]1(F)CCOC1 2222405203 YSXXWDZLGJJFDV-CQSZACIVSA-N 252.333 2.219 10 10 CECE COc1ccc(O)c([C@@H](C)N2C[C@@H]3C[C@H](C[C@@H]3N)C2)c1 2234889582 UTMKOHOAIDYYLV-FJJYHAOUSA-N 276.380 2.131 10 10 CECE CN(c1ccc2c(c1)OCCCO2)[C@@H](CO)CC1CC1 2235119731 KJKMGSSWYZMYDB-CQSZACIVSA-N 277.364 2.445 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@]2(CCOC2)C1 2235953499 BJLJIIJSJSNLKX-INIZCTEOSA-N 276.380 2.031 10 10 CECE CCN(C[C@H](C)O)c1ccc(OC)cc1CNC(C)C 2235974572 YHMDYFUFMYTJCZ-ZDUSSCGKSA-N 280.412 2.400 10 10 CECE CNCc1cc(OC)ccc1N1CCC[C@](C)(CO)C1 2235963487 QZUVMANUOLSLFH-INIZCTEOSA-N 278.396 2.013 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H](C)O[C@H]2C)c(CN)c1 2235961287 YGLUIUSNFDQXNC-DYEKYZERSA-N 278.396 2.404 10 10 CECE Cc1cc(CN)ccc1N1[C@H]2CCC[C@@H]1CN(C)C2 2226364771 QVWZCTHAAONWAC-GASCZTMLSA-N 259.397 2.127 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CCCN3C)C[C@H]1O 2226657617 XEZILMVFSAZFGP-MLGOLLRUSA-N 260.381 2.276 10 10 CECE CN1CCc2cc(N3CCC[C@@](C)(O)CC3)ccc21 2226797437 CTOAZSVUWAFNKQ-MRXNPFEDSA-N 260.381 2.420 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@@](=O)CCC1CC1 2227205571 TXMJNVWWGZQYGS-DGIBIBHMSA-N 280.393 2.145 10 10 CECE COc1ccc(N2CCOC(C)(C)CC2)c(CN)c1 2227673805 RWTPXWISHLZXCB-UHFFFAOYSA-N 264.369 2.159 10 10 CECE CCCN(Cc1nc(C)n(C)n1)c1ccc(N)cc1 2228239496 IPTSCQXBPVBPIN-UHFFFAOYSA-N 259.357 2.122 10 10 CECE CC[C@H](C)NCc1ccc(N(C)[C@H](C)C(N)=O)c(F)c1 2240077339 RZPYBZSYPVVOBL-WDEREUQCSA-N 281.375 2.024 10 10 CECE COc1ccc(N(C)[C@@H](C)C(=O)NCC(F)(F)F)cc1 2279054745 SWONWYZETPVSPG-VIFPVBQESA-N 290.285 2.198 10 10 CECE Oc1cccc(CNC[C@@H]2OCC[C@@H]2C(F)(F)F)c1O 2240520906 ROEKMHZTGMIZPJ-ONGXEEELSA-N 291.269 2.155 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)CCCn1cncn1 2240759790 MGBGGMDBZRPTKL-ZDUSSCGKSA-N 273.384 2.133 10 10 CECE CNC(=O)[C@H]1CCCN(c2ccc([C@H](C)O)cc2C)C1 2240834531 ATKIWPZIVYTFPN-JSGCOSHPSA-N 276.380 2.011 10 10 CECE CSc1ncc(CNCCCCCC(N)=O)s1 2253033804 KSGGTUZBWUIFRC-UHFFFAOYSA-N 273.427 2.000 10 10 CECE CC(C)C[C@H](NCc1ccc(Cl)cc1O)C(N)=O 2253485314 IXAVGURBDBIZKK-NSHDSACASA-N 270.760 2.035 10 10 CECE CSc1ncc(CNc2cccc(=N)[nH]2)s1 2243819699 UBAHBEXPJGHFEX-UHFFFAOYSA-N 252.368 2.285 10 10 CECE Cc1nsc(CN[C@H]2CCc3cccc(O)c32)n1 2254083696 GZBYKZPZYSNGCQ-JTQLQIEISA-N 261.350 2.329 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1CC[C@H]2C[C@H]1CO2 2254488490 PSOJGUZKYUBEEM-WCFLWFBJSA-N 251.301 2.188 10 10 CECE CO[C@@H]1CN(c2ccc([C@@H](C)N)c(C)c2)C[C@H]1F 2257466647 KUWFWGFIBVPVPE-LERXQTSPSA-N 252.333 2.188 10 10 CECE COCCN(CCF)c1ccc([C@H](C)O)c(C)c1 2257463371 JVCSPMAAFTWZTF-LBPRGKRZSA-N 255.333 2.471 10 10 CECE CCN(CCN1CCCC1)c1ccc(CN)c(F)c1 2265086034 PLFVSPFOZRRAHG-UHFFFAOYSA-N 265.376 2.207 10 10 CECE [N-]=[N+]=NCCCCN1Cc2ccccc2C[C@@H]1CO 2278842156 ZENCBZJZKNTKEP-CQSZACIVSA-N 260.341 2.496 10 10 CECE COC[C@]1(C)C[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2269192554 FLYLSXAZAFEZOK-GVXVVHGQSA-N 266.345 2.350 10 10 CECE CN(C(=O)C[S@](=O)CC1(C)CCC1)c1ccc(N)cc1 2290401343 KREQOFICCUTDBW-FQEVSTJZSA-N 294.420 2.171 10 10 CECE N[C@@H]1CCN(Cc2c(O)cccc2F)[C@@H](C(F)(F)F)C1 2281179264 RIMIXATZPRZFEM-PRHODGIISA-N 292.276 2.385 10 10 CECE Cc1cc(N2CCO[C@]3(CCOC3)C2)ccc1[C@@H](C)O 2285156978 FJYSXSWJUWFJJB-CZUORRHYSA-N 277.364 2.044 10 10 CECE CCCN(c1ccc([C@@H](C)N)c(C)c1)[C@@H]1CCNC1=O 2285126876 HQDVNQBTPDYCQO-IUODEOHRSA-N 275.396 2.120 10 10 CECE COc1ccc(N2C[C@H](O)C3(CCC3)C2)c(OC)c1C 2295466593 HJFGDLQZGNVNEB-AWEZNQCLSA-N 277.364 2.363 10 10 CECE COc1cccc(CN2C[C@@H](CC(=O)O)C[C@H]2C)c1O 2285693620 HPSOHJYXKQYLNL-GHMZBOCLSA-N 279.336 2.086 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c(C)c1 2286214827 QZYCAAFPNFDZEN-QLPKVWCKSA-N 274.408 2.312 10 10 CECE COc1ccc(N)c(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])c1 2286939994 KLWCTPSNZIEXKE-SECBINFHSA-N 275.312 2.192 10 10 CECE C[C@@H](O)CN(CCCOc1ccc(N)cc1)C1CCC1 2288152669 YSRQBVQSQUEOPT-CYBMUJFWSA-N 278.396 2.273 10 10 CECE CN1CC[C@H]2CCN(Cc3cccc(F)c3O)C[C@H]21 378488723 BIFCYWKXWBFESD-SMDDNHRTSA-N 264.344 2.057 10 10 CECE CN(C(=O)C1=CC[C@H](N)C1)c1ccccc1Cl 2301316569 VDUNHGWTDCWWSP-JTQLQIEISA-N 250.729 2.350 10 10 CECE COCc1nc(C(=O)N[C@@H](C)c2ccccc2O)cs1 827978158 JFSKHNORORNBHO-VIFPVBQESA-N 292.360 2.486 10 10 CECE [N-]=[N+]=NC[C@H]1CCN([C@H]2CCCC(F)(F)[C@@H]2O)C1 2308749653 DNDLCVWANHEJGW-KXUCPTDWSA-N 260.288 2.167 10 10 CECE Oc1ccc(Cl)cc1CNC[C@H]1[C@@H]2CCOC[C@@H]21 2310301057 QDBCIWXHEOVRDL-AVGNSLFASA-N 267.756 2.418 10 10 CECE COc1ccc(N2CCN[C@H]3CCC[C@H]32)cc1F 2319325683 IQTVFOMUKOHDOX-QWHCGFSZSA-N 250.317 2.165 10 10 CECE CN[C@@H]1CCN(c2c(Cl)cc(OC)cc2OC)C1 2319559931 JNIUWOVTAWETDX-SECBINFHSA-N 270.760 2.155 10 10 CECE CSc1ncc(CN[C@](C)(C(=O)O)[C@@H]2C[C@@H]2C)s1 2326013423 QZJWBBYJVZAVMZ-VMAXQDLPSA-N 286.422 2.454 10 10 CECE O=C(O)[C@@]1(Sc2nccs2)CNC12CCCCC2 2326897933 VGPDPMSPHMBBHJ-LBPRGKRZSA-N 284.406 2.365 10 10 CECE CCN(C)C1CN(c2ccc(CN)c(SC)c2)C1 2328543907 XURVTNVEYUERRV-UHFFFAOYSA-N 265.426 2.008 10 10 CECE Nc1ccc(CCCN2C(=O)[C@H]3C[C@@H]2[C@H]2C[C@H]32)cc1 2329266182 WJQDMMMLOWXMGZ-ZQDZILKHSA-N 256.349 2.068 10 10 CECE CN1CCc2cc([C@@H](O)[C@@]3(C)CC[C@H](N)C3)ccc21 2329486975 QLEVFNOGOIKRNU-IMJJTQAJSA-N 260.381 2.230 10 10 CECE C[C@H]1Cc2cc(N3C[C@H]4C[C@H](N)C[C@@H]3C4)ccc2O1 2332110640 DWNNZYAVNUWLHV-UHXUCMFUSA-N 258.365 2.326 10 10 CECE CC[C@H](O)c1ccc(N2CC[C@H]3C[C@]2(CO)C3)cc1 2336575566 VOHLUOHIYSGALM-VBNZEHGJSA-N 261.365 2.481 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)c1C 2340853013 LEQYYWDRULKNID-YUDUHTQSSA-N 261.365 2.316 10 10 CECE CCn1cnc(CN2CCCC[C@H](CN=[N+]=[N-])C2)n1 2341900958 OKWGKMABAAXIAE-LLVKDONJSA-N 263.349 2.210 10 10 CECE COc1cc(Cl)c(N2CCC3(CNC3)C2)c(OC)c1 2342299507 GTCAOKCBRHPBDX-UHFFFAOYSA-N 282.771 2.157 10 10 CECE CC[C@](C(=O)O)(C(F)F)N(C)Cc1ccccc1O 2347724003 QPKLHBIEWFRXFZ-CYBMUJFWSA-N 273.279 2.323 10 10 CECE 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Cc1c([C@H](C)N)ccc(N2CC[C@H](O)[C@@H](F)C2)c1C 2340859521 LCTXHTRQZRWVBC-WHOFXGATSA-N 266.360 2.232 10 10 CECE CN(CCc1cccnc1N)Cc1ccccc1O 2351799913 WMIXFESCICJOFR-UHFFFAOYSA-N 257.337 2.044 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@@H]2CC[C@H]3C[C@@H]2CO3)CC1 2354196382 HDCUTTSBKMXLNX-MROQNXINSA-N 278.356 2.493 10 10 CECE CN1CCCc2cc(CNC[C@H]3[C@@H]4CCO[C@@H]43)ccc21 2355558454 NDUHLAMFPJSKTO-ZOBUZTSGSA-N 272.392 2.194 10 10 CECE c1cc2c(cc1CN[C@H]1CCN[C@@H]3CC[C@H]13)CCCO2 2355669831 PHRISCJCHHMDNP-XHSDSOJGSA-N 272.392 2.242 10 10 CECE CN(C)c1ccc([C@@]2(N)C[C@H]2C(=O)OC(C)(C)C)cc1 1952741628 HNTMAQKWVJFICE-BBRMVZONSA-N 276.380 2.268 10 10 CECE C=C(Cl)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 401086175 AYBLOSCGSYHSCW-UHFFFAOYSA-N 294.782 2.234 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](O)[C@@H]3CC[C@@H]32)c(F)c1 2357398218 LPGLFWGVZDSKPF-HHSCNIOUSA-N 282.334 2.334 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCO)c(Br)c1 61695941 NUFKISPFRZZVNS-VIFPVBQESA-N 287.201 2.158 10 10 CECE CCOCCN(CCOCC)c1ccc([C@@H](C)N)c(O)c1 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249594993 PQPXVVWWXUXGHG-JUFVYRIHSA-N 279.767 2.247 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1N(C)C 251780000 MXCLDDVNWYAWDK-ZWNOBZJWSA-N 268.788 2.428 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H](C)[C@@H](CO)C2)c(F)c1 700399451 KIZISTULTVYNHN-NTZNESFSSA-N 267.344 2.334 10 10 CECE COc1cccc(S(=O)(=O)Nc2ccc(O)c(F)c2)c1 1259188722 HHKYMFWESDNNSZ-UHFFFAOYSA-N 297.307 2.341 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@@H]1COCCC1(F)F 2168221676 ZAGIBPHGCNJZBS-LLVKDONJSA-N 285.294 2.157 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@H]1CCN2CCC[C@H]1C2 2164425818 MYSKZYYGRCBOAE-BBRMVZONSA-N 277.387 2.205 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)C3(C)CC=CC3)ccc21 2166485512 JSPAXISWCJTHPO-JKSUJKDBSA-N 272.392 2.396 10 10 CECE COCc1ocnc1CN[C@@H](C)c1ccc(O)cc1O 2164749188 KXJXMCBEWBYZRE-VIFPVBQESA-N 278.308 2.083 10 10 CECE c1cc2c(cc1N1CCNCC13CCC3)OCCCO2 2162852196 VTOSMLGDVJYATL-UHFFFAOYSA-N 274.364 2.180 10 10 CECE C[C@H]1CNCC[C@@H]1N(C)c1ccc2c(c1)OC(F)(F)O2 2162872531 NFYKIWRNSZVLON-ONGXEEELSA-N 284.306 2.442 10 10 CECE N[C@]1(c2ccc(N3CCCC3)cc2)CN2CCC1CC2 2163105898 LNGXCZSZSKWGAD-KRWDZBQOSA-N 271.408 2.166 10 10 CECE CN[C@@H](c1ccc(N2CCCC2)cc1)c1cn(C)cn1 2163111651 UJMSXCLTBZAUCY-INIZCTEOSA-N 270.380 2.329 10 10 CECE CNCc1ccc(N2C[C@@H](CO)[C@@H](C(F)(F)F)C2)cc1 2163285876 IHODNXXNRTULSJ-AAEUAGOBSA-N 288.313 2.013 10 10 CECE CC(C)[C@H](C)CNC(=O)c1c(F)ccc(O)c1O 825997821 PZPYXSASOPUJGY-MRVPVSSYSA-N 255.289 2.259 10 10 CECE CN(C)c1ccc(/C=C\CN2CC[C@@](C)(O)C2)cc1 835027845 GVCWHBHFRXMXPA-YIEVGGLXSA-N 260.381 2.223 10 10 CECE COCCN(C/C=C/c1ccc(N(C)C)cc1)CCOC 835024967 FCSSZKYCXHYDGU-AATRIKPKSA-N 292.423 2.361 10 10 CECE CC[C@H](CO)N(C)C/C=C\c1ccc(N(C)C)cc1 835055054 PNFQKZAEWXZLEZ-IDTUSYRASA-N 262.397 2.469 10 10 CECE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CC12CC2 846477575 SMEAYPKNSRCQPZ-JTQLQIEISA-N 251.713 2.462 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CCNC[C@H]1C(F)F 843124941 QPVRJEIBHGLXEM-JTQLQIEISA-N 294.704 2.224 10 10 CECE O=C(NCc1ccc(N2CCCC2)cc1)C1(F)CC1 843764881 AHHNRCFVEWCHMR-UHFFFAOYSA-N 262.328 2.405 10 10 CECE C[C@@]1(CNC(=O)NCc2ccccc2O)CCCCO1 915525496 PLJNTUYNXZXYKV-HNNXBMFYSA-N 278.352 2.151 10 10 CECE COc1ccc(N2CC[C@@H](N[C@@H]3CCn4ccnc43)C2)cc1 850489368 XJNJWTBJCWMJDS-CZUORRHYSA-N 298.390 2.205 10 10 CECE C[C@H](CCC(=O)O)Sc1ncc([N+](=O)[O-])s1 386290350 QIJPCFMPTLFRKZ-RXMQYKEDSA-N 262.312 2.397 10 10 CECE CC(C)Cn1nccc1C(=O)NCc1c(O)cccc1F 928705366 HRLADASKBVMSLY-UHFFFAOYSA-N 291.326 2.314 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc2nccn2c1 779518504 YNOOYWRSRCXMDG-KXFIGUGUSA-N 295.298 2.397 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCC[C@H]2N)c1 1118269366 DLKNCTRPRPKJMR-ZKYQVNSYSA-N 292.379 2.096 10 10 CECE CC[C@@H](CCO)Sc1ncc(C(=O)OC)s1 2245244697 DHCRUTNXJXVPDB-ZETCQYMHSA-N 261.368 2.183 10 10 CECE CCCC[C@@H](N[C@H](C)Cc1ccc(N)cc1)C(=O)O 71428769 CMWPRPXKSIBBMN-BXUZGUMPSA-N 264.369 2.433 10 10 CECE C[C@]12CCC[C@@H]1C(=O)N2C(=O)Nc1ccc(N)cc1 1876153521 UUIMGEARENLOTN-RISCZKNCSA-N 259.309 2.202 10 10 CECE Cc1cccc(CN[C@@H]2[C@@H]3CCN[C@H]3C2(C)C)c1O 1875715559 APZCYBUKUREKMA-BPLDGKMQSA-N 260.381 2.177 10 10 CECE Nc1ccc(CCC(=O)Nc2cccc(N)c2)cc1 1876514107 JPOJZTMRNYZBRS-UHFFFAOYSA-N 255.321 2.422 10 10 CECE COC(=O)[C@H]1CC[C@H](N[C@H](C)c2ccccc2O)C1 895459736 HNBOMDFUJUJMDN-WOPDTQHZSA-N 263.337 2.385 10 10 CECE C[C@@H](C(=O)NC1CC1)N(C)[C@H](C)c1ccccc1O 1877536710 AJQFZHUIVYDWEK-MNOVXSKESA-N 262.353 2.052 10 10 CECE Oc1ccc(Br)cc1CN[C@H]1CCC[C@@H]1O 164233150 BWSMVPALEOBBMB-JQWIXIFHSA-N 286.169 2.158 10 10 CECE Nc1ccc(NC(=O)OC[C@@H]2CCCCO2)cc1 35408337 QJCRCXQGVPYHMD-LBPRGKRZSA-N 250.298 2.386 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H](O)C(C)(C)C2)c(F)c1 1880480327 VGYGULNHHGEQLY-PELKAZGASA-N 271.307 2.225 10 10 CECE CO[C@@H]1CN(c2c(F)cc([C@H](C)O)cc2F)C[C@@H]1F 1880483854 AKTLYOGXECHYFZ-CQFDHEJISA-N 275.270 2.191 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3CO[C@@H](C3)C2)c(F)c1 1880452804 WWMFGIGLWGTMLB-QXEWZRGKSA-N 269.291 2.243 10 10 CECE C[C@H]1CN(CCCN=[N+]=[N-])CC[C@H]1NC(=O)C(F)(F)F 1957250993 VUCBIYOFBYHAMP-DTWKUNHWSA-N 293.293 2.076 10 10 CECE CC[C@@H]1CN(Cc2ccc(OC)cc2O)C[C@@H](C)O1 245564840 RDAVDHZNJQTDTK-DGCLKSJQSA-N 265.353 2.400 10 10 CECE CN(Cc1ccccc1O)C(=O)C1(CF)CCC1 1349445706 AGXXWRNAIQESEN-UHFFFAOYSA-N 251.301 2.490 10 10 CECE CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1885562246 COCGWKGXWRWDRT-ZJUUUORDSA-N 297.359 2.201 10 10 CECE Nc1ccc(-n2c(CC(=O)O)nc3ccccc32)cc1 76005386 AKMGAKKLYVEVKB-UHFFFAOYSA-N 267.288 2.235 10 10 CECE COc1cccc([C@H]2NCCc3cccc(O)c32)c1O 83593538 WWOWKUUBILXXIC-OAHLLOKOSA-N 271.316 2.342 10 10 CECE Oc1cccc([C@H]2NCCc3c(O)cccc32)c1O 83619854 SDMQTGMGWZHBPC-AWEZNQCLSA-N 257.289 2.039 10 10 CECE COc1cccc(O)c1CNC12CCC(CC1)OC2 1885122675 DSVJWJZTWKFPQR-UHFFFAOYSA-N 263.337 2.202 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CC[C@@H]1SC 702430404 ZYBYQUCFTAALOY-MNOVXSKESA-N 266.366 2.361 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@H]1CCCSC1 689524146 KWZMBJTWNLUOPE-ZDUSSCGKSA-N 279.409 2.035 10 10 CECE C[C@]1(N)CCN(Cc2ccc(Br)cc2O)C1 691385583 GYRMRMJJFKZZKH-LBPRGKRZSA-N 285.185 2.078 10 10 CECE 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10 CECE CCCN(C)C1CN(c2ccc([C@H](C)O)cc2F)C1 1877447645 CZSIZINFMNGLLV-NSHDSACASA-N 266.360 2.409 10 10 CECE C[C@H]1CC[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 796656939 AJXLUEZCKAAEQQ-SMDDNHRTSA-N 261.369 2.350 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC(C2(O)CC2)CC1 895133768 PABJLTMVHPZASQ-UHFFFAOYSA-N 283.318 2.407 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@]2(CN)CCCSC2)cc1 1879870961 VGWOXVOBFJHCFH-HUUCEWRRSA-N 280.437 2.258 10 10 CECE O=C(O)C=Cc1ccc(N2[C@H]3COC[C@H]2C3)c(Cl)c1 1899388411 XAZCYRDHTWVDME-GHMZBOCLSA-N 279.723 2.415 10 10 CECE FC(F)COc1ccc(N2CCNCC23CC3)cc1 1879917086 GGIDOXADNJLGRY-UHFFFAOYSA-N 268.307 2.273 10 10 CECE C[C@H](O)c1ccc(N2CC(c3ccn(C)n3)C2)cc1 1882897032 JVUGBHJCUOABLI-NSHDSACASA-N 257.337 2.077 10 10 CECE CC1(C)CN(C(=O)Cc2ccc(O)c(O)c2)C(C)(C)CO1 1147164166 PFNMFZOYGQXSKV-UHFFFAOYSA-N 293.363 2.056 10 10 CECE C[C@@H](O)[C@@H](NCc1cc(F)cc(F)c1O)C(F)(F)F 1882640368 SQPWOHORDQXFNB-GPXNAGAYSA-N 285.212 2.072 10 10 CECE Oc1ccc(CNCCc2ccccc2)c(O)c1O 83431954 IAKQLYKSLDRKDF-UHFFFAOYSA-N 259.305 2.136 10 10 CECE CC[C@]1(c2c(O)cc(C)c(N)c2C)CO[C@@H](C)CN1 83479709 NGFMSCAOPGFZAX-ZUZCIYMTSA-N 264.369 2.205 10 10 CECE Oc1ccc2c(c1)[C@H](c1ccc(F)cc1O)NCC2 83662192 QGADSSDZCMDTRK-HNNXBMFYSA-N 259.280 2.472 10 10 CECE CC[C@@H](NCCCC(=O)OC)c1ccccc1O 37416256 AGKOIWOZJZDJOE-GFCCVEGCSA-N 251.326 2.386 10 10 CECE [N-]=[N+]=NCCN[C@]1(C(=O)O)CCCc2ccccc21 90256578 LUMJLGJUVRDBNM-CYBMUJFWSA-N 260.297 2.203 10 10 CECE CCC(CC)(CC)[C@@H](NCCCN=[N+]=[N-])C(N)=O 395116578 HFVQCDOATJXHMZ-JTQLQIEISA-N 255.366 2.347 10 10 CECE CNCc1ccc(N2CCC[C@@H]3COC[C@@H]32)c(C)c1 702082245 UWNPMUFSNNYEDJ-ZBFHGGJFSA-N 260.381 2.330 10 10 CECE CN(C)c1ccccc1C(=O)NCc1ccc(N)cc1 169820542 AFDBZVAXJMLTPC-UHFFFAOYSA-N 269.348 2.265 10 10 CECE COC1CC(CN[C@H](C)c2c(O)cccc2O)C1 703172272 YENGGKKQQMHYJJ-KPPDAEKUSA-N 251.326 2.173 10 10 CECE COc1cc(CNCc2ccc(F)c(F)c2O)sn1 703294335 HDBUMBJNGLOHLB-UHFFFAOYSA-N 286.303 2.425 10 10 CECE COc1cccc(CNC(=O)C2(CF)CCC2)c1O 1326654538 RPAXNMKVMJDPDE-UHFFFAOYSA-N 267.300 2.157 10 10 CECE C[C@H](O)c1ccc(N(C)CCC(N)=O)cc1C(F)(F)F 705534042 PFQFWTQRCNODIB-QMMMGPOBSA-N 290.285 2.070 10 10 CECE CN(C[C@]12COC[C@@H]1C2)c1ccc(CN)c(Cl)c1 689298347 UTHYDMBVXBLJOB-SMDDNHRTSA-N 266.772 2.271 10 10 CECE Nc1ccc(OCCCN2C[C@H](F)[C@H](F)C2)cc1 714589047 XBHHVWTWRYLBKC-BETUJISGSA-N 256.296 2.030 10 10 CECE COC[C@H](CN(C)[C@H](C)c1ccc(OC)cc1O)OC 691300666 PEROCCCTMGOAOV-YPMHNXCESA-N 283.368 2.055 10 10 CECE COC(=O)[C@H](NC(C)C)[C@H](C)Sc1nccs1 698612407 NXICNAVNRHYQCF-DTWKUNHWSA-N 274.411 2.163 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC[C@@H]2CO)cc1O 93670669 IPXMCTFFLPSRPC-WCQYABFASA-N 264.369 2.024 10 10 CECE CN(C)c1ccc([C@@H](NCc2ccccn2)C(=O)O)cc1 211888441 VZLZXTAMHIRBHS-OAHLLOKOSA-N 285.347 2.063 10 10 CECE COc1ccc(/C(C)=C2\SC(=S)N(CO)C2=O)cc1 1030956 YZOFZQUEGBDQIA-FLIBITNWSA-N 295.385 2.236 10 10 CECE C[C@@H]1CC(F)(F)CN1c1cc2c(cc1N)OCCO2 2115417895 MMYCERPLRHTJSQ-MRVPVSSYSA-N 270.279 2.274 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC(F)(CO)C1 2116277800 AAJRYDCLFJADGP-UHFFFAOYSA-N 266.360 2.014 10 10 CECE CC(C)OC1(C(=O)NCc2c(O)cccc2O)CCC1 1472063368 JDESYYSOZDIPFP-UHFFFAOYSA-N 279.336 2.062 10 10 CECE CCC[C@H](C)NC(=O)COCCc1ccc(N)cc1 2119732920 HNKYMUUPRZJDLE-LBPRGKRZSA-N 264.369 2.133 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](OCC)C1CC1 1623574343 MQLRAWOKQJKWAT-OAHLLOKOSA-N 298.379 2.309 10 10 CECE COc1ccc(C(=O)NCc2ccc(O)cc2O)cc1F 1630302269 VYQYLRBKASBADW-UHFFFAOYSA-N 291.278 2.176 10 10 CECE Cc1cc(C)nc(NC(=O)Cc2ccc(O)c(O)c2)c1 1632186286 ZGPIIDAJMVZTMB-UHFFFAOYSA-N 272.304 2.291 10 10 CECE Oc1ccc(F)cc1CN[C@H]1c2ccccc2C[C@H]1O 1963629102 IZVJCSQOVKHQIM-CVEARBPZSA-N 273.307 2.279 10 10 CECE Cc1cccc(O)c1CN1CC[C@H](C(=O)O)C(F)(F)C1 1964733426 VJZLOURROXXGKG-LLVKDONJSA-N 285.290 2.242 10 10 CECE COc1cc(C)cc2c1C(=O)c1c(O)cccc1C2=O 13334424 KVRUANCWPQJDMF-UHFFFAOYSA-N 268.268 2.485 10 10 CECE endogenous,in-man C[C@]1(NCc2ccc3c(c2)CCCO3)CCC[C@H]1O 2126314773 UPTKROWBWRXOLV-CVEARBPZSA-N 261.365 2.405 10 10 CECE Cc1cc(C(=O)NC2(CO)CC2)c(C)n1-c1ccccc1 160227220 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OC[C@@H]1CC2(CC2)CN1c1ccc2c(c1)CC[C@@H]2O 2128314254 DFDGCQFTNDAIOL-ZFWWWQNUSA-N 259.349 2.017 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3O)C[C@@H]1CO 2128324756 JOCPNFPYZDGTTO-GHJWDPDVSA-N 261.365 2.121 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)cc1 2128635108 GHJZJRLZLRWGIL-OCVGTWLNSA-N 261.365 2.337 10 10 CECE C[C@@H](c1ccccc1O)N(C)S(=O)(=O)C1CC=CC1 2132425355 UWUFCPBJUORZDU-NSHDSACASA-N 281.377 2.433 10 10 CECE COc1cc(N(CC(C)C)C2COC2)ccc1CO 2139697953 CAOFZNVMOWWSFE-UHFFFAOYSA-N 265.353 2.049 10 10 CECE C[C@H](F)CN1CCN(Cc2c(O)cccc2F)CC1 2133463008 PBDVGUYODDOAAJ-NSHDSACASA-N 270.323 2.007 10 10 CECE Nc1ccc(OCCn2cnc3c2CCCC3)cc1 216786968 BNSUYDHCQIELAW-UHFFFAOYSA-N 257.337 2.423 10 10 CECE CC[C@@H](C)C[C@@H](N)C(=O)NCc1cccc(C)c1O 2139741754 OTWLULZUIWFBQR-ZWNOBZJWSA-N 264.369 2.080 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)c2ccnc(F)c2)CC1 1912178768 PAOVRKMCRPGAJS-UHFFFAOYSA-N 263.276 2.383 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C[C@@H]2CC[C@H]3C[C@H]2CO3)C1 1912174622 BPYZSYRKOVLDQE-CYDGBPFRSA-N 250.346 2.434 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)COc1ccccc1F 1912172468 FEBZJJWRVYEPEU-UHFFFAOYSA-N 266.276 2.363 10 10 CECE COc1cccc(CCC(=O)N2CC(N=[N+]=[N-])C2)c1 1912171527 LTOWYWJQCPGCHZ-UHFFFAOYSA-N 260.297 2.149 10 10 CECE CC(C)c1noc(CN2CCC(N=[N+]=[N-])CC2)n1 1912166262 VEYQOMUHHABEAB-UHFFFAOYSA-N 250.306 2.468 10 10 CECE CC[C@]1([C@H](NCCCN=[N+]=[N-])C(=O)OC)CCCCO1 1912148392 SKSNEJOTUWOXNA-DGCLKSJQSA-N 284.360 2.167 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H]1CCNC1(C)C 1900678255 FRICDPUDTKAHLI-LSDHHAIUSA-N 261.413 2.401 10 10 CECE C[C@H]1[C@H](O)CCN1c1ccc(CN)c2ccccc12 1914284072 YXRJJYFJAOZZFE-MEDUHNTESA-N 256.349 2.258 10 10 CECE OCc1ccc(N2CC[C@@H](O)C23CCC3)cc1Cl 1914380583 SYUFRYDCVPJGKV-CYBMUJFWSA-N 267.756 2.326 10 10 CECE Oc1cccc(F)c1CNC[C@H]1CCCc2nccn21 1965994001 OAWHILFGJOSGIG-LLVKDONJSA-N 275.327 2.395 10 10 CECE C[C@H]1CN2CCCC[C@H]2CN1c1ccc2c(c1)OCO2 251639685 FWKPORXBVZCTQC-JSGCOSHPSA-N 274.364 2.478 10 10 CECE CC1(C)OCCC[C@@H]1NCc1cc2c(cc1O)OCO2 1967881715 MPCNSRGNTFAKLH-AWEZNQCLSA-N 279.336 2.168 10 10 CECE CN(C)[C@@H]1CCC[C@@H]1NCc1cc(F)cc(F)c1O 1921993360 WMEOUSFOFIACDH-QWHCGFSZSA-N 270.323 2.243 10 10 CECE CN(CC(F)(F)F)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 118587579 TZCPXUXAZNROHR-VIFPVBQESA-N 293.676 2.290 10 10 CECE CCNC(=O)CCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 228329244 CMKZWTDYQNWNDM-NEPJUHHUSA-N 276.380 2.365 10 10 CECE CC1(C)CCCN1C(=O)[C@H]1CNc2ccccc2N1 229881054 NZWRYOBAFOVYBO-CYBMUJFWSA-N 259.353 2.294 10 10 CECE OCCCC1(NCc2cc(F)cc(F)c2O)CCC1 2140854379 VZZFATITFNSYEH-UHFFFAOYSA-N 271.307 2.455 10 10 CECE CC[C@H]1CC[C@H](CNCc2cccc(OC)c2O)O1 2136776289 ZDCFPWGLPXKUIT-QWHCGFSZSA-N 265.353 2.448 10 10 CECE CC1(C)CCCN2C(=O)N(c3ccc(N)cc3)C(=O)[C@H]21 232786018 AKPONYLFUSZTBV-LBPRGKRZSA-N 273.336 2.226 10 10 CECE CO[C@@H]1C[C@H](C)CN(c2c(F)cc(CN)cc2F)C1 2140962364 LHFIJFDBWJFIET-GXSJLCMTSA-N 270.323 2.285 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@@H]1CCN(C)C1 235157237 XBTOWJNVNNMAEJ-VXGBXAGGSA-N 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COc1ccc(N(C)C2(CO)CCCC2)cc1OC 2226805819 LLKIWNVYYDUDHY-UHFFFAOYSA-N 265.353 2.445 10 10 CECE COc1ccc(N2CCO[C@@H]3C[C@H](O)C[C@@H]32)cc1Cl 2226922612 PJILNLKEOTUCKC-SCDSUCTJSA-N 283.755 2.077 10 10 CECE CC[C@H](C)C[C@](O)(CN)COc1ccc(N(C)C)cc1 2237695553 JIELDLXSJLXNRE-BBRMVZONSA-N 280.412 2.257 10 10 CECE COc1ccc(N(C)[C@@H]2CC[C@@H](OC)C2)c(CN)c1 2227672520 JCLMYZXHCQFNCL-TZMCWYRMSA-N 264.369 2.158 10 10 CECE CC[C@H]1CN(c2ccc(OC)cc2CN)C[C@@H](C)O1 2227677666 MGDHIYRAESTZRE-YPMHNXCESA-N 264.369 2.158 10 10 CECE FC(F)[C@@H](NCc1ccc2c(c1)CCO2)[C@H]1CCOC1 2239538858 YZSVMFCAEHJDFG-JSGCOSHPSA-N 283.318 2.381 10 10 CECE Nc1ccc(CCNC[C@H]2OCC[C@H]2C(F)(F)F)cc1 2240504526 KQUDJDRDBSZGER-CHWSQXEVSA-N 288.313 2.368 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC(C(=O)NC(C)C)C1 2240842570 VDZXSWBWTSJJAK-LBPRGKRZSA-N 276.380 2.009 10 10 CECE Cc1cccc(CN=c2[nH]c(Br)co2)c1O 2245903454 WCXTZFBHSPYIJI-UHFFFAOYSA-N 283.125 2.485 10 10 CECE CSc1ncc(CNC[C@@H]2CCNC3(CC3)C2)s1 2257135077 NAIXADPECLDBKZ-SNVBAGLBSA-N 283.466 2.487 10 10 CECE CSc1ncc(CNC[C@@]2(N)CC[C@H](C)C2)s1 2248741017 MUWMCOKCQAOINM-JOYOIKCWSA-N 271.455 2.472 10 10 CECE C[C@@H]1C[C@@H](CC(=O)O)CN1Cc1cc(F)ccc1O 2270160738 QSBZMNBTHHFLED-ZJUUUORDSA-N 267.300 2.216 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1CCNCc1ccc(O)c(O)c1O 2260451565 MHCJMSZLKNIQGT-JZYVYDRUSA-N 251.326 2.185 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1ccc([C@@H](C)NC)c(O)c1 2273224453 LHOIPXGEJCSMFL-HONMWMINSA-N 264.369 2.022 10 10 CECE N[C@@H]1CC[C@H]2CN(c3ccc(OCF)cc3)C[C@@H]12 2263938009 ZHCLNUYWFSBIJL-ZLKJLUDKSA-N 250.317 2.166 10 10 CECE CSC1CC(CN(C)C(=O)c2cccc(O)c2O)C1 2268834824 PJFIYZCFZBCQPB-UHFFFAOYSA-N 281.377 2.311 10 10 CECE Cc1cc(N2C[C@@H](C)[C@](C)(CO)C2)ccc1[C@@H](C)N 2269658409 FDIFHUIBNGZUSL-IOASZLSFSA-N 262.397 2.469 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)C1(OC)CC(C)C1 2281071485 KYRCZGJGISXDPT-UHFFFAOYSA-N 276.380 2.432 10 10 CECE COc1ccc(N2C[C@H](C(F)F)[C@@H](N)C2)c(OC)c1C 2295417882 ZTAHXGVLCAXYPW-UWVGGRQHSA-N 286.322 2.041 10 10 CECE 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2331548764 IFQMQIADBCEMKT-FPCVCCKLSA-N 259.349 2.016 10 10 CECE Cc1cccc(O)c1CN[C@@H]1C[C@H]2[C@@H]1[C@@H]1CC[C@H]2O1 2331831763 YEPCIPRMZOCKCX-DJJNUCPWSA-N 259.349 2.356 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](N)C[C@@H]2C3)cc1OC 2332111660 KPCOWYLMUNXIMI-GVXVVHGQSA-N 262.353 2.020 10 10 CECE CN(C)c1ccc(O[C@@]2(C(=O)O)CC[C@@H]3C[C@@H]32)cc1 2333833963 MZZGHYVZMFDAPF-DGFSRKRXSA-N 261.321 2.385 10 10 CECE Oc1cc(F)ccc1CN1CC[C@@H]2CCCN[C@H]2C1 2336223413 SRMMDAAHDCBANN-FZMZJTMJSA-N 264.344 2.105 10 10 CECE C[C@@H](N=c1[nH]c(=N)[nH]c(Cl)c1Cl)c1ccccc1O 2337597272 SDVAEGRIKZOBTM-ZCFIWIBFSA-N 299.161 2.497 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccc2cncn2c1 2337775711 FBUMSYIYAKZYIZ-UHFFFAOYSA-N 258.285 2.107 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCN(C)[C@@H]3C[C@@H]32)c1C 2340858536 ZLUGSNXDTJONAU-WQVCFCJDSA-N 260.381 2.249 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H]3COC[C@H]3C2)c1C 2340859690 NFSLCFUVXVDDDQ-BFHYXJOUSA-N 260.381 2.406 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@@H]3C[C@@H](O)[C@H]3C2)c1C 2341061451 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10 10 CECE Oc1ccc(F)cc1CN1CCS[C@H]2COCC[C@H]21 246013775 UCFLJPKMCILRFK-OCCSQVGLSA-N 283.368 2.238 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2F)C[C@H]1N(C)C 251923554 YDYCLUMMCQQRJD-SJKOYZFVSA-N 291.414 2.464 10 10 CECE C[C@H]1C[C@H](OCC(=O)N(C)c2ccc(N)cc2)C[C@@H](C)O1 252792998 WKUSXBRRGUKHLF-JJLQDPRZSA-N 292.379 2.204 10 10 CECE CCOc1ccc(O)c(CNCCC(C)(C)C(=O)OC)c1 285370300 CBKJTLUBOFMFNZ-UHFFFAOYSA-N 295.379 2.470 10 10 CECE NC[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(O)c(O)c1 382699047 BWEFGBLPKGJNLP-CVEARBPZSA-N 298.386 2.272 10 10 CECE COc1cccc(O)c1CN(C)[C@H]1C[C@@H](OC)C1 809692910 JEBHMSPKXNDMAB-PHIMTYICSA-N 251.326 2.010 10 10 CECE Cc1cc([C@@H](O)c2ccc(N3CCCC3)cc2)nn1C 2163109423 YVKVKTVRRUXOHY-INIZCTEOSA-N 271.364 2.410 10 10 CECE CN1CCCc2cc(N3CC[C@@H]4CCN[C@@H]4C3)ccc21 2163109792 CFJIPHJUBXUYKA-XJKSGUPXSA-N 271.408 2.257 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H](O)C3CC=CC3)ccc21 2163229732 LMJDKOUUZFHMQG-IAGOWNOFSA-N 272.392 2.396 10 10 CECE COc1ccc(N2CCC(N[C@H](C)[C@H](C)O)CC2)cc1 806171228 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CO[C@@H]1CC[C@@H]2OCCN(Cc3cccc(C)c3O)[C@@H]2C1 245871588 RUESITPTPINVBL-OAGGEKHMSA-N 291.391 2.469 10 10 CECE N[C@@H](CO)c1cc2cc(Br)ccc2cc1O 258588263 LUAVVNHVELNOKN-NSHDSACASA-N 282.137 2.300 10 10 CECE C[C@H](N)C1(c2c(O)c(O)cc(F)c2Br)CC1 258403605 BZYYCNOMTOZEHP-YFKPBYRVSA-N 290.132 2.378 10 10 CECE CC(C)CN1CC[C@H](N)[C@H]1c1ccc2c(c1)CCN2C 250601673 SDTBFOGGRWIFJJ-DOTOQJQBSA-N 273.424 2.409 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H](C)O)cc1Cl 251063798 CSROSMUIGLFCHT-UWVGGRQHSA-N 256.777 2.437 10 10 CECE CCOC(=O)C[C@H](N)c1ccc(Br)cc1O 261286783 XZOQBGONWJBOFV-VIFPVBQESA-N 288.141 2.108 10 10 CECE C[C@H]1CN([C@@H]2CCc3cccc(O)c32)C[C@@H](C)N1C 381105849 FFTNCOIQBCVQDZ-MBNYWOFBSA-N 260.381 2.404 10 10 CECE Cc1nc(C2CC2)oc1C(=O)NCc1ccc(N)cc1 297191265 LXOCGZLZGDIUEH-UHFFFAOYSA-N 271.320 2.373 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(C)cc1Br 808528819 QVDLTDOPQNPDJL-UHFFFAOYSA-N 299.120 2.072 10 10 CECE COc1ccc(N(C)Cc2ccnc(OC)n2)c(OC)c1 294999434 RJJNJLAFHZCNQG-UHFFFAOYSA-N 289.335 2.139 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)OCCCO3)CC[C@@H]1N 2162626507 WFTWTZHHRWWWOE-OCCSQVGLSA-N 276.380 2.412 10 10 CECE CCN1CCc2cc([C@@]3(O)CCNC4(CC4)C3)ccc21 2163074509 SUASNRYZPGMKLJ-QGZVFWFLSA-N 272.392 2.173 10 10 CECE COc1ccc(N2C[C@@H](C)[C@@H](CCN)C2)c([N+](=O)[O-])c1 723892036 SVAWTIJPVNQNKI-MNOVXSKESA-N 279.340 2.025 10 10 CECE C[C@H]1CC(CNCc2cccc(O)c2O)C[C@H](C)O1 724292849 NSZHXYCQLQMJQU-QWRGUYRKSA-N 265.353 2.391 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2[C@H](C(=O)O)[C@@H]2C1)c1ccc(F)cc1O 2169239434 PISCFCVFFDXVLX-RCPLOFICSA-N 279.311 2.291 10 10 CECE Cn1cc(/C=C\C(=O)N2CCc3c(F)ccc(F)c32)cn1 814425986 KXMNCAUBBWJIBG-DJWKRKHSSA-N 289.285 2.301 10 10 CECE FC(F)Oc1ccc(N2CC=CCC23CNC3)cc1 2278496666 NVZYBCNFZFVBHV-UHFFFAOYSA-N 266.291 2.396 10 10 CECE Nc1ccc(OC[C@H](O)C[S@](=O)C2CCCCC2)cc1 722446676 YUTJNSXHXCKSMD-RBZFPXEDSA-N 297.420 2.090 10 10 CECE Cc1cc(F)c(O)c([C@H](CF)N2CCOCC2)c1 575303390 UGKQVMFWSBLJIX-LBPRGKRZSA-N 257.280 2.183 10 10 CECE CNC(=O)[C@H]1CCCN1c1ccc([C@H](C)NC)cc1Cl 723189838 TVKBKTPHODMINT-IINYFYTJSA-N 295.814 2.335 10 10 CECE C[C@](O)(CNCc1ccccc1O)C(F)(F)C(F)(F)F 724118790 ZGRZMYVAVFYBQF-JTQLQIEISA-N 299.239 2.430 10 10 CECE COC1(C(F)(F)F)CN(CCCc2ccc(N)cc2)C1 724171176 RDSVSFALJIIMPZ-UHFFFAOYSA-N 288.313 2.465 10 10 CECE CC[C@@H](N)c1ccc(N2CCC(C(=O)NC)CC2)cc1 723152655 DPODCDNXFMYIOH-OAHLLOKOSA-N 275.396 2.059 10 10 CECE O=C(O)/C=C/c1cc2scc(O)c2cc1CC(=O)O 725380786 NTYVHQVCTGRUMU-OWOJBTEDSA-N 278.285 2.332 10 10 CECE CO[C@]1(CO)CCCN(Cc2c(O)cc(C)cc2Cl)C1 826952923 XEHXELMPZKKUSR-OAHLLOKOSA-N 299.798 2.327 10 10 CECE CCc1ccc2sc([C@@H](O)C(=O)O)c(O)c2c1 725301476 SIIDMLRIPGAGRF-SNVBAGLBSA-N 252.291 2.287 10 10 CECE Cc1cc(N(C)C)ccc1CN1C[C@H]2CC[C@H]1[C@@H]1CNC[C@@H]21 903963788 QCKWSGYFFMWNCA-LULLPPNCSA-N 299.462 2.491 10 10 CECE CC[C@H](N[C@H](CC)c1ccc(C)cc1O)C(=O)NC 834910889 GJRLGWMITDSSSC-OLZOCXBDSA-N 264.369 2.266 10 10 CECE O=C1N[C@@H](c2ccc(O)c(O)c2)Nc2cc(F)ccc21 917499762 LFQNOPUWGSHRNU-ZDUSSCGKSA-N 274.251 2.091 10 10 CECE Cc1cc(N(C)C)ccc1CNCC[C@@H](O)C(F)(F)F 840948858 LRULWVZKIVPIKC-CYBMUJFWSA-N 290.329 2.464 10 10 CECE C[C@H](NCC(C)(C)[C@]1(O)CCOC1)c1cc(F)ccc1O 842921385 YFXCRDQDKKZVBN-ZBEGNZNMSA-N 297.370 2.360 10 10 CECE CCn1ccnc1CN1CCc2cc(OC)ccc21 750521500 ANPOEUPUTCFLJM-UHFFFAOYSA-N 257.337 2.474 10 10 CECE COC[C@@H](CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O)OC 850485501 KDDYSVKLIGVPIF-ZYHUDNBSSA-N 298.339 2.003 10 10 CECE C[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)c2ncnn21 850351939 KBILEQHKKGGHNQ-ZWNOBZJWSA-N 289.358 2.279 10 10 CECE COc1ccc(O)c(CN2CCO[C@@](C)(C(F)F)C2)c1 698946905 BJFWOCYKQAVQAV-CQSZACIVSA-N 287.306 2.257 10 10 CECE C[C@H]1CC[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CN1 863484977 QYBXZOCMPDWUHV-GZMMTYOYSA-N 299.758 2.184 10 10 CECE Oc1c(CN[C@]23CCC[C@H]2OCC3)ccc(F)c1F 872263643 IORKMXRVSFNXCX-RISCZKNCSA-N 269.291 2.472 10 10 CECE COC(=O)c1cc(OCc2nocc2C)ccc1N(C)C 871681526 ISJZGCAQRBSXNO-UHFFFAOYSA-N 290.319 2.415 10 10 CECE Cn1cc(/C=C\C(=O)N2CCCCc3cccnc32)cn1 872300488 XMQMHKFMJOVEBM-FPLPWBNLSA-N 282.347 2.198 10 10 CECE COc1ccc(N(CCC(=O)O)CCN2CCCC2)cc1 71720948 HOEMWAMQAZTGTO-UHFFFAOYSA-N 292.379 2.072 10 10 CECE COC[C@@H]1CC[C@H]1NCc1cnc(SC)s1 2243822457 DLMDMCOOLCEAMN-WCBMZHEXSA-N 258.412 2.380 10 10 CECE C[C@@H](NC(=O)[C@@H]1CCC(C)(C)N1)c1ccccc1O 1877590778 XIVGOXVCLDUFCY-PWSUYJOCSA-N 262.353 2.100 10 10 CECE COc1ccc(=N)[nH]c1N[C@@H](C)c1ccccc1O 1877590761 XFRPETXYYMUIFO-VIFPVBQESA-N 259.309 2.381 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)[C@H]2[C@H](C1=O)C2(C)C 1877589815 ONVDIWKHDLTEKK-GGZOMVNGSA-N 259.305 2.094 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3COC[C@H]3C2)c(F)c1 1880479289 MCZBVVVYTNRKEZ-JMJZKYOTSA-N 269.291 2.101 10 10 CECE Nc1ccc(N2CCC[C@@H]([C@H]3CCCNC3)C2)cc1 1879207943 YLEFWGDCQQJASI-UONOGXRCSA-N 259.397 2.485 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)CC(C)(C)O)c(F)c1 1880960220 HTQGIRTWWUQRQT-VIFPVBQESA-N 272.339 2.452 10 10 CECE O=C(c1cc(O)cs1)N1Cc2ccc(O)cc2C1 1301073837 OCHFAIKECYAURS-UHFFFAOYSA-N 261.302 2.315 10 10 CECE Oc1ccc(O)c2c1CCN[C@@H]2[C@H]1C[C@@H]2C=C[C@H]1C2 75799296 YJPZLBPIQYUCLJ-XPQXIITISA-N 257.333 2.497 10 10 CECE CN1CCCc2cc(CNCC(C)(C)CO)ccc21 135076890 KIBGVANQNFHRHW-UHFFFAOYSA-N 262.397 2.177 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 1885562391 FXLDRMKMKPKXIU-SNVBAGLBSA-N 297.359 2.155 10 10 CECE Oc1cc(F)ccc1[C@@H]1NCCc2cccc(O)c21 83659919 TUAGHFYFOPDROG-HNNXBMFYSA-N 259.280 2.472 10 10 CECE CCOc1cccc(CN2CCN(C)C[C@@H](C)C2)c1O 707530099 MTKVCJVYQCDDEL-CYBMUJFWSA-N 278.396 2.174 10 10 CECE CC1(C)SCCN(Cc2ccc(N)cc2)[C@H]1C(=O)O 1891310871 IEECPODOCQKBJI-LBPRGKRZSA-N 280.393 2.049 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@@H](O)C[C@H]2C3)cc1O 709838357 AIHBOKACMUDOGQ-OIMNJJJWSA-N 276.380 2.022 10 10 CECE CN(C)c1ccc(/C=C/CN[C@@H]2C=C[C@H](C(=O)O)C2)cc1 1334842199 UFCTUPUICJQLST-NMONBKHDSA-N 286.375 2.385 10 10 CECE C[C@@H](NCC[C@@H](O)C(F)(F)F)c1ccc(F)cc1O 717344176 BKNDBBHAUOPXLB-RDDDGLTNSA-N 281.249 2.495 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@H]2[C@H](O)C(C)(C)[C@H]21 693168015 SIWFXFDNWNPNQT-BPUTZDHNSA-N 274.408 2.439 10 10 CECE Cc1cc(CN)ccc1N1CCCC[C@H]1[C@H](C)CO 699938670 POUMNOMXEDXEGJ-HIFRSBDPSA-N 262.397 2.441 10 10 CECE CCN1CCC[C@@H]1CN(C)c1ccc(CN)c(C)c1 92633230 YVDYRPSREMNBJB-MRXNPFEDSA-N 261.413 2.374 10 10 CECE CN(c1ccc(N)cc1)[C@H]1CCO[C@]2(CCOC2)C1 94379206 ZFKPMKLAJTYSFJ-LSDHHAIUSA-N 262.353 2.043 10 10 CECE C[C@H](NCCC(=O)N1CCCC1)c1cc(F)ccc1O 94616871 UACXQNNCZOVGFO-NSHDSACASA-N 280.343 2.194 10 10 CECE Nc1ccc(CN2CCO[C@@H](c3nccs3)C2)cc1 1963537806 IFRVRBCSTDXVFJ-CYBMUJFWSA-N 275.377 2.299 10 10 CECE Nc1ccc(CN2CCC[C@H](n3cccn3)C2)cc1 1963537276 DEHCXURPLRVECN-HNNXBMFYSA-N 256.353 2.302 10 10 CECE Cc1ccc(CN2C[C@H]3CN(C)C[C@@]3(C)C2)c(O)c1 897619966 AOOYZCOQACSJSY-ZBFHGGJFSA-N 260.381 2.084 10 10 CECE CCN(CC)c1ccc(CN(C)C(=O)C2CC(=O)C2)cc1 1539309035 XVLLUKQPCRDYJG-UHFFFAOYSA-N 288.391 2.470 10 10 CECE C[C@H](N[C@H]1CCCC[C@@H]1C(N)=O)c1ccccc1O 2117474678 YLCLTZQSEWSRER-DRZSPHRISA-N 262.353 2.087 10 10 CECE Cc1cc2c(cc1N(C)C(C)(C)C(=O)O)OCCO2 258872732 UTHMQIXLWCACRJ-UHFFFAOYSA-N 265.309 2.066 10 10 CECE Oc1cc2c(cc1CN[C@H]1CCCC[C@@H]1F)OCO2 2118934483 BIACYDQGLWDXFF-QWRGUYRKSA-N 267.300 2.491 10 10 CECE O=C(N[C@H]1CC[C@H](CF)CC1)c1ccc(O)c(O)c1 2118427274 MJCPBYMYFTWCER-HOMQSWHASA-N 267.300 2.356 10 10 CECE Cc1cccnc1[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 1611700094 RBISUCYHMPVZJZ-SECBINFHSA-N 290.294 2.431 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2Cc1cncnc1 2122282923 HRKJXNXSEJYYOA-LLVKDONJSA-N 254.337 2.059 10 10 CECE Nc1c(Cl)cccc1C(=O)NCc1ccc(O)cc1O 1630307113 SGMHRYKURDRJBG-UHFFFAOYSA-N 292.722 2.263 10 10 CECE CC(=O)N1CCC[C@@H](CNCc2ccc(Cl)cc2O)C1 1657964430 GNBKFIGJRSSUTO-LBPRGKRZSA-N 296.798 2.394 10 10 CECE Cc1nnc(CCCNCc2cc(F)ccc2O)s1 1964606368 OMZQYPZGWSEFPX-UHFFFAOYSA-N 281.356 2.414 10 10 CECE C[C@H](NCCC(=O)N1CCCC1)c1ccccc1O 20127212 DOCBVYKKYKLXAI-LBPRGKRZSA-N 262.353 2.055 10 10 CECE C[C@]1(O)CCCN(c2ccc(CN)c(Cl)c2)C1 163009014 KWEWGEMJWHLBME-ZDUSSCGKSA-N 254.761 2.150 10 10 CECE CC1(C)C[C@@](NCCN=[N+]=[N-])(C(=O)O)c2ccccc2O1 163156594 MNZGFBUBWJKLKT-AWEZNQCLSA-N 290.323 2.428 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@](C)(O)C2)c(F)c1 163267233 ACPJTARGNUNYCJ-HZMBPMFUSA-N 252.333 2.197 10 10 CECE COCCN(CCO)c1ccc(CNCC(C)C)c(C)c1 164422025 DKPPOMQRKZMPGI-UHFFFAOYSA-N 294.439 2.186 10 10 CECE C[C@H](C(=O)O)C1CN([C@@H](C)c2cc(F)ccc2O)C1 165976064 YXETXIZLWODBAE-IUCAKERBSA-N 267.300 2.245 10 10 CECE CCCCC[C@@H]1C[C@@](C)(C2=N[C@H](N)[SH]=C2)OC1=O 252619610 LRAAPSPLINXXNS-ICCXJUOJSA-N 270.398 1.853 10 10 CECE CN(C)CCN1C(=O)/C(=C\c2ccccc2)SC1=S 1858596553 WCXIHQDAVXKMKH-ZRDIBKRKSA-N 292.429 2.449 10 10 CECE CN(C[C@@H]1CCCN1)c1ccc2c(c1)OCCCO2 258885736 KWIOWYRKDJVXKI-LBPRGKRZSA-N 262.353 2.036 10 10 CECE O[C@@H]1CCCc2cc(N3CCOC[C@@H]3CF)ccc21 2128278300 WUOAOWVTYNPWEY-DZGCQCFKSA-N 265.328 2.231 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@]4(CCO4)C3)ccc21 2128308579 GOOTWWGDHDIMOT-HOTGVXAUSA-N 258.365 2.263 10 10 CECE COC[C@]12C[C@H]1CN(c1ccc3c(c1)CC[C@H]3N)C2 2128300020 XEMVOXOOPVJXJO-APHBMKBZSA-N 258.365 2.105 10 10 CECE Cc1cc(CO)ccc1N1CCC[C@H](C2(O)CC2)C1 2130501527 IQXIJHWFTRQVAW-AWEZNQCLSA-N 261.365 2.229 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H]2CN3CC)cc1 2131055988 KTTZENZZEWDGKZ-HOTGVXAUSA-N 259.397 2.079 10 10 CECE CO[C@H]1CC[C@H]1CCN1CCc2cc(CN)ccc21 2133395711 LGDLKPQBIXDSQF-BBRMVZONSA-N 260.381 2.323 10 10 CECE CCNCc1ccc(N2C[C@H](OC)C[C@@H]2CF)cc1 2133711206 REMCULFKGDQEPS-HUUCEWRRSA-N 266.360 2.359 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H]3C[C@@H]32)c([N+](=O)[O-])c1 1912075385 PJKSOAVLKPFWMM-JQWIXIFHSA-N 274.276 2.291 10 10 CECE C[C@@H](N=[S@@](C)(=O)C(C)(C)C)C(=O)Nc1ccc(N)cc1 1913860703 FBLXRMWYNJXQJK-SBKAZYGRSA-N 297.424 2.492 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(Cc2nnc(-c3ccco3)o2)C1 1912189426 VDMHQXPLEIIIPX-VIFPVBQESA-N 274.284 2.462 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cc(F)cnc2Cl)C1 1912170840 CIIJAPMHJWEWGF-UHFFFAOYSA-N 255.640 2.009 10 10 CECE Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912191764 VWJDAUKHAWOCRE-VIFPVBQESA-N 275.268 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CECE CC[C@@H](NC)c1ccc(N2CC(=O)NCC2(C)C)cc1 2175723930 BLJFPZQWHQSDHW-CQSZACIVSA-N 275.396 2.072 10 10 CECE O=C(N[C@@H]1CC[C@H]1C1CCC1)c1cc(O)c(O)c(O)c1 2191878147 MJYSJVWEUBYUBO-WDEREUQCSA-N 277.320 2.112 10 10 CECE NCc1ccc(N2CCC3(CC[C@@H]3O)CC2)c(F)c1F 2187437184 QUNHFJYBGZDWLZ-LBPRGKRZSA-N 282.334 2.165 10 10 CECE O=C(O)C[C@@H]1C[C@H](NCc2c(O)cccc2Cl)CCO1 2187961085 PHJZKMFMKMHULQ-ZJUUUORDSA-N 299.754 2.158 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H]3C[C@@H]4CC[C@H](C3)N4)ccc21 2181704938 ZQRRIRUMFLKEFF-JYYAWHABSA-N 272.392 2.243 10 10 CECE C[C@H](NC(=O)[C@@H]1C[C@H]2CCC[C@H]2N1)c1ccccc1O 2192621559 DGZBEWUTDJWUGP-UNJBNNCHSA-N 274.364 2.100 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@H]3C[C@H]3C2)cc1[N+](=O)[O-] 2188572459 RRLGBTBGCJXELU-PHIMTYICSA-N 274.276 2.149 10 10 CECE Nc1cc2c(cc1N1CC[C@H]3CC[C@H]3C1)CCC(=O)N2 2188536999 LJBWMYHLGZWLCS-PWSUYJOCSA-N 271.364 2.390 10 10 CECE CN(c1ccc(CO)c([N+](=O)[O-])c1)[C@@H]1[C@H]2C[C@H]2[C@H]2C[C@H]21 2188575777 JRBZOLSCCXMMGF-NYEGDDQHSA-N 274.320 2.178 10 10 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CN[C@H]1CCc2cc(N3C[C@H](O)C4(CCC4)C3)ccc21 2184726387 JPOXHIPVGCZFLC-HOTGVXAUSA-N 272.392 2.245 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@@]12CC[C@@](C)(CO1)C2 2193702315 YLKPENUVXIQOLY-CVEARBPZSA-N 276.380 2.365 10 10 CECE [N-]=[N+]=NC1CCN(C[C@H]2COCCC2(F)F)CC1 2050900884 SLBLPQAAHNFBTH-VIFPVBQESA-N 260.288 2.433 10 10 CECE CC[C@@H](O)c1ccc(N2CC[S@@](=O)[C@@H](C)C2)cc1 2051901850 GSABFAWLUCGGTL-UCMVZMLTSA-N 267.394 2.087 10 10 CECE OCc1ccc(N2CCOC[C@H]2C(F)F)cc1Cl 2055450411 YKMXPVMJPYMHES-NSHDSACASA-N 277.698 2.303 10 10 CECE CN(Cc1cnsn1)c1cc(Cl)c(CN)cc1F 2057255331 YQVOHSLPBJKYPZ-UHFFFAOYSA-N 286.763 2.426 10 10 CECE COCCN(c1ccc([C@H](C)N)cc1)[C@H]1CCCOC1 2197182596 SSBHRBZOPAJTMW-BBRMVZONSA-N 278.396 2.338 10 10 CECE C[C@@H](N[C@H]1CC[C@H](NC(N)=O)CC1)c1ccccc1O 2186215014 CSZDGAIPJPBJDD-IJLUTSLNSA-N 277.368 2.022 10 10 CECE C[C@H](N[C@@H]1CCOC[C@H]1F)c1ccc(F)cc1O 2066723508 NIHOMOWCLKOIOU-XXILOJSOSA-N 257.280 2.309 10 10 CECE NC[C@H]1CC[C@H](CNC(=O)Nc2ccc(N)cc2)CC1 2191532693 YUGZRLZJIVDTCT-HAQNSBGRSA-N 276.384 2.155 10 10 CECE CCC(N)(CC)C(=O)N[C@H](C)c1ccccc1O 2072490557 NBVQRNBBCOVRHF-SNVBAGLBSA-N 250.342 2.087 10 10 CECE C[C@@H](N)c1ccc(N2CCCC[C@H]2C2(O)CC2)cc1O 2187039508 LGCZXIYMEIVXQA-ABAIWWIYSA-N 276.380 2.296 10 10 CECE COc1ccc(N2CCC[C@@H](N)[C@H]2C)c(F)c1F 2081859252 GNYDZXHHJMKZIX-RKDXNWHRSA-N 256.296 2.289 10 10 CECE CCC[C@@H](C(=O)O)N(C)[C@@H](C)c1ccc(O)cc1O 2102204279 YYKIYYXMDHXYPX-CABZTGNLSA-N 267.325 2.344 10 10 CECE C[C@@H]1C[C@@H](O)CCN(c2ccc([C@@H](C)O)c(O)c2)C1 2103308953 CXAYIAHBBDULGM-WZRBSPASSA-N 265.353 2.043 10 10 CECE OCc1ccc(N2CCC[C@@H]2c2nncs2)cc1 2084137213 DAEFVYSTXMVMEY-GFCCVEGCSA-N 261.350 2.372 10 10 CECE CC[C@@H]1CN(C)CCCN1Cc1c(O)cccc1F 2104476896 HUSSDEYBSGPDMR-GFCCVEGCSA-N 266.360 2.447 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])C1CC2(CCC2)C1 2105424503 GICIQLARXJQNEH-LBPRGKRZSA-N 266.345 2.398 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)OCCO3)CC[C@@H]1N 2106330479 CRUXEAOMNJZBOF-AAEUAGOBSA-N 262.353 2.021 10 10 CECE COc1ccc(N2C[C@@H](CN)C3(CCC3)C2)c(F)c1 2106393345 YHIAZIHRSWZIMD-LLVKDONJSA-N 264.344 2.400 10 10 CECE COc1cc(C)c(N2C[C@H]3CNC[C@@H](C3)C2)cc1C 2106393669 CBJWBQKZHXAGOZ-ZIAGYGMSSA-N 260.381 2.358 10 10 CECE CCN1CCc2cc([C@@]3(O)CNC(C)(C)C3)ccc21 2106799239 UBKHMZNDKGQNBQ-INIZCTEOSA-N 260.381 2.029 10 10 CECE CN(C)c1ccc(C2(N)C[C@@H]3CC[C@H](C2)N3C)cc1 2106790210 GCMGPSFHFYDBAA-XYPWUTKMSA-N 259.397 2.163 10 10 CECE CCc1nnsc1[C@@H](NC)c1ccc(N(C)C)cc1 2106806274 VJYXYFURJKDFDD-ZDUSSCGKSA-N 276.409 2.475 10 10 CECE CCN1CCc2cc([C@@H](O)C3CC(NC)C3)ccc21 2106800363 GWNGRYFTFCROAI-ZBCRRDGASA-N 260.381 2.100 10 10 CECE CC(=O)C(=O)[C@H](O)c1ccc(OC(F)(F)F)c(Cl)c1 2107099085 PWPDBSKQAUBXPH-SNVBAGLBSA-N 296.628 2.430 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@H]2NCC[C@@H]21 2087390254 RZJIFKTZPUQSGS-HONMWMINSA-N 264.344 2.419 10 10 CECE Oc1c(Cl)cccc1CN1CCO[C@H]2COCC[C@@H]21 2087483780 ILQUTEQHDVEEPM-STQMWFEESA-N 283.755 2.035 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@]3(C)C[C@H]2CO3)cc1O 2088393209 AXLWPIRCTJHRAA-ITDIGPHOSA-N 262.353 2.040 10 10 CECE Cc1ccc(O)c(CN2CCC(C)(C)[C@@H]2C(=O)O)c1 2088557805 NZAWEDMNJHZVCY-ZDUSSCGKSA-N 263.337 2.386 10 10 CECE CCO[C@@H]1C=CCN(C(=O)Nc2ccc(N)cc2)C1 2108783695 FUWZVBPOVKSFNA-CYBMUJFWSA-N 261.325 2.078 10 10 CECE COC[C@@]12C[C@@H]1CN(c1ccc([C@@H](C)N)cc1F)C2 2109177805 RLLXBCJBOGYQLY-HCKVZZMMSA-N 264.344 2.318 10 10 CECE CCN[C@@H](COC[C@@H]1CCOC1)c1ccccc1O 2090045760 RASFMPRWFLNQBK-OCCSQVGLSA-N 265.353 2.096 10 10 CECE Nc1ccc(CC(=O)NC2(C(F)(F)F)CCC2)cc1 2090343100 TVCSXJNBLMLFHL-UHFFFAOYSA-N 272.270 2.413 10 10 CECE FC1CC(COc2ccc(N3CCNCC3)cc2)C1 2092489269 RVPIZSWDIBEKNM-UHFFFAOYSA-N 264.344 2.223 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@H]2C(F)(F)F)cc1 2093977003 LGZGAKSPXWXQBS-CABZTGNLSA-N 274.286 2.474 10 10 CECE CCNCc1ccc(N2CC(N3CCC3)C2)cc1Cl 2095926631 AJLZQLXNCQAXMZ-UHFFFAOYSA-N 279.815 2.344 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1ncno1 2096081209 ZJIKJNUNXHTVSS-VHSXEESVSA-N 259.309 2.422 10 10 CECE CN(C[C@@H]1C=CCC1)c1ccc2c(c1)NC(=O)[C@H]2O 2096778874 SAIXYOWPYRFZAV-YGRLFVJLSA-N 258.321 2.075 10 10 CECE C[C@]1(CO)CCN1c1ccc(CNC2CC2)cc1F 2097238026 NPDLMMSREQZDDK-OAHLLOKOSA-N 264.344 2.039 10 10 CECE C[C@H](c1cc(O)ccc1O)N(C)[C@@H]1CCC[C@@H](N)C1 2099834826 ZIOXPONALWDIQH-IJLUTSLNSA-N 264.369 2.361 10 10 CECE Nc1ccc(CCN2CCC[C@]3(CCOC3)C2)cc1 2114692608 LRZQKHIVOIFMLJ-INIZCTEOSA-N 260.381 2.314 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)[C@@H]1CCCC[C@H]1F 2123005835 UNVDLJUYYJSDKK-GMTAPVOTSA-N 290.364 2.372 10 10 CECE CCNCc1ccc(N(CC)CC(C)(C)O)cc1OC 2204547712 KZUHQFRHGZBCAV-UHFFFAOYSA-N 280.412 2.402 10 10 CECE Cc1ccc(CN2O[C@@H]3CCC[C@H]3[C@@H]2C(=O)O)c(O)c1 2204634325 ACJGOOSENUUGHY-MRVWCRGKSA-N 277.320 2.070 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@@H]1[C@H]2[C@@H]3C[C@@H]4[C@H]([C@H]23)[C@@H]41 2208378881 XANSTIAHILSSPG-BJDCQQGGSA-N 276.330 2.370 10 10 CECE CC1(C)CO[C@H](C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2218742292 FQVVDIMZUSBCLG-GUBZILKMSA-N 252.318 2.149 10 10 CECE C[C@@H]1CCC[C@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])O1 2219727741 IOQCQUPXZLRWPR-OUAUKWLOSA-N 252.318 2.245 10 10 CECE COc1ccc(N2CC3CC2(CF)C3)c(CO)c1 2220429910 PQIGKKNYYAADIT-UHFFFAOYSA-N 251.301 2.126 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H](OC(F)F)C3)ccc21 2230668109 AQCXLZVZHYZOGC-YPMHNXCESA-N 269.291 2.484 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@@H](CCO)C(F)F 2232018544 VSSHGTMVNRVINO-GWCFXTLKSA-N 272.339 2.467 10 10 CECE Cc1cc([C@H](C)O)ccc1N(CCO)CC(F)(F)F 2232099278 XNRXVDZMTBFWAU-JTQLQIEISA-N 277.286 2.409 10 10 CECE N[C@H]1CCCc2cc(N3CC[C@H]4[C@H](C[C@H]4O)C3)ccc21 2232886884 GXEIPHSOIOYOIB-ISWURRPUSA-N 272.392 2.230 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[S@@](=O)[C@@H](C)C1 2223982902 HWQKDEYXRCJKIL-OAVHHTNSSA-N 267.394 2.006 10 10 CECE C[C@@H]1C[C@H](C(=O)O)[C@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2234171960 QALYLTLCDYFPGS-ZDCRXTMVSA-N 280.328 2.035 10 10 CECE O[C@@H]1CCN(c2ccc3c(c2)OCCCO3)[C@H]2CC[C@@H]21 2235130760 CSPBJIXRMZPPGZ-MELADBBJSA-N 275.348 2.198 10 10 CECE CS(=O)(=O)[C@@H]1CN(CCCCN=[N+]=[N-])C2(CCC2)C1 2225664310 TZPQWLIRVLDMHC-NSHDSACASA-N 286.401 2.119 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1C[C@@H]2CC[C@H](C1)O2 2225793295 VETWUURXESSXEL-KZZRWZIVSA-N 264.329 2.292 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)[C@@]12CCC[C@@H](C1)OC2 2225794167 CXEBGPIARVBNAZ-ZPFDUUQYSA-N 264.329 2.293 10 10 CECE COc1ccc(N(C)[C@@H]2CCCOC2)c(C[C@H](C)N)c1 2235974313 LAKJHDGODNIUSY-GXTWGEPZSA-N 278.396 2.200 10 10 CECE COc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]32)c(C=O)c1 2236005105 RKCJDBHSTYIITP-OSAQELSMSA-N 275.348 2.247 10 10 CECE COc1ccc(N2CC(F)(F)C[C@@]2(C)CO)cc1F 2226792800 LEQUQVYJXPWFHQ-LBPRGKRZSA-N 275.270 2.431 10 10 CECE CCCOc1ccc(N(C)[C@@](C)(CO)COC)cc1 2226766407 QRPXXYQPFSMVOB-HNNXBMFYSA-N 267.369 2.309 10 10 CECE CO[C@@]1(CO)CCCN(c2ccc3c(c2)CCC3)C1 2226753762 ZOZNPCODWOCKEF-INIZCTEOSA-N 261.365 2.153 10 10 CECE CCN(c1ccc2c(c1)OCCO2)[C@H]1CCC[C@@H]1O 2226777908 XKBOHZPILSBNHP-STQMWFEESA-N 263.337 2.198 10 10 CECE COc1ccc(N2[C@@H](CO)CCC2(C)C)cc1OC 2226807678 SDYNLPPNOFTDPT-GFCCVEGCSA-N 265.353 2.444 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@H]1CC[C@@H]1C(=O)O 2237213893 NSWIEKSPISXPSU-KGLIPLIRSA-N 274.364 2.009 10 10 CECE COc1ccc(N2CCC[C@@H](OC(F)F)C2)c(N)c1 2227411814 DKTHMKUXVSRESD-SNVBAGLBSA-N 272.295 2.485 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@]2(C)C=CCN2)cc1 2228767686 CNWOWSIYHAXGEK-HOTGVXAUSA-N 260.381 2.484 10 10 CECE CC(C)(C)[C@H]1CCC[C@](NCCN=[N+]=[N-])(C(N)=O)C1 2229847022 UTIMFPBDJOSAGP-GXFFZTMASA-N 267.377 2.347 10 10 CECE Oc1c(F)cccc1CNC[C@H](F)C1CCOCC1 2229956461 UPBDPVBITNJPDO-ZDUSSCGKSA-N 271.307 2.386 10 10 CECE CC[C@H](C)NCc1cc(OC)ccc1N(CC)CCO 2240065125 BWAPKSCYKHCHMA-ZDUSSCGKSA-N 280.412 2.402 10 10 CECE CCOC[C@@H]1CN(c2ccc([C@H](C)N)cc2C)CCO1 2240735611 PYQQZCQCOFLODQ-ZFWWWQNUSA-N 278.396 2.256 10 10 CECE Cc1cc([C@H](C)O)ccc1N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 2240829407 HTLJKHGZMKXIAX-LLBPEQMJSA-N 273.376 2.254 10 10 CECE Cc1cnc2c(C(=O)Cc3ccc(N)cc3)cnn2c1 2241191894 KBEFGVLPZVDFET-UHFFFAOYSA-N 266.304 2.045 10 10 CECE CCOC(=O)[C@H](CC)N(C)c1ccc(OC)cc1 2253405626 AJIYXMPYZRANON-ZDUSSCGKSA-N 251.326 2.473 10 10 CECE COc1cc(C)[nH]c(=NCc2cnc(SC)s2)n1 2256941820 IVEALWPCRSUJGC-UHFFFAOYSA-N 282.394 2.006 10 10 CECE COc1cc(OC)c(N2C[C@H](O)C[C@@H]2C)cc1Cl 2258048514 FWNJUMRZOPFJPH-DTWKUNHWSA-N 271.744 2.317 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cccc(Br)c2N)C1 2249924194 CSIXYRCJVKRXKF-UHFFFAOYSA-N 296.128 2.166 10 10 CECE COc1cc(OC)c(N2C[C@H](O)C[C@@H](F)C2)cc1Cl 2270379867 DYLZADMRNUITAR-RKDXNWHRSA-N 289.734 2.266 10 10 CECE COCCCC[S@](=O)CCCOc1ccc(N)cc1 2271826099 PVXCMBUDFPINGK-IBGZPJMESA-N 285.409 2.213 10 10 CECE NC(=O)c1cccc(F)c1NCc1ccc(N)cc1 2265763114 PFCAWRLSEYHTOB-UHFFFAOYSA-N 259.284 2.119 10 10 CECE CN(C)c1ccc2c(c1)OCCN2CC[C@@H]1CCO1 2278549773 KPJMEIHRLRHGGT-CYBMUJFWSA-N 262.353 2.130 10 10 CECE CSc1ncc(CNC(=O)C[C@@H]2CCNC2(C)C)s1 2269096742 XQQOYJJTRSZXBF-VIFPVBQESA-N 299.465 2.259 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H](CO)[C@@H]3C2)c(C)c1C 2269163700 FWDALCCWUZWXRL-BFHYXJOUSA-N 261.365 2.377 10 10 CECE COC[C@]1(C)C[C@H]1COC(=O)Cc1ccc(N)cc1 2269210605 AXWVGJQQRCFBED-WFASDCNBSA-N 263.337 2.027 10 10 CECE COC[C@@]1(C)C[C@H]1COC(=O)Cc1ccc(N)cc1 2269210604 AXWVGJQQRCFBED-SWLSCSKDSA-N 263.337 2.027 10 10 CECE Cc1cc(N(C)CC2COCCOC2)ccc1[C@H](C)O 2285177167 QWNBDJZGNQEGLW-ZDUSSCGKSA-N 279.380 2.148 10 10 CECE Cc1cc(N(C)C[C@@H]2OCCO[C@@H]2C)ccc1[C@H](C)N 2285125423 BZPXPMXBMZFVDW-ZENOOKHLSA-N 278.396 2.255 10 10 CECE Cc1cc(N2CCC[C@H]2C(=O)N(C)C)ccc1[C@H](C)N 2285144218 QDROYSCDJKPWMJ-WFASDCNBSA-N 275.396 2.072 10 10 CECE CO[C@]1(CN(C)c2ccc([C@@H](C)O)c(C)c2)CCOC1 2285160100 ZTSOEWRHZLXUJH-CJNGLKHVSA-N 279.380 2.290 10 10 CECE C[C@]1(O)CCN(c2ccc(OC(F)F)cc2)C[C@@]1(C)O 2295977512 JAQBWDSHXDVNSH-UONOGXRCSA-N 287.306 2.000 10 10 CECE COC[C@@H]1C[C@H](CN)N(c2ccc(OC(F)F)cc2)C1 2295933419 SAEGXPFKOCWHAH-ZYHUDNBSSA-N 286.322 2.088 10 10 CECE Cc1ccc(C=C2C(=O)NC(=O)N(c3ccccc3)C2=O)o1 2296740104 DAIAJSOQDQWBAR-UHFFFAOYSA-N 296.282 2.254 10 10 CECE Cc1ccc(/C=C/C(=O)N2CCOc3ccncc32)cn1 492499655 HCPCSJGDKBOPCE-SNAWJCMRSA-N 281.315 2.224 10 10 CECE Cc1ccc(CN2C[C@@H]3C[C@H]2CO3)c(O)c1Br 2307569272 HSTVCAZWNSOVSS-QWRGUYRKSA-N 298.180 2.436 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)Nc1ccc2nn[nH]c2c1 2308001826 SMDRPLWZPIVBNE-UHFFFAOYSA-N 296.286 2.021 10 10 CECE CN1C[C@@](Sc2nccs2)(C(=O)O)CC1(C)C 2306965461 TZZDRLZMZVJLHN-LLVKDONJSA-N 272.395 2.173 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)c(Cl)c1 2311886406 HBCNNLQHIWVREP-AEHQLWAISA-N 266.772 2.177 10 10 CECE NCc1ccc(N2C[C@H]3CC[C@H]2C[C@@H]3O)cc1Cl 2315480237 KAZSDRGCFRCIRL-OSMZGAPFSA-N 266.772 2.148 10 10 CECE CO[C@@H]1C[C@H]2C[C@H]1CN2Cc1c(O)cccc1F 2318342364 XLNZJAHTZGKMPJ-IMSIIYSGSA-N 251.301 2.141 10 10 CECE CNCc1ccc(N(C)[C@H](CO)C(C)C)cc1C 2318849215 NGRJVVHORUYARV-OAHLLOKOSA-N 250.386 2.168 10 10 CECE CSc1cc(N2C[C@H](O)CC2(C)C)ccc1CN 2328537441 YGQTYBALAHYETB-GFCCVEGCSA-N 266.410 2.217 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CC[C@@H]2[C@H](C1)C2(F)F 2329717484 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2.438 10 10 CECE CSc1ncc(CNC(=O)c2cc(O)ccc2N)s1 2269124033 MVDKWZKKECRCAU-UHFFFAOYSA-N 295.389 2.083 10 10 CECE COc1ccc(N2CC[C@H](N)[C@@H](C)C2)c2c1CCC2 2269168262 NELHJLDHJAXZAH-FZMZJTMJSA-N 260.381 2.357 10 10 CECE Oc1ccc(CNC[C@H]2COC3(CCC3)C2)cc1O 2269325984 TYUHGWYNWMELQS-LBPRGKRZSA-N 263.337 2.147 10 10 CECE CC(C)c1ncc(N)c(OCCc2ccc(N)cc2)n1 2281200413 RHNHQWYKYSPQPB-UHFFFAOYSA-N 272.352 2.386 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1C 2285122555 UPTZKOCPXVQIMR-VBQJREDUSA-N 274.408 2.484 10 10 CECE Cc1cc(N2CCO[C@H]3COCC[C@H]32)ccc1[C@@H](C)N 2285126494 ZVOBULATMUSXQH-WQVCFCJDSA-N 276.380 2.009 10 10 CECE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccoc3)C2=O)cc1 2296374292 SBMGYJWFXRUVER-UHFFFAOYSA-N 296.282 2.254 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@]3(C)O)c(F)c1 2286197082 JACWZFLATPMQEK-CNXAATOLSA-N 278.371 2.313 10 10 CECE C[C@H]1CCN[C@H]1CSCCC(=O)Nc1ccc(N)cc1 2288848809 ISIDMCVTIUKCKG-FZMZJTMJSA-N 293.436 2.329 10 10 CECE O=C1NC(=S)SC1=CC=Cc1ccc([N+](=O)[O-])o1 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10 10 CECE COc1cccc(CNCc2nc(C)ccc2O)c1O 265089061 MFUGROVVGOYBTA-UHFFFAOYSA-N 274.320 2.100 10 10 CECE CC[C@H]1CN(Cc2cc(F)ccc2O)C[C@]2(CCOC2)O1 376635525 WYFYEAXGEKGHOA-HOCLYGCPSA-N 295.354 2.301 10 10 CECE COC1(C)CN(c2ccc(/C=C/C(=O)O)cc2F)C1 382944242 AYDAQGYGLFWIQV-GQCTYLIASA-N 265.284 2.149 10 10 CECE COc1cccc(CNC(=O)[C@H]2CCCC[C@H]2OC)c1O 293702451 MUQZRWMKPVGBEQ-QWHCGFSZSA-N 293.363 2.222 10 10 CECE CC(C)C[C@@H](CO)N(C)Cc1cc(F)ccc1O 290551225 RUTWCPZXOFXQMW-ZDUSSCGKSA-N 255.333 2.370 10 10 CECE Nc1ccc(NC(=O)N2[C@H](CO)C[C@H]3CCC[C@@H]32)cc1 2164843863 XREOMUGFRRDOCG-SWHYSGLUSA-N 275.352 2.036 10 10 CECE c1cc2c(cc1N1CCO[C@@]3(CCNC3)C1)CCCC2 2162671077 CPKPLIYVUVMSML-QGZVFWFLSA-N 272.392 2.134 10 10 CECE CN(C(=O)CCC(=O)OC(C)(C)C)c1ccc(N)cc1 2162709245 SEHBMPQUPHTDNL-UHFFFAOYSA-N 278.352 2.354 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CNCC34CC4)ccc21 2163064975 ZPXIXYAMPJXFGL-HOCLYGCPSA-N 272.392 2.102 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H]3CCNC34CC4)ccc21 2163067177 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10 10 CECE C[C@H]1CN[C@](C)(c2cc(Cl)cc(F)c2O)CO1 83433300 VCOMOHVLZCDSKM-MADCSZMMSA-N 259.708 2.408 10 10 CECE Oc1cc(O)c2c(c1)[C@H](c1c(O)cccc1F)NCC2 83666636 XHYRSBBHVQHVCB-OAHLLOKOSA-N 275.279 2.178 10 10 CECE O=C(NCCOCc1ccccc1)c1ccc(O)c(O)c1 390353379 CKQPOFAXLJJPGJ-UHFFFAOYSA-N 287.315 2.044 10 10 CECE CC[C@@H](O)[C@@H](C)NCc1ccc(Br)cc1O 691478098 VPZUILWIHFQUBK-LDYMZIIASA-N 288.185 2.404 10 10 CECE C[C@H]1CCCCN(c2ccc3c(c2)NC(=O)[C@@H]3O)C1 703660048 DYOMLYOLPCFCBW-IINYFYTJSA-N 260.337 2.299 10 10 CECE CSC[C@H]1CCN(c2ccc(CN)cc2F)C1 706656018 FZXMIWDHFCZRKW-NSHDSACASA-N 254.374 2.474 10 10 CECE Cc1cccc(CNCCO[C@H]2CC2(F)F)c1O 690726778 YSFMCVZYPNLPMF-NSHDSACASA-N 257.280 2.214 10 10 CECE C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2c1ccc(CN)c(F)c1F 686170834 HIYBEQMWMJCEMX-VUXODMRMSA-N 282.334 2.162 10 10 CECE CO[C@H](CNC(=O)Nc1ccc(N)cc1)C1CCC1 692144620 JYXUSFLHTBAGNL-CYBMUJFWSA-N 263.341 2.205 10 10 CECE COc1nscc1[C@@H](O)c1ccc2c(c1)CCN2C 712853770 NKCLUNRFHXYIPD-ZDUSSCGKSA-N 276.361 2.226 10 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264.325 2.035 10 10 CECE Cc1cc(Br)c(O)c(CNCC2COC2)c1 527816583 FTFAGIAIXVWSRN-UHFFFAOYSA-N 286.169 2.199 10 10 CECE Cc1ccc(CN2CC[C@@H]3NCCC[C@@H]3C2)c(O)c1 1237407158 WURMQHDWUJMXES-HIFRSBDPSA-N 260.381 2.275 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ncoc1C(F)(F)F 2337778332 VEFUNQPNOXBDMA-UHFFFAOYSA-N 277.206 2.466 10 10 CECE Cc1ccc(-c2cn3c(n2)[C@H](C(=O)O)CCC3)n1C 606596886 LFLPZILXOQFTNH-SNVBAGLBSA-N 259.309 2.159 10 10 CECE C[C@@H]1CN(c2ccc(/C=C/C(=O)O)cc2)C[C@H]1N(C)C 251715030 JPZMBBACQATVGC-OHEJIBKASA-N 274.364 2.171 10 10 CECE CNC[C@H]1CCN(C)[C@H]1c1ccc2c(c1)CCCN2C 250719621 HVQWKBREOYPQBH-WBVHZDCISA-N 273.424 2.281 10 10 CECE Nc1oncc1-c1cc(O)c(O)c(Br)c1 258549195 QWOWVRGLYJFJNO-UHFFFAOYSA-N 271.070 2.098 10 10 CECE Cc1cc(N2C[C@@H](CO)[C@@H](C(F)(F)F)C2)ccc1CN 2163292927 XAOZUBSTFXERFX-AAEUAGOBSA-N 288.313 2.061 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2C[C@H](CO)[C@H]3C[C@H]32)c1O 2166860544 ACKZDLBWKABFTF-OJAKKHQRSA-N 297.782 2.161 10 10 CECE CN(C[C@@H]1CC12CC2)c1cc2c(cc1N)NC(=O)CC2 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2.122 10 10 CECE CCNC[C@@H]1CCN(Cc2cnc(SC)s2)C1 2248739866 KZZZKORLXWAYTK-JTQLQIEISA-N 271.455 2.296 10 10 CECE O=C(/C=C/c1cncc(O)c1)N1CCCc2cccc(O)c21 182173652 BGOUGSJXQRBCTQ-VOTSOKGWSA-N 296.326 2.485 10 10 CECE O=C(NCc1ccc(O)cc1O)c1cncc(Cl)c1 1451770189 PVOUPLPOKBBTRW-UHFFFAOYSA-N 278.695 2.076 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@H](CF)C2)c(F)c1 2115423183 OQBWNGSVNTZDDP-CMPLNLGQSA-N 270.323 2.281 10 10 CECE C[C@H](NCc1ccc(O)c(O)c1O)[C@]1(C)CC1(F)F 2116106188 UXSRNUQDQLZWBX-MADCSZMMSA-N 273.279 2.327 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@H]1C[P@@](C)(=O)C[C@H]1O 2116376346 NMDVDDCHNJWVLT-ZRXDBEOPSA-N 283.308 2.121 10 10 CECE C[C@H]1COCC[C@@H]1NC(=O)c1ccc(N=NC(N)=O)cc1 1466855265 GALWMTKKKFRBQM-CABZTGNLSA-N 290.323 2.004 10 10 CECE CCN1CCc2cc([C@]3(O)C=C[C@H](OC)C3)ccc21 2119416406 FEQAYOMYOHBNOF-HOCLYGCPSA-N 259.349 2.232 10 10 CECE CCN(CC)c1ccc([C@@H](CC2COC2)NN)cc1 2120025623 KJVKVOIXBYKAPE-OAHLLOKOSA-N 263.385 2.074 10 10 CECE Cc1csc(CNC(=O)Cc2ccc(O)c(O)c2)c1 1628003868 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C[C@H](O)c1ccc(N2CC[C@H]3OCCC[C@H]3C2)cc1O 2170322445 DTYREOMMQSIZHA-MQIPJXDCSA-N 277.364 2.451 10 10 CECE CCSC[C@H](C)NCCc1ccc(O)c(O)c1 1173286876 DEZXURDNXFAPBR-JTQLQIEISA-N 255.383 2.372 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C[C@H]3C[C@@H]3F)c(Cl)cc21 2188322902 AAQGLYPOXJXDJQ-IDALBHDPSA-N 297.761 2.347 10 10 CECE COc1cc(N2C[C@H](N)CC[C@H]2C)cc(OC)c1OC 2181953954 ZSYDWPYVGJFVPH-GHMZBOCLSA-N 280.368 2.028 10 10 CECE Cc1nc(N(C)[C@@H](C)c2ccccc2O)ncc1CO 2192601123 UVSMTVRXLJWICQ-NSHDSACASA-N 273.336 2.180 10 10 CECE CN(Cc1ccc(Cl)o1)C(=O)c1cc(O)c(O)c(O)c1 2188924760 RYYIQNLUTDFVHP-UHFFFAOYSA-N 297.694 2.322 10 10 CECE Nc1ccc(CS(=O)(=O)NC[C@H]2C[C@@H]3CC[C@@H]3C2)cc1 2189017808 XWBAIHATUPXVIK-ZSOGYDGISA-N 294.420 2.124 10 10 CECE C[C@@H](O)c1ccc(N2[C@@H]3COC[C@H]2C3)c(Cl)c1 1910353416 XAUFMWQBZKDZFJ-IEBDPFPHSA-N 253.729 2.371 10 10 CECE COc1ccc(N2C[C@@H](N)CCC23CCOCC3)cc1 2193488482 PYPDGEIBTIXOGF-ZDUSSCGKSA-N 276.380 2.172 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@H]4COC[C@H]4C3)ccc21 2184693268 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C[C@H](N)c1ccc(N(C)C[C@@H]2OCC[C@@H]2F)cc1 2058680384 OVVHHPUSOLMBNV-BPNCWPANSA-N 252.333 2.270 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3C[C@H](CO)[C@@H]3C2)c(F)c1 2194524604 QGRBNRPCHUKCBO-OHBODLIOSA-N 283.318 2.083 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)c1ncccc1Cl 2107073044 XOUQXJAELRXCAP-TZMCWYRMSA-N 278.739 2.435 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2CCOC3(CCC3)C2)cc1 2197381743 LPWUFJFUTPQLPT-CYBMUJFWSA-N 275.352 2.492 10 10 CECE CO[C@@H]1CC[C@H]1CCNCc1cccc(F)c1O 2066826575 LCTMDEVRSVGNSB-GXFFZTMASA-N 253.317 2.436 10 10 CECE CO[C@H]1CC[C@H]1CCNCc1ccc(O)c(O)c1 2066818362 MQXYTYHBESNZDX-FZMZJTMJSA-N 251.326 2.003 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@H](F)[C@@H](OC)C2)c(F)c1 2194699665 JXEDZKAEMTUURR-JCOFBHIZSA-N 288.313 2.418 10 10 CECE CO[C@@H]1C[C@@H]1CN(C)[C@@H](C)c1cc(O)ccc1O 2067884243 PAMNOPAQBBNABA-IMSIIYSGSA-N 251.326 2.126 10 10 CECE C[C@H](NC(=O)Cc1ccc(N)cc1)c1ccc(N)cc1 2191748745 YZFONSGYXNRMKQ-NSHDSACASA-N 269.348 2.271 10 10 CECE COc1ccc(CNC[C@H]2C[C@]23CCCOC3)c(O)c1 2198148866 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2.497 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCCNC(=O)C1(C)C 2240741715 BKTHIEOMTBQXOD-GFCCVEGCSA-N 275.396 2.120 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCOCCOC)c(C)c1 2240824936 SNMVXGXLWALROH-AWEZNQCLSA-N 280.412 2.375 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)CCc1cnn(C)c1 2240835182 HKRVNYPKNVZGBE-ZDUSSCGKSA-N 273.380 2.461 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)c(C)c1 2240828062 AMCNYORXTFOLSZ-HNKHHVNMSA-N 274.408 2.483 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCCC[C@H]1CC(N)=O 2240829675 NEDXYTWSZKJBRE-JSGCOSHPSA-N 275.396 2.249 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCC[C@@H]1CS(C)(=O)=O 2240829872 KRWMHORMIPOVLQ-GXTWGEPZSA-N 297.420 2.062 10 10 CECE CSc1ncc(CN[C@@H](C)[C@@H](N)C(C)C)s1 2243833756 WUJVYQWGWQBHRL-WPRPVWTQSA-N 259.444 2.326 10 10 CECE CN(Cc1nncs1)c1ccc2c(c1)CC[C@H]2N 2255263836 LQIUNCTUZPXWOP-GFCCVEGCSA-N 260.366 2.121 10 10 CECE CCS(=O)(=O)[C@@H]1CCN(c2ccc([C@H](C)O)c(C)c2)C1 2285165173 FHZKSEVCMPKUPA-GXTWGEPZSA-N 297.420 2.062 10 10 CECE CN[C@@H](C)c1ccc(N(C)CC[S@@](C)=O)cc1C 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CETJJZYECSUVNC-CZUORRHYSA-N 276.380 2.172 10 10 CECE CO[C@H]1C[C@@H](CN)N(c2ccc(OC3CCC3)cc2)C1 2162660072 WVAZUYQXOSAPCY-BBRMVZONSA-N 276.380 2.170 10 10 CECE Nc1ccc(O)c(CN2CCC[C@@]3(CO)CCC[C@H]23)c1 2165250509 QQLVEUZJOHNELE-JKSUJKDBSA-N 276.380 2.101 10 10 CECE COc1cc(CN2CC[C@H](CN=[N+]=[N-])C2)cc(OC)n1 2167086995 HWCCLFYJCWVVGW-SNVBAGLBSA-N 277.328 2.231 10 10 CECE CN1CCC[C@@H](C[C@H](O)c2ccc3c(c2)CCN3C)C1 2163062418 LZSOSEMYPGRMCA-GUYCJALGSA-N 274.408 2.444 10 10 CECE CN1CCCc2cc([C@@H](O)C3CC4(CCN4)C3)ccc21 2163095835 DZFLMXHCSBBFLB-ARWYELJZSA-N 272.392 2.245 10 10 CECE CN1CCC[C@H](C[C@@H](N)c2ccc3c(c2)CCN3C)C1 2163139901 ZXQSRHAUGHMZHL-CZUORRHYSA-N 273.424 2.411 10 10 CECE CCNCc1ccc(N2C[C@H](OC)C[C@@H](OC)C2)cc1 2165506213 IBLONHAXDJOJRC-HZPDHXFCSA-N 278.396 2.036 10 10 CECE Cc1cc(O)c(CN2CC[C@H]3CN(C)C[C@H]32)cc1C 814172922 DDXHQBJMVBGIRQ-DZGCQCFKSA-N 260.381 2.145 10 10 CECE Cc1cccc(CN2CCC[C@@H](C)[C@H]2C(=O)O)c1O 818631911 VPTCTSVPGQUPNU-MFKMUULPSA-N 263.337 2.386 10 10 CECE CN1N=C(C(F)(F)F)/C(=C/c2ccc(C(=O)O)cc2)C1=O 1865675438 HSAOAQCFMMCSIU-TWGQIWQCSA-N 298.220 2.159 10 10 CECE COC(=O)[C@@](C)(CCF)NCc1cccc(C)c1O 827352886 SHOGGZJZCDNIHK-CQSZACIVSA-N 269.316 2.082 10 10 CECE CNCc1ccc(N2CC(OC)(C(F)(F)F)C2)c(C)c1 724153025 OAQXMCPQGUPELS-UHFFFAOYSA-N 288.313 2.482 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](CC(N)=O)C2)c(Cl)c1 723160476 XLPHRRLSADTQCG-UWVGGRQHSA-N 281.787 2.061 10 10 CECE CN(C)c1ccc(/C=C/CN(CCO)CC(F)F)cc1 835055331 YDULEHBILXZDCS-ONEGZZNKSA-N 284.350 2.325 10 10 CECE C[C@@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)[C@@H]1CO 835046024 QIBGPDRSTPWOIH-AYUWKEHRSA-N 274.408 2.469 10 10 CECE Cc1cc(O)c(CNCC2([S@](C)=O)CC2)c(Cl)c1 840942418 LNCDRDLEBVZSMB-SFHVURJKSA-N 287.812 2.355 10 10 CECE COc1ccc(N(C)CCN(C)Cc2n[nH]cc2C)cc1 846051056 BEGPSDPJDGTGLD-UHFFFAOYSA-N 288.395 2.295 10 10 CECE Cc1cc(Cl)cc(CN2CCC[C@@H]2C(=O)O)c1O 840995636 AALVHKZGEMRQGV-LLVKDONJSA-N 269.728 2.403 10 10 CECE CCOc1ccc(O)c(CNC[C@H](C(=O)O)C(C)C)c1 848639289 GNSUURNEJLNFQY-ZDUSSCGKSA-N 281.352 2.237 10 10 CECE COc1ccc2c(c1)CCN2Cc1cc(C)nn1C 841829811 LLDDHLQCSVYQPP-UHFFFAOYSA-N 257.337 2.300 10 10 CECE CCN(CCN(C)C)c1ccc(/C=C/C(=O)O)cc1 688291452 GOLFWDIACDQGLT-JXMROGBWSA-N 262.353 2.172 10 10 CECE Cc1cc(Cl)cc(CNCC[C@@]2(O)CCCOC2)c1O 846107355 HVGVYJYGUANYQU-HNNXBMFYSA-N 299.798 2.375 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C[C@@]1(C)CCNC1 843059154 DXAXAOCFMKFDEN-INIZCTEOSA-N 261.413 2.184 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C[C@H](N)C(F)(F)F 699113819 GYLHAGUEIGZOIS-KWQFWETISA-N 290.285 2.191 10 10 CECE C[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@@](C)(C(F)F)O1 856480221 CRQVPMZTJFILIX-KRTXAFLBSA-N 291.319 2.338 10 10 CECE CC1(O)CCN(Cc2cc3c(cc2O)CCC3)CC1 759748217 VILRCGOATJEEBT-UHFFFAOYSA-N 261.365 2.228 10 10 CECE C[C@@H](CNC(=O)CCOc1ccc(N)cc1)C(F)(F)F 697730462 MGPBJFAOUFYPLD-VIFPVBQESA-N 290.285 2.352 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2C[C@@H]2C)c1 756456340 OHGYWIZEZGGXAZ-JBLDHEPKSA-N 263.337 2.485 10 10 CECE Oc1ccc(CNC2C[C@H]3CC[C@H](C2)C3)c(O)c1O 697913321 NJWCANNBDKZKRY-UWVGGRQHSA-N 263.337 2.472 10 10 CECE C[C@@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)Nc1ccc(N)cc1 868162256 GLPTVPBHTJUCGI-ZWKOPEQDSA-N 273.336 2.243 10 10 CECE CCc1nocc1C(=O)N1Cc2cccc(O)c2C1 871206272 XTULFBITPQKTJX-UHFFFAOYSA-N 258.277 2.099 10 10 CECE CCOc1ccccc1NC[C@H](O)C[C@@](C)(O)C1CC1 872210072 IFWRBNVQDQKFLR-CZUORRHYSA-N 279.380 2.409 10 10 CECE COc1ccc(O)c([C@H](C)NCc2ncc(C)cn2)c1 775376307 SJBMTMNABJLASH-NSHDSACASA-N 273.336 2.350 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Cl)CC[C@H]1O 779199546 DZALXAZLAWQBBJ-JOYOIKCWSA-N 255.745 2.248 10 10 CECE CN(C)c1ccc(CNCC2(CCO)CC2)cc1F 778215978 HQTWOQKXFPPXKE-UHFFFAOYSA-N 266.360 2.144 10 10 CECE Oc1ccc(F)cc1CN1CCN[C@H](CC(F)(F)F)C1 1875761030 GYXJZZTVMFUTIJ-LLVKDONJSA-N 292.276 2.258 10 10 CECE CCOc1cccc(CN[C@H]2C[C@]23CCOC3)c1O 1896292911 NRUPFSPNLBAUCD-ZFWWWQNUSA-N 263.337 2.060 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3COCC[C@H]32)cc1 1878807093 PLJWUOBKOPQSSW-GDBMZVCRSA-N 260.381 2.410 10 10 CECE COc1ccc(O)c(CN2CC[C@@H]([C@H]3CCCO3)C2)c1 895844967 GGPKRYXAEGYLJA-MLGOLLRUSA-N 277.364 2.402 10 10 CECE CCCNCc1ccc(N(C)C[C@H](C)O)c(C)c1 51839104 VRXTYMVPJYWJLE-ZDUSSCGKSA-N 250.386 2.312 10 10 CECE C[C@@](CO)(NCc1cccc(O)c1O)c1ccccc1 134318911 KCFFIALLUQMOIO-INIZCTEOSA-N 273.332 2.095 10 10 CECE CC[C@H](COC)N1CCN(c2ccc(OC)cc2)CC1 1963176596 LSZOFQDAXXBTSE-CQSZACIVSA-N 278.396 2.242 10 10 CECE CCC[C@H](N[C@H](C)c1cc(O)ccc1O)C(=O)O 86733154 NOFQODHKCIGEIL-KCJUWKMLSA-N 253.298 2.002 10 10 CECE CCC[C@@H](N[C@H](C)c1cc(OC)ccc1O)C(=O)O 86733282 CWURDQLOAODZQP-BXKDBHETSA-N 267.325 2.305 10 10 CECE CC[C@@]1(c2cc(N)cc(C)c2O)COC(C)(C)CN1 83479724 IOUQLLVCFBRSCN-HNNXBMFYSA-N 264.369 2.287 10 10 CECE O=C(O)c1ccc([C@@H]2NCCc3cccc(O)c32)cc1 83594441 LDMRCBDZJWIZIW-HNNXBMFYSA-N 269.300 2.326 10 10 CECE Oc1ccc(O)c2c1CCN[C@@H]2c1cccc(F)c1 83657807 UGHGWWAEVRHCCM-OAHLLOKOSA-N 259.280 2.472 10 10 CECE C[C@@H]1C[C@H](N)CN1Cc1ccc(Br)cc1O 702647927 DPJIAVBACCPTSL-KCJUWKMLSA-N 285.185 2.076 10 10 CECE C[C@@H](O)c1ccc(N2CC(OCC(F)(F)F)C2)cc1O 708264668 LOBGRVBARFMHCG-MRVPVSSYSA-N 291.269 2.213 10 10 CECE Cc1conc1CNCc1ccc(F)c(F)c1O 708273837 HFAWIYNHBZLHNR-UHFFFAOYSA-N 254.236 2.257 10 10 CECE Cc1cnc(CN[C@H](C)c2ccc(O)cc2O)cn1 61320184 AXSTUZNHXYXCCQ-SNVBAGLBSA-N 259.309 2.047 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CCCSCC1 709528097 HHALACVUOXWHBA-SNVBAGLBSA-N 258.347 2.017 10 10 CECE C[C@H](Sc1cccnn1)C(=O)Nc1ccc(N)cc1 711698880 QENOBLHVFKWXPF-VIFPVBQESA-N 274.349 2.178 10 10 CECE C[C@H]1CCC[C@@H]1N(C)c1cc2c(cc1N)OCC(=O)N2 690916402 AAIUKJYYWFLDEX-CABZTGNLSA-N 275.352 2.225 10 10 CECE O=C(N[C@H](C(F)F)C1CCC1)c1ccc(O)c(O)c1 1893187487 HEJQQUWJHGNJPV-NSHDSACASA-N 271.263 2.261 10 10 CECE CC[C@@H]1C[C@H](N[C@@H](C)c2c(O)cccc2O)CO1 688491570 ZFTUNFILHLKNLM-GARJFASQSA-N 251.326 2.316 10 10 CECE C[C@H]1[C@@H](NCc2ccc(N3CCCC3)cc2)CCN1C 719578815 VKTONSHWTONGLX-YOEHRIQHSA-N 273.424 2.469 10 10 CECE CCCN(Cc1ccc(N)cc1)[C@H](CC)C(=O)OC 695047096 DJMMFBMEWCGPOB-CQSZACIVSA-N 264.369 2.432 10 10 CECE CC(C)[C@H]1CN(c2ccc3c(c2)OCCCO3)CCN1 86122732 VMPRZYVTPDSUFX-CQSZACIVSA-N 276.380 2.282 10 10 CECE CN1CCCc2cc(CN[C@@H](C(=O)O)C3CC3)ccc21 86758256 STCKKEQLWXHYGC-OAHLLOKOSA-N 274.364 2.022 10 10 CECE Nc1ccc(CC(=O)OCCC[C@H]2CCCO2)cc1 87273118 GSGNUCSWBSXXOV-CQSZACIVSA-N 263.337 2.314 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cnc(F)c(F)c1 1963731870 BXIWSIBASSROLV-UHFFFAOYSA-N 255.228 2.180 10 10 CECE Oc1ccccc1CN=c1[nH]c(Cl)nc2c1CCC2 1963899990 JLSFGAWUAVVFAV-UHFFFAOYSA-N 275.739 2.358 10 10 CECE [N-]=[N+]=NCCCCN1CCO[C@H]([C@H]2CCCCO2)C1 2115083804 NIDISWBFXYQMFZ-OLZOCXBDSA-N 268.361 2.347 10 10 CECE Oc1cc(F)c(Cl)cc1CNCCn1ccnc1 294202765 KWZAUJJPCXIDAW-UHFFFAOYSA-N 269.707 2.171 10 10 CECE CC[C@@H](N)CN(CC)Cc1ccc2c(c1)CCN2C 2116684960 FNZJGFZHFFZPOF-OAHLLOKOSA-N 261.413 2.238 10 10 CECE Oc1ccc2ccccc2c1CN1C[C@@H]2C[C@H](C1)N2 2117059080 SXUZHNHIGFDNLR-BETUJISGSA-N 254.333 2.092 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)c(Cl)c1 2117691078 VDPUKYJIPGFVOH-IXOXFDKPSA-N 281.783 2.458 10 10 CECE NC[C@@H]1CN(c2ccncc2F)Cc2ccccc21 2119636187 ZRZOSJZVIXHTOC-GFCCVEGCSA-N 257.312 2.283 10 10 CECE CC1(C)CNCC(C)(C)N1c1ccc2c(c1)OCO2 216845323 RABIMLMLZVYSHP-UHFFFAOYSA-N 262.353 2.382 10 10 CECE CO[C@@H]1COC[C@H]1N(C)[C@H](C)c1cc(Cl)ccc1O 2120779159 INPGFJOZOPCAPX-GAJTVXKRSA-N 285.771 2.452 10 10 CECE CC(C)(C(=O)NCc1c(O)cccc1O)[C@@H]1CCCCO1 1558534996 AUDLBGWCGSPYRT-AWEZNQCLSA-N 293.363 2.309 10 10 CECE Oc1cccc(F)c1CNC12CCC(O)(CC1)CC2 2121282032 DYXPCWVZOFFZOW-UHFFFAOYSA-N 265.328 2.459 10 10 CECE CN(C)CCCCN(C)c1c(F)cc(CN)cc1F 2121429904 WZILGIQDFKHZLW-UHFFFAOYSA-N 271.355 2.202 10 10 CECE C[C@H]1CCCCN1NC(=O)c1ccc(N=NC(N)=O)cc1 1631574842 SHQKDUPGXBDTIN-JTQLQIEISA-N 289.339 2.368 10 10 CECE C=C/C=C\CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1567467780 RJHCLOHBIUBHIO-DOGVGXBMSA-N 261.321 2.277 10 10 CECE CCc1ncc(Cl)c(C(=O)NCc2ccccc2O)n1 1595799964 LUUYEWGKCBEKOJ-UHFFFAOYSA-N 291.738 2.328 10 10 CECE C[C@H](NCCCOC(=O)N(C)C)c1ccc(F)cc1O 1964506705 PTXMXBDNOZKROE-JTQLQIEISA-N 284.331 2.270 10 10 CECE CC1(C)CCN(Cc2ccc(F)cc2O)[C@@H]1C(=O)O 1964725492 ASNSEZXQHZOOFP-GFCCVEGCSA-N 267.300 2.216 10 10 CECE CCN[C@H](C)c1ccc(N2CCCC[C@H]2CO)cc1O 250298564 PVVUEMLPAVHWJT-OCCSQVGLSA-N 278.396 2.414 10 10 CECE C[C@@H]1C[C@H](C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)CCO1 2126507790 KHQNCJLFBDNHFD-IJLUTSLNSA-N 266.345 2.350 10 10 CECE CC(C)[C@@H]1C[C@@H](NCc2ccc(O)cc2O)CCO1 2126528413 UKIGIZCFFOWMHR-WFASDCNBSA-N 265.353 2.391 10 10 CECE COc1cc(O)c(CN2C[C@H](C)O[C@@H](C)C2)cc1OC 159456310 JEMMCAWBWWXTLS-QWRGUYRKSA-N 281.352 2.019 10 10 CECE Nc1ccc(NC(=O)CCCC(=O)N2CCCCC2)cc1 1866185656 OMBQZXHMKRDQQZ-UHFFFAOYSA-N 289.379 2.390 10 10 CECE CC(C)Oc1ccc(N2C[C@@H](CN)OC(C)(C)C2)cc1 11632489 QRANOEIVTOCTTE-OAHLLOKOSA-N 278.396 2.416 10 10 CECE CN1C(=O)N(c2ccc(N)cc2)C[C@H]1c1ccccn1 259401248 KKYJTTDRLPNKOI-AWEZNQCLSA-N 268.320 2.277 10 10 CECE O=C(O)c1cc2c(nc1Sc1nccs1)COCC2 2129697290 XAFSVCSFSJWXIK-UHFFFAOYSA-N 294.357 2.460 10 10 CECE CO[C@@H]1CC[C@H]1CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2130386392 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C[C@@H](O)c1ccc(N2C[C@@]3(C)CC[C@@]2(CO)C3)cc1 1911528917 ULODEPXHKAQTMN-KCXAZCMYSA-N 261.365 2.481 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@@H]2C)cc1Br 1914262219 MIZWPGHALPGFJB-ZANVPECISA-N 299.212 2.128 10 10 CECE CN(C)c1ccc(C=CC(=O)Nc2cn[nH]c2)cc1 1911836767 PMKMMRHFOUJITO-UHFFFAOYSA-N 256.309 2.128 10 10 CECE CN1CCC(C)(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)CC1 1912189352 UJDCNVDVRAIGMQ-LBPRGKRZSA-N 279.388 2.267 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2ccc(C(N)=O)cc2)C1 1912169553 MBJYUOXBZIRZNB-GFCCVEGCSA-N 259.313 2.060 10 10 CECE CO[C@H](CN1CCC(CN=[N+]=[N-])CC1)[C@H]1CCCOC1 1912204196 JEQBRCWTZLKXOT-UONOGXRCSA-N 282.388 2.450 10 10 CECE CC(C)(CNCc1ccc(O)cc1O)N1CCCC1 1912334014 MIMDCTPGVRYNNP-UHFFFAOYSA-N 264.369 2.062 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2CCNC23CCC3)cc1 2133789501 MVDVSWZBEIOWFI-CABCVRRESA-N 260.381 2.318 10 10 CECE CC(C)(N)[C@@H]1CCN(c2ccc3c(c2)COCC3)C1 2139887894 QYEBHEMVXGPBAP-CQSZACIVSA-N 260.381 2.323 10 10 CECE COc1ccc(O)c(CN2CC(C)(C)C[C@H]2C(=O)O)c1 1912574089 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CN(CC(=O)Nc1ccc(N)cc1)C[C@H]1[C@H]2CCC[C@H]21 2167280975 TXTRNILVJRXBEI-QDMKHBRRSA-N 273.380 2.185 10 10 CECE CCOC(=O)[C@@H](F)[C@H](N)c1ccc(N(CC)CC)cc1O 725274758 RZKWXBOFNCRKGR-UONOGXRCSA-N 298.358 2.139 10 10 CECE COc1ccc2c(c1)CCN2Cc1cnc2n1CCC2 824477882 GYLPBWXYOZNSBA-UHFFFAOYSA-N 269.348 2.401 10 10 CECE Cc1nc(C)c(CN[C@@H](C)c2ccc(O)cc2O)[nH]1 724680963 RBBVLWFRBHGTOC-QMMMGPOBSA-N 261.325 2.289 10 10 CECE CC(C)(C)OC(=O)N1CC[C@]2(CC(=O)O[C@@H]2CN=[N+]=[N-])C1 675052634 HGWBFJSNCQRGFC-RNCFNFMXSA-N 296.327 2.239 10 10 CECE CN(C)c1ccc([C@H]2[C@H](N)CC(=O)N2C(C)(C)C)cc1 62210182 LMUOZPZBSGLMLC-HIFRSBDPSA-N 275.396 2.152 10 10 CECE C[C@@H]1C[C@@H](NC/C=C/c2ccc(N(C)C)cc2)CCN1 841064118 YJFWMNFKZKOOIX-SBAHZNLJSA-N 273.424 2.496 10 10 CECE O=C(NCc1cc(Cl)ccc1O)N[C@@H]1CC12CC2 846717254 DFVRWSSELFZQFW-LLVKDONJSA-N 266.728 2.397 10 10 CECE COc1ccc(N2CC[C@@H](N[C@H]3CCOC3(C)C)C2)cc1 850486061 DSJNMTXGUHHJID-CJNGLKHVSA-N 290.407 2.431 10 10 CECE Cc1cc(C)c(O)c(CN2CCN3C(=O)OCC[C@@H]3C2)c1 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GRSKHHATMSVBCP-OTYXRUKQSA-N 288.313 2.285 10 10 CECE CCN(C(=O)c1ccc(O)c(O)c1)[C@H]1CCSC1 2050787868 RXAOIPXSSBVTAE-JTQLQIEISA-N 267.350 2.065 10 10 CECE CC[C@@H]1CN(c2c(F)cc([C@@H](C)NC)cc2F)C[C@H]1O 2194686491 BYUQCZVWMVVPSK-GPCCPHFNSA-N 284.350 2.452 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)C[C@@H]1C[C@H]1CF 2191369864 AQQCOSOEMKCNBZ-RYUDHWBXSA-N 279.359 2.135 10 10 CECE COC(=O)c1ccc(C)nc1OCc1ccc(N)cc1 2186281933 LLCAQHWXBJPDRR-UHFFFAOYSA-N 272.304 2.338 10 10 CECE Nc1ccc(NC(=O)NC[C@H](O)c2ccccc2)cc1 2191503272 PSENTAVEEOJTML-AWEZNQCLSA-N 271.320 2.124 10 10 CECE COc1ccc(N(C)C[C@H]2CCO[C@@H]2C)c(N)c1 2057468865 NGZWSUVPOPORTD-GHMZBOCLSA-N 250.342 2.139 10 10 CECE C[C@@H]1OCC[C@H]1CCNCc1cccc(O)c1O 2057455730 UCZRGJUOQBCAKK-WDEREUQCSA-N 251.326 2.003 10 10 CECE C[C@H](F)CS(=O)(=O)N(C)[C@@H](C)c1ccccc1O 2057400491 WLLKXHSCLQWCOH-UWVGGRQHSA-N 275.345 2.073 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@](C)(O)C(C)(F)F)cc1 2058507849 YQOSPUSKNYHNST-VXGBXAGGSA-N 258.312 2.159 10 10 CECE Nc1ccc(CC(=O)OCc2cnn(C3CC3)c2)cc1 2186803653 ACDRQWFBNPQWMZ-UHFFFAOYSA-N 271.320 2.086 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCOC[C@@H]2CF)c1 2062340928 XNHJICOWCULPNH-RYUDHWBXSA-N 253.317 2.432 10 10 CECE COCC1(CN(C)c2cc(OC)c(OC)cc2N)CC1 2195199962 HFRQBXZNYBDVLX-UHFFFAOYSA-N 280.368 2.149 10 10 CECE COCCNCc1cnc(SCCOC(C)C)s1 2065056199 ULXBQHSHETYBQG-UHFFFAOYSA-N 290.454 2.396 10 10 CECE COC1CC2(CO[C@@](C)(c3ccc(N(C)C)cc3)N2)C1 2198594463 POMGHFHKHPUARW-PCKAHOCUSA-N 276.380 2.093 10 10 CECE C[C@@H](NCC1CC2(CC[C@@H]2O)C1)c1c(O)cccc1O 2195362683 KBDXUMRSXCGUAF-ASHUDPAUSA-N 277.364 2.300 10 10 CECE CN(C)c1ccc([C@]2(C)N[C@H](C(=O)O)C(C)(C)S2)cc1 2195333036 DTXRVWHYCWJFHB-IUODEOHRSA-N 294.420 2.494 10 10 CECE COc1cc2c(cc1OC)N1CC[C@@H](OC)C[C@@H]1CN2 2187866162 CPSLGYHUJQNCEY-GHMZBOCLSA-N 278.352 2.113 10 10 CECE Oc1c(F)cccc1CNCC1CC(O)(C(F)(F)F)C1 2188160688 YOQFLGXEONAWQD-UHFFFAOYSA-N 293.260 2.324 10 10 CECE C[C@H](NC(=O)[C@@H]1CNC2(CCC2)C1)c1ccccc1O 2192626486 ZOSQHUDDMZLSRF-RYUDHWBXSA-N 274.364 2.102 10 10 CECE Cc1ncnc(C)c1C(=O)N[C@@H](C)c1ccccc1O 2192620422 RKEQUJCLAHKUMQ-VIFPVBQESA-N 271.320 2.290 10 10 CECE C[C@H](O)[C@@H](NCc1ccc(Cl)cc1O)C(F)(F)F 2074722427 ZZDBQTQSRCCOTL-QUBYGPBYSA-N 283.677 2.447 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H]2CCN(C)C(=O)C2)cc1 2188483965 JGYVIFBYKPNONM-WFASDCNBSA-N 275.396 2.024 10 10 CECE CCNCc1ccc(N2[C@H]3COC[C@H]2C3)c(Cl)c1 2077879084 IUUDZPGEVZDVSH-VXGBXAGGSA-N 266.772 2.427 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@H]4C[C@@]4(CO)C3)ccc21 2200841698 PWVQOYYHGYRMTO-COXVUDFISA-N 272.392 2.102 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H]4C[C@@]4(CO)C3)ccc21 2200841699 PWVQOYYHGYRMTO-JQFCIGGWSA-N 272.392 2.102 10 10 CECE CCc1cccc(CN[C@H]2COC(C)(C)[C@@H]2OC)c1O 2199456858 KEMQNVZNYRBDES-DZGCQCFKSA-N 279.380 2.237 10 10 CECE CC(C)[C@H]1C[C@H]1CNCc1ccc(O)c(O)c1O 2079449574 DHIOEOZHDDRWNH-WDEREUQCSA-N 251.326 2.185 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2C[C@@H](OC)C2)cc1O 2100206568 DWNMGAYLUAUVOR-RTXFEEFZSA-N 264.369 2.286 10 10 CECE Cc1cc(N(C)[C@H]2CCN(C3CC3)C2)ccc1CO 2103763516 VAFMDYBQTZSFML-INIZCTEOSA-N 260.381 2.160 10 10 CECE CCC(CC)(CO)CNCc1c(O)cccc1OC 2104438345 KBYPOMDCSZROSJ-UHFFFAOYSA-N 267.369 2.289 10 10 CECE C[C@@H]1CC[C@@H](CN)N(c2ccc3c(c2)OCCO3)C1 2106372235 SHOVGDGNVOUJJP-YPMHNXCESA-N 262.353 2.021 10 10 CECE CN(c1ccc2c(c1)COCC2)[C@H]1CCC[C@H](N)C1 2106352909 YZPOJZGPWWWWEG-GJZGRUSLSA-N 260.381 2.465 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H]1CSCCN1C 2106793820 QUSKJDOWFYTTFU-HUUCEWRRSA-N 279.453 2.060 10 10 CECE C[C@H]1CC(N)(c2ccc3c(c2)CCN3C)C[C@H](C)O1 2106794194 UQYLDTCXWRAEIW-RYUDHWBXSA-N 260.381 2.420 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CCC[C@@H](N)C3)ccc21 2106797346 ZPNUOLAOGCVWCJ-XNRPHZJLSA-N 260.381 2.230 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3COC(C)(C)C3)ccc21 2106801926 QNTNJZKKVBUFTF-DZGCQCFKSA-N 260.381 2.494 10 10 CECE CCN(CC)c1ccc([C@H](C[C@H](C)OC)NN)cc1 2106861138 XODMAZUMRRKOMD-WFASDCNBSA-N 265.401 2.462 10 10 CECE CC1([C@@H](O)c2ccc(N3CCCC3)cc2)CC(N)C1 2106825452 JSLADQKKBWQVAB-SIWZUTFBSA-N 260.381 2.448 10 10 CECE CSCC[C@@H](N)[C@@H](O)c1ccc2c(c1)CCCN2C 2106821331 UCBBMPOSYIEUCV-HIFRSBDPSA-N 280.437 2.183 10 10 CECE CSCCNC[C@H](O)c1ccc2c(c1)CCCN2C 2106834578 VVGUZCZRLCFFGL-HNNXBMFYSA-N 280.437 2.055 10 10 CECE CCn1cnc(CN[C@H](C)c2ccc(O)cc2O)c1 2088032258 JIEQOPOLCGDFMY-SNVBAGLBSA-N 261.325 2.165 10 10 CECE Oc1ccc(CNC[C@H]2CCC(F)(F)CO2)c(O)c1 2088783963 IXNKRUXBHNTLLE-LLVKDONJSA-N 273.279 2.002 10 10 CECE O=C(O)CC[C@@H]1CCN1Cc1cc(F)cc(F)c1O 2109432239 QAJKAHFFDPSLEF-SNVBAGLBSA-N 271.263 2.110 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2Cc1ccncn1 2089617658 WKLCPUSKCNWQDO-NSHDSACASA-N 254.337 2.059 10 10 CECE CC1(C)CCc2cc(N3CCC34CNC4)ccc2O1 2110240734 IEVBAWCJKYUTQK-UHFFFAOYSA-N 258.365 2.342 10 10 CECE COc1ccc(N(C)Cc2cc(Cl)n(C)n2)c(N)c1 2110203307 HUDWHUQCONSGGT-UHFFFAOYSA-N 280.759 2.301 10 10 CECE CN[C@H](C[C@@H]1C[C@@H]1C)[C@H](O)c1ccc(N(C)C)cc1 2091658713 RXLCOWGUHNNQLN-DDUYRFODSA-N 262.397 2.420 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3[C@@H](CO)[C@@H]3C2)cc1Cl 2093155498 LPQBFDRMIDIYNG-OLRMPSLUSA-N 281.783 2.458 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@H]1[C@H]2COCC[C@@H]21 2093704654 BQDVSQXFECLFNT-OAGGEKHMSA-N 260.381 2.373 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H]2C[C@H]2[C@H]1C(=O)O 2096882152 JMECUOFZNDOPNM-RSXIPKFTSA-N 261.321 2.248 10 10 CECE C[C@@H]1COCC[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2099332821 KVFFMLLKFMWCHX-GRYCIOLGSA-N 266.345 2.350 10 10 CECE CO[C@@H]1CCN(c2ccc(CO)cc2C)C[C@@]1(C)OC 2201551147 ZGMIFIYKCWNPJM-HZPDHXFCSA-N 279.380 2.118 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@H]2CC[C@]21C(=O)O 2201102168 NMSQEXBOLXHFSG-IQMDTDKHSA-N 277.320 2.098 10 10 CECE C[C@@H](c1cc(O)ccc1O)N(C)[C@@H]1CCCCNC1 2112837346 ABLLOJHCHKDRDQ-NWDGAFQWSA-N 264.369 2.233 10 10 CECE NCc1ccc(N2CCCO[C@@H]3CCC[C@H]32)cc1F 2113806270 BHEQMPCMZLSDPW-HUUCEWRRSA-N 264.344 2.432 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC[S@](=O)C(C)(C)C1 2114496370 RLHVRWYKUPYSPF-OVWNDWIMSA-N 285.384 2.435 10 10 CECE C[C@H](c1ccc(Cl)cc1O)N1CC[C@@H]2C(=O)NC[C@H]2C1 2203363825 SMZDDRQMBYKNMP-NRUUGDAUSA-N 294.782 2.175 10 10 CECE CNCc1ccc(N2CC[C@@](C)(COC)C2)cc1OC 2204555155 WIJIRGOWLODQKC-MRXNPFEDSA-N 278.396 2.277 10 10 CECE COCCNCc1ccc(N(C)CCSC)cc1OC 2204542499 BEZJSRKCSNJPKB-UHFFFAOYSA-N 298.452 2.230 10 10 CECE CCCC1(O)CN(c2ccc(CNCC)c(OC)c2)C1 2204551783 VKFLFDCOGUGLOM-UHFFFAOYSA-N 278.396 2.156 10 10 CECE Oc1cc(F)ccc1CNCc1cccc2nccn12 2204744180 JIXZQXCCVHQWBF-UHFFFAOYSA-N 271.295 2.469 10 10 CECE CSc1ncc(CNC[C@H](O)CC(C)C)s1 2208567382 HDLMAGHATRZCBL-SECBINFHSA-N 260.428 2.362 10 10 CECE CSc1ncc(CNC[C@H]2C[C@@H](C)CO2)s1 2208775873 FHFRQFBHRCLZAX-RKDXNWHRSA-N 258.412 2.380 10 10 CECE CCOc1cccc(CNC[C@]2(F)CCOC2)c1O 2208798299 WRXVFRYWFIYKDH-CQSZACIVSA-N 269.316 2.009 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)/C(Cl)=C(/Cl)C(=O)O)C1 2218746256 WCDUESPCAOPZMQ-MPLXJBJVSA-N 293.110 2.062 10 10 CECE COc1ccc(N2CCC[C@](C)(O)C2)c(OC)c1 2219590681 QRBTZMFVCBNTGO-AWEZNQCLSA-N 251.326 2.055 10 10 CECE Nc1ccc(OCCCN2CC[C@@H]3C[C@]3(F)C2)cc1 2230336189 XQLXVLJNCJAMAJ-DOMZBBRYSA-N 264.344 2.472 10 10 CECE COc1ccc(N(C)CCOC(C)C)c(CO)c1 2220425496 ABMUODLTDVLSKQ-UHFFFAOYSA-N 253.342 2.049 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC2(CC2)C[C@H]1CO 2232100848 RCEMPUNDTHACFZ-OCCSQVGLSA-N 261.365 2.400 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCN(C)[C@H]2CC[C@@H]21 2232100712 PSIPJWAQXJEFBX-RCBQFDQVSA-N 260.381 2.331 10 10 CECE COc1ccc(N2C[C@@]3(C)CC[C@@]2(CO)C3)c(OC)c1 2235127678 VIONDUIPVSBIFU-HOTGVXAUSA-N 277.364 2.445 10 10 CECE C[C@H](C[C@@H](C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-])C(=O)O 2225791565 FIIBZZRUGWBPMP-OPRDCNLKSA-N 268.317 2.035 10 10 CECE COc1ccc(N2CC[C@@H](OC)[C@@H](C)C2)c(C(=O)O)c1 2235957240 INGMEEFXALHELN-IINYFYTJSA-N 279.336 2.255 10 10 CECE CNCc1cc(OC)ccc1N1C[C@@H](OC)CC[C@H]1C 2235964971 BAQYZJAJZITNGJ-DOMZBBRYSA-N 278.396 2.418 10 10 CECE COc1ccc(N(C)Cc2coc(C)n2)c(C(=O)O)c1 2235945893 LOWNTBQNRFTZRY-UHFFFAOYSA-N 276.292 2.326 10 10 CECE C[C@@H]1CC[C@H]1CN(C)c1ccc2c(c1)N(C)C(=O)[C@H]2O 2236130457 CYZBWLXUPWWZFE-ZETOZRRWSA-N 274.364 2.179 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H]3CC[C@@H]2CN(C)C3)cc1 2226367397 HDMHEDKGJAOYRV-VBNZEHGJSA-N 259.397 2.250 10 10 CECE CCNCc1cc(OC)ccc1N(CC)C1COC1 2227671528 ACYKIJQJYNNBAB-UHFFFAOYSA-N 264.369 2.030 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2C[C@H]3CC[C@H]2O3)cc1O 2228079577 COWXNVWGVYQYQF-AGNJHWRGSA-N 262.353 2.168 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@H](F)[C@@H]2CCOC2)c1 2238312702 VVEXKERWALFWRY-WDMOLILDSA-N 283.343 2.426 10 10 CECE CCOc1ncc([C@@H](NCCCN=[N+]=[N-])C(=O)OC)s1 2239771741 GOWAOJVAEIUSAK-SECBINFHSA-N 299.356 2.046 10 10 CECE C[C@@H](NCC1(F)CCOCC1)c1cc(O)ccc1O 2229930261 QXMPMNTXUBWPFO-SNVBAGLBSA-N 269.316 2.267 10 10 CECE CC[C@H](C)NCc1ccc(N2CC=C[C@H](O)C2)c(F)c1 2240042082 COHZOVPPSDOKQJ-JSGCOSHPSA-N 278.371 2.451 10 10 CECE COc1ccc(CN[C@@]2(C3CC3)CCOC2)c(O)c1 2230033139 PIJXWGAUVFBYBH-HNNXBMFYSA-N 263.337 2.060 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@](C)(CO)COC)c(C)c1 2240828641 HXKYELVAAQFISS-BBRMVZONSA-N 280.412 2.109 10 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N[C@@H]1CCC[C@@H]2CN(c3ccc4c(c3)COCC4)C[C@H]21 2162627113 YJSHXGCBPDDFKB-KBRIMQKVSA-N 272.392 2.323 10 10 CECE C[C@H]1[C@@H](C)NCCN1Cc1ccc2c(c1)CCCN2C 379494544 NKRMSRAYHLDUFU-KGLIPLIRSA-N 273.424 2.251 10 10 CECE CN1CCCc2cc([C@](C)(O)[C@@H]3CCCCN3)ccc21 2163097142 LMFQPZIAZQQTFB-IRXDYDNUSA-N 274.408 2.419 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2CC[C@H](CN)O2)cc1 2163091198 FHHDWRLTWGDVRQ-OAGGEKHMSA-N 278.396 2.073 10 10 CECE CCN1CCc2cc([C@H](O)CC3CC(CN)C3)ccc21 2163066853 PYRLWCDCQBVHNL-QWQCLYJRSA-N 274.408 2.477 10 10 CECE CO[C@@H]1COCC[C@@H]1N[C@H](C)c1ccc(N(C)C)cc1 384064141 ZNUWPWHUKKXUHD-UHOFOFEASA-N 278.396 2.207 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)COC1CCC1 716947036 QKQCRHFNAZYUST-NSHDSACASA-N 263.337 2.481 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)Cc1cc(F)cc(F)c1O 2163630148 MJPRFFXHFVYORE-HZMBPMFUSA-N 284.350 2.490 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H](CO)[C@H]2C)c(F)c1 385617321 GKRGCMCJNLBBDI-CKYFFXLPSA-N 252.333 2.053 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](CO)[C@@H]2C)c(F)c1 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10 CECE NC1CC([C@@H](F)[C@@H](O)c2ccc(N3CCCC3)cc2)C1 2199075282 YNXBBHAFTHXCPN-GMEATFMZSA-N 278.371 2.396 10 10 CECE CN1CCC[C@@H](N(C)CCOc2ccc(N)cc2)CC1 2192731634 BXFFIPKTQVLRNW-OAHLLOKOSA-N 277.412 2.064 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@@H]2CCN(C)C(=O)C2)cc1Cl 2188476082 AVVDTBJNBLGVEW-ZYHUDNBSSA-N 296.798 2.450 10 10 CECE c1cc2c(cc1CN[C@@H]1C[C@@H]3[C@@H]1[C@H]1CC[C@H]3O1)CCO2 2188665996 MYSGMSCBRZZHKN-CNLQAYEWSA-N 271.360 2.277 10 10 CECE Cc1c(Cl)cncc1NC(=O)c1cc(O)c(O)c(O)c1 2188874090 CXKPPPCNUFLQHK-UHFFFAOYSA-N 294.694 2.413 10 10 CECE Cc1ncn(CCNCc2ccc3c(c2)CCO3)c1C 2193295336 MOIQPHOMSMTREZ-UHFFFAOYSA-N 271.364 2.225 10 10 CECE CCC(=O)N1CCN([C@@H](CC)c2ccccc2O)CC1 2182602244 NWEUQTWLVHAPKY-AWEZNQCLSA-N 276.380 2.398 10 10 CECE Oc1ccc(CNCCC23CCCN2CCC3)cc1O 2183021483 RZPFJOJRXPPTMD-UHFFFAOYSA-N 276.380 2.206 10 10 CECE C[C@@H](N)c1ccc(N2CCCNC(=O)C2(C)C)cc1Cl 2193693237 UOLKEFDNXFRQBU-SNVBAGLBSA-N 295.814 2.465 10 10 CECE COC[C@H]1CCC=C[C@]1(N)c1ccc2c(c1)CCN2C 2183623447 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294.420 2.385 10 10 CECE CO[C@@]1(CN(C)CCCCN=[N+]=[N-])CCCOC1 2047419799 JBCWLGRZHVJATC-GFCCVEGCSA-N 256.350 2.204 10 10 CECE COC[C@](C)(OC)[C@@H](N)c1ccc2c(c1)CCCN2C 2198206198 KDSSHQKTWNPEHH-HOTGVXAUSA-N 278.396 2.120 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@](C)(O)[C@](C)(O)C2)c(Cl)c1 2194617644 HBDQSOSAQXLTMM-WKPIXPDZSA-N 299.798 2.105 10 10 CECE CC(C)(C)[C@@H]1C[C@@H](NC(=O)c2ccc(O)c(O)c2)CO1 2185641192 ZOZKDTTXPNSIDV-MFKMUULPSA-N 279.336 2.031 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@@H](O)C2)c(F)c1 2050101298 RAAVKFMEJZUDRZ-CMPLNLGQSA-N 253.317 2.230 10 10 CECE CCN1CC(CN(C)c2c(F)cc([C@@H](C)N)cc2F)C1 2194710263 QJMGPZRVRWFWFD-SNVBAGLBSA-N 283.366 2.372 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@H]1[C@@H]2CCC(F)(F)[C@H]21 2051257237 TZUFDKSRIBECDK-DJLDLDEBSA-N 258.272 2.484 10 10 CECE C[C@H](N)c1ccc(N2CC=C(CO)CC2)cc1Cl 2051356782 AVNVOBYOVRCVHN-JTQLQIEISA-N 266.772 2.489 10 10 CECE C[C@H](CNC(=O)c1ccc(O)c(O)c1)C(C)(F)F 2051842717 KKWHZUGLDYNWGE-SSDOTTSWSA-N 259.252 2.119 10 10 CECE 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Nc1ccc(CNc2ncnc3ncccc23)cc1 1162784339 LGTUAXYZEWDTTH-UHFFFAOYSA-N 251.293 2.219 10 10 CECE Cc1c(Cl)ccc2nc(C3=C[C@@H](O)[C@H](N)C3)n(C)c12 2131478842 ZYAFIYGNMGESML-ZYHUDNBSSA-N 277.755 2.010 10 10 CECE CCNCc1ccc(N(C)CC[C@@H](C)O)cc1C 135586886 WSTCIMAVTSJJGR-CYBMUJFWSA-N 250.386 2.312 10 10 CECE COc1ccc(O)c(CN[C@H]2CC[C@H](OC)C2)c1 189230941 DJBUAJZZIQPSJY-AAEUAGOBSA-N 251.326 2.058 10 10 CECE O=C(O)CN(Cc1ccc(O)cc1O)c1ccccc1 86738957 XKSGKZVTHCYXCW-UHFFFAOYSA-N 273.288 2.189 10 10 CECE COc1cccc(CN2CCC[C@H](CCC(=O)O)C2)c1O 86809568 KLLCWZQZBPKVQK-GFCCVEGCSA-N 293.363 2.478 10 10 CECE COc1ccc(O)c(C(=O)N(C)Cc2ccc(N)cc2)c1 43327733 YXHFIBGPKFHVBM-UHFFFAOYSA-N 286.331 2.255 10 10 CECE NC1CCN(c2ccc(OC[C@@H]3CCCO3)cc2F)CC1 87439430 XDSIRXSQBVMACV-AWEZNQCLSA-N 294.370 2.311 10 10 CECE CN(C)c1ccc(-c2nc(C(=O)O)c(N)s2)cc1 232306550 ZBKCXWKTLARCSL-UHFFFAOYSA-N 263.322 2.157 10 10 CECE COC[C@@H]1CCCN1Cc1cccc(OC)c1O 91862534 FSQQNJQOCPORST-LBPRGKRZSA-N 251.326 2.012 10 10 CECE CC(C)[C@H](C)S(=O)(=O)CCc1ccc(N)cc1 232745897 CHIYMFIKGKGABP-NSHDSACASA-N 255.383 2.271 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@H]1CCCCO1 251557601 PRTREMJZADMSBM-IUODEOHRSA-N 291.395 2.097 10 10 CECE C[C@H](c1cc(O)ccc1O)N(C)[C@H]1CCC[C@H]1CN 251237436 CUUJHKVLJVEYPL-SUNKGSAMSA-N 264.369 2.218 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@H](CO)OC[C@H]1C 251061843 YEMRYIVEWHROGS-GDBMZVCRSA-N 292.423 2.079 10 10 CECE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CSC2(C)C)c1O 283013495 LQHFEKODYZYMIX-SNVBAGLBSA-N 298.364 2.293 10 10 CECE CN1CCc2cc([C@@]3(O)CCN(C(C)(C)C)C3)ccc21 2163072903 ZVTMXBQVOJLDQA-QGZVFWFLSA-N 274.408 2.371 10 10 CECE COC(=O)[C@H](CF)NCc1ccc(N2CCCCC2)cc1 290162816 LZKZKULVXIZXBG-HNNXBMFYSA-N 294.370 2.278 10 10 CECE COc1ccc(N(C)CC2(C(N)=S)CCOCC2)cc1 2166315330 WLQSSQBTTHZBTN-UHFFFAOYSA-N 294.420 2.214 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@H]1CC2(CCC2)CO1 2166447691 MWWXARFIZZCQNN-CQSZACIVSA-N 274.364 2.186 10 10 CECE Cc1c(Br)cc(C(=O)O)c(O)c1CN(C)C 642879656 YFHXGCLVWWRMOZ-UHFFFAOYSA-N 288.141 2.223 10 10 CECE CC(=O)C(=O)COC(=O)/C=C(/C)c1ccccc1Cl 808513509 GUKIZCCVNDAQHL-CLFYSBASSA-N 280.707 2.445 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H](CO)OCC2(C)C)cc1Cl 2167526740 KKDKQGCQDGCTQA-ZYHUDNBSSA-N 298.814 2.336 10 10 CECE COc1ccc(CN2C[C@H]3[C@@H]4CC[C@@H](O4)[C@H]3C2)c(O)c1 718243437 JPSHGEFCORKTGR-UPUJQMMVSA-N 275.348 2.010 10 10 CECE CN(Cc1ncccn1)c1ccc(/C=C/C(=O)O)cc1 718921829 QSOSNCBSAPDCJB-VMPITWQZSA-N 269.304 2.211 10 10 CECE CSc1ncc(CN[C@@H]2C[C@H]3OCC[C@H]23)s1 2243832418 KFHFTKDUBUBIMR-OPRDCNLKSA-N 256.396 2.132 10 10 CECE CC[C@@H]1C[C@H](NC(=O)c2cc(O)cs2)CCO1 817770000 YEKBRPXGQVPJFQ-PSASIEDQSA-N 255.339 2.141 10 10 CECE Oc1cccc(CNC[C@H]2CC[C@@H](C(F)(F)F)O2)c1O 722398187 KSQFOWKKXDVERK-KOLCDFICSA-N 291.269 2.297 10 10 CECE COc1ccc([C@@H](C)N2CCN3CCC2CC3)c(O)c1 722814564 RBWRDBYWLOJMQP-GFCCVEGCSA-N 276.380 2.242 10 10 CECE CCNCCCCC(=O)N(C)Cc1ccccc1O 724717429 ZAKFJKCJIQGZMS-UHFFFAOYSA-N 264.369 2.130 10 10 CECE CN(C)c1ccc(/C=C\CNC[C@@]2(C)CCC(=O)N2)cc1 835059821 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Cc1cc(CO)ccc1N1CCC[C@@H]1CCN(C)C 701480911 RUNBVJFRBGMPBZ-OAHLLOKOSA-N 262.397 2.408 10 10 CECE CCO[C@@H]1CCN(Cc2cccc(OC)c2O)C1 701661412 KNKMSLLCJBRWLZ-GFCCVEGCSA-N 251.326 2.012 10 10 CECE COc1nc(Sc2nccs2)c(CN)s1 393734501 HHPFCYXLEGFHHB-UHFFFAOYSA-N 259.381 2.218 10 10 CECE COC(=O)N(C)CCN(C)[C@H](C)c1ccc(F)cc1O 690813955 BAZVGCMTYHUDAS-SNVBAGLBSA-N 284.331 2.222 10 10 CECE CC(C)[C@](C)(CO)NCc1ccc(F)c(F)c1O 703308892 QCVJMTMDMHVDLJ-ZDUSSCGKSA-N 259.296 2.167 10 10 CECE Oc1c(CNC[C@H]2CCC=CO2)ccc(F)c1F 703417338 KQMYUHBVGAUDDI-SNVBAGLBSA-N 255.264 2.453 10 10 CECE Oc1cccc(CN[C@H]2CCOC3(CCC3)C2)c1O 1889788592 IAJLJHHWLLWPJL-LBPRGKRZSA-N 263.337 2.289 10 10 CECE C[C@@H](Oc1ccccc1F)C(=O)NCCN=[N+]=[N-] 706133257 QKCISZQGZLJPTM-MRVPVSSYSA-N 252.249 2.020 10 10 CECE [N-]=[N+]=NCCNC(=O)CSCc1ccc(F)cc1 706345442 XVQAIBXDZBKCPY-UHFFFAOYSA-N 268.317 2.485 10 10 CECE C[C@H](c1ccco1)N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 706321362 AJTMPPUMAOQQAG-YMTOWFKASA-N 272.304 2.463 10 10 CECE 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IFVWVERRMTYGNE-CYBMUJFWSA-N 288.313 2.300 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H]3OCC[C@@H]3C2)cc1 2143551657 DJHFCDMEAPQBKQ-UKRRQHHQSA-N 273.332 2.400 10 10 CECE CC(C)N(Cc1ccc(N)cc1)[C@@H]1CCCCNC1=O 35365409 BBZQHFQCURBKRX-OAHLLOKOSA-N 275.396 2.148 10 10 CECE C[C@H]1CCc2cc(N3CCn4cnnc4C3)ccc2N1 168415192 FKMJQYPGORHFOZ-NSHDSACASA-N 269.352 2.045 10 10 CECE CC[C@@](NCCCN=[N+]=[N-])(C(=O)O)c1ccc(F)cn1 161945272 HOEZFHNGKSEGRI-LBPRGKRZSA-N 281.291 2.201 10 10 CECE Nc1cccc(Cl)c1N[C@H]1C[C@H]2C[C@H]1C[C@@H]2O 1997916207 BNGNWSAOKKCOFV-VVJJBPBLSA-N 252.745 2.494 10 10 CECE CSCC1CN(c2ccc([C@H](C)O)c(O)c2)C1 1998203391 FTWSDRGPFXLMHZ-VIFPVBQESA-N 253.367 2.245 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@H]2C(F)(F)F)cc1O 2150377505 UQMADCJCURMOFE-UFBFGSQYSA-N 290.285 2.179 10 10 CECE CCOC(=O)CN(C(=O)Nc1ccc(N)cc1)C(C)C 42707815 YXILHRJZPQVWSM-UHFFFAOYSA-N 279.340 2.074 10 10 CECE CCn1nccc1CN(C)c1ccc([C@@H](C)O)c(O)c1 2150695516 BBNKIWCAQKJJTF-LLVKDONJSA-N 275.352 2.298 10 10 CECE Cn1cc(CN2CCC[C@@H](N=[N+]=[N-])C2)c(Cl)n1 2002830731 XBBVWNRIBGANBT-SECBINFHSA-N 254.725 2.348 10 10 CECE CNCc1ccc(N2C[C@@H]3CCC[C@@H](O)[C@H]3C2)c(C)c1 2150922329 OWWBODWWIXCJEO-YQQAZPJKSA-N 274.408 2.312 10 10 CECE C[C@@H](CCc1nccs1)NC(=O)c1ccc(O)c(O)c1 2150932414 JXOVGVVVGMXGHX-VIFPVBQESA-N 292.360 2.305 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C[C@@H](O)CC(F)(F)F 2009442648 FKYKNDRJCNKUCM-SFYZADRCSA-N 252.240 2.074 10 10 CECE COC[C@@]1(OC)CCCN(Cc2cc(C)ccc2O)C1 2151849932 VZPUILZNZNIOPK-MRXNPFEDSA-N 279.380 2.328 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N3CC[C@@H]3C(C)(C)C)cc21 2152291353 JPFFNONJUUTJFP-ZIAGYGMSSA-N 273.380 2.288 10 10 CECE CN(C[C@@H]1C=CCCC1)C(=O)COc1ccc(N)cc1 2153114598 QIDFDGZCQWPDLC-CYBMUJFWSA-N 274.364 2.462 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@]3(CCO3)C2)c([N+](=O)[O-])c1 2153329624 DWFZBOVKIVOKEJ-YGRLFVJLSA-N 278.308 2.017 10 10 CECE CCCN(CCCO)c1ccc(CNC)cc1F 2032098395 XUGSNGSQRRGRGH-UHFFFAOYSA-N 254.349 2.144 10 10 CECE COc1ccc(CNC[C@@H](C)CN2CCCC2)c(O)c1 60942130 TVMDDFOFXPSOSV-CYBMUJFWSA-N 278.396 2.222 10 10 CECE Cc1nc([C@H](N)c2ccc3c(c2)CCCN3C)cn1C 2154677200 KODMJRBBKYDVMT-MRXNPFEDSA-N 270.380 2.159 10 10 CECE CC1(C)C[C@@H](O)CN1c1ccc(CNC2CC2)cc1F 2154826199 ANOZOLQVCXQIPM-CYBMUJFWSA-N 278.371 2.427 10 10 CECE CCN(CC)C(=O)[C@H](C)N[C@@H](C)c1ccc(F)cc1O 62747529 TVKITBLXANTLCO-QWRGUYRKSA-N 282.359 2.439 10 10 CECE CN(C[C@@H]1CC[C@@H]2C[C@H]21)S(=O)(=O)Cc1ccc(N)cc1 2157957517 CZXWTTOMOKLZAN-VNHYZAJKSA-N 294.420 2.077 10 10 CECE CC[C@@H](N)Cc1cnc(Sc2nnc(C)n2C)s1 2037805458 IWUKBEXNYLWXAL-MRVPVSSYSA-N 283.426 2.011 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cc2c(s1)CCOC2 2041522256 GCEZWYKRVOLHFE-UHFFFAOYSA-N 266.326 2.203 10 10 CECE Cc1ccc(CNC(=O)CCc2ccc(N)cc2)nc1 400901304 REKMEYVRGPGHEJ-UHFFFAOYSA-N 269.348 2.221 10 10 CECE CC[C@@H]1CN(Cc2ccc(OC)cc2O)[C@@H](C)CO1 403812406 LCKOUQHHRDNEAS-WCQYABFASA-N 265.353 2.400 10 10 CECE Cc1cc(CNCc2ccc(O)c(O)c2)sn1 404366255 PMGWKAVPVCZNNY-UHFFFAOYSA-N 250.323 2.153 10 10 CECE OC[C@@H](O)CNc1ccccc1OCc1ccccc1 309842193 WQNJNHFZPXLRBE-AWEZNQCLSA-N 273.332 2.031 10 10 CECE CC(C)[C@@H](O)CN1CCCc2cc([C@H](C)N)ccc21 311996103 WWCREKWZXAJKFL-LRDDRELGSA-N 262.397 2.476 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)cc1 312508766 DENMEQZHFOVRTM-DJJPAPDTSA-N 272.392 2.302 10 10 CECE C[C@H]1OC2(C)CC1(NCc1ccc3c(c1)CCN3C)C2 2156682480 NMZJTNWBQBAPQI-AXOLYNHLSA-N 272.392 2.479 10 10 CECE C[C@H](N)c1ccc(N2CC3(C2)OCCC[C@H]3O)c(Cl)c1 2159650210 JZSXOTZFNPHVSX-IINYFYTJSA-N 296.798 2.090 10 10 CECE CO[C@@H]1C[C@@H]2[C@@H]1CCN2c1ccc(C[C@H](C)N)c(C)c1 2178287602 DINJNMMVRHRYIK-KKBVYLPWSA-N 274.408 2.498 10 10 CECE Cc1cc(N(C)[C@@H]2CCN(C(C)C)C2)ccc1CCN 2160082715 PBFAGTPFUFXHIE-QGZVFWFLSA-N 275.440 2.415 10 10 CECE CN(C)c1ccc(Cn2cncc2[C@H]2CCNC2)cc1 2160480709 OIUNLRPATANDAD-AWEZNQCLSA-N 270.380 2.074 10 10 CECE Cc1ccc(OCC(=O)NCCCN=[N+]=[N-])c(C)c1 701320006 WDWVNFSXMRQVKB-UHFFFAOYSA-N 262.313 2.499 10 10 CECE CN1CCc2cc(CN[C@@H]3CC[C@@]34CCCO4)ccc21 2160725895 PEHACXJLWKNRNV-SJORKVTESA-N 272.392 2.480 10 10 CECE CN[C@@H](C)c1ccc(N2CCC23CC(CO)C3)cc1O 2160851238 GAWHBLKYNKOCAA-FZWSLVFFSA-N 276.380 2.024 10 10 CECE CS[C@@H]1CC[C@@H]1NC(=O)Nc1ccc(N)cc1 702377502 MLHUGCJWTHBNGA-WDEREUQCSA-N 251.355 2.284 10 10 CECE Cc1ccc(C(=O)[C@H](O)c2ccc(N(C)C)cc2)nc1 2161637196 ALJJOBSTLYLUEX-OAHLLOKOSA-N 270.332 2.372 10 10 CECE C[C@@H](O)c1ccc(N(C)CCO)cc1C(F)(F)F 705587605 KLWPMAAQTXKBCT-MRVPVSSYSA-N 263.259 2.187 10 10 CECE COc1ccc(N2C[C@@H](CO)CC[C@@H]2C)c([N+](=O)[O-])c1 688646820 DEUXPAGJDKLJTH-QWRGUYRKSA-N 280.324 2.201 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCn3c(C)nnc3C2)c1 2170346545 NOCDNVCBHPIHNH-LLVKDONJSA-N 272.352 2.177 10 10 CECE CC[C@@H](O)c1ccc(N2CCn3nc(C)nc3C2)cc1 2170407664 WBMKRXNYABXUKK-CQSZACIVSA-N 272.352 2.050 10 10 CECE CC(C)[C@@](C)(CO)NCc1cc(F)cc(F)c1O 708482211 XDFKUBNADNBABL-CYBMUJFWSA-N 259.296 2.167 10 10 CECE CC(C)[C@H]1CN(C)CCN1c1ccc([C@H](C)O)c(O)c1 2170570682 LHLLMYPOQXHQIG-SWLSCSKDSA-N 278.396 2.222 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@]1(O)C=C(C)CC1 2176006825 JIKIEEXOQFMWSA-IAGOWNOFSA-N 272.392 2.411 10 10 CECE CC(C)N1CC(NCc2cccc(Br)c2O)C1 383146601 YWLANMRABPMJCU-UHFFFAOYSA-N 299.212 2.337 10 10 CECE CC(C)C[C@@H]1C[C@H]1NCc1ccc(O)c(O)c1O 385888303 YPQHFHHEIGTJER-GHMZBOCLSA-N 251.326 2.328 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1Cc1cc(C(N)=O)ccc1F 2179612351 JWMXXFLJICSDSO-LLVKDONJSA-N 277.303 2.199 10 10 CECE C[C@@H](N[C@@H](CO)C1CCCC1)c1c(O)cccc1O 386119705 BZCLKWYSEXZMAB-PWSUYJOCSA-N 265.353 2.300 10 10 CECE CCCN([C@@H](C)c1ccc(F)cc1O)[C@@H]1CCNC1=O 2171234126 IWWHJSVGLAMMTR-GXFFZTMASA-N 280.343 2.193 10 10 CECE CC(C)O[C@]1(CNc2ccc(N)cc2)CCOC1 722348231 RVIYXQZWVBCNJR-AWEZNQCLSA-N 250.342 2.265 10 10 CECE Cc1nc([C@@H](C)N[C@H]2CCc3cccc(O)c32)n[nH]1 392413886 FZOHOWDQMWAYNX-KCJUWKMLSA-N 258.325 2.157 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3CCN(C)C[C@@H]3C2)cc1 394349348 YNMKHXMLDRISGS-FVQBIDKESA-N 273.424 2.355 10 10 CECE C[C@H](N[C@@H]1CCN(C)CC1(C)C)c1ccc(O)cc1O 2162867952 LRBRMOMGAVNTHV-XHDPSFHLSA-N 278.396 2.479 10 10 CECE C[C@@H](N[C@@H]1COC(C)(C)C1)c1ccc(O)cc1O 396552222 SMJNDKVVIOUZOI-ZJUUUORDSA-N 251.326 2.316 10 10 CECE C[C@H](COC[C@H](O)COc1ccc(N)cc1)C1CCC1 398380456 MSPRMEQHIBFVHU-DOMZBBRYSA-N 279.380 2.461 10 10 CECE CCNCc1ccc(N2C[C@@H](CO)C[C@@H](C)C2)cc1 398765741 AQNAUWYMKCGYTF-HIFRSBDPSA-N 262.397 2.251 10 10 CECE Cn1cncc1[C@@](C)(N)c1ccc(N2CCCC2)cc1 2163112167 ZLGAGBDLVQQAEO-INIZCTEOSA-N 270.380 2.243 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@H](O)C1(C)CC1 2163241871 DKUBKDLIKUIZKT-HOTGVXAUSA-N 274.408 2.491 10 10 CECE CN(Cc1ccc(Cl)cc1O)C[C@@H]1C[C@H]2OCC[C@@H]2O1 2163204902 UCYPIGRYJHUBHZ-AEGPPILISA-N 297.782 2.424 10 10 CECE CC(C)c1nc([C@@H](NN)c2ccc(N(C)C)cc2)ns1 2163482343 ISJFWUPDHIOKTO-LBPRGKRZSA-N 291.424 2.280 10 10 CECE C[C@@](F)(C(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C(F)(F)F 2071774935 LDUICQYDGAAWOB-POYBYMJQSA-N 268.214 2.436 10 10 CECE CN(C)C1CC2(CC(NCc3ccc(O)cc3O)C2)C1 2172173155 GLCYXRVXCUJGIU-UHFFFAOYSA-N 276.380 2.060 10 10 CECE Cc1cc(O)n2ncc(C(=O)NCCCC3CCC3)c2n1 2065191369 KTXAWAQFCSUQCR-UHFFFAOYSA-N 288.351 2.053 10 10 CECE COC1(OC)CC[C@H]1CN[C@@H](C)c1ccc(O)cc1O 2173381825 LFKAFJBDDPPIFF-QWRGUYRKSA-N 281.352 2.148 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1CO[C@@]2(CCCOC2)C1 2178975582 QEMWEEOOQJNRQO-NHYWBVRUSA-N 297.782 2.473 10 10 CECE C[C@H]1C[C@@H]1N(CCO)c1ccc(CNC2CC2)cc1F 2167108424 DUHIQVFBMVNTEF-ZBEGNZNMSA-N 278.371 2.285 10 10 CECE CC[C@]12C[C@H]1CN(c1ccc3c(c1)NC(=O)[C@@H]3NC)C2 2167535314 CJELFIQWIWIMEE-DRZCJDIDSA-N 271.364 2.136 10 10 CECE Cc1cc(N2CC(O)(c3ccccc3)C2)ccc1CO 2177794857 UYHXPSHWDZQPFK-UHFFFAOYSA-N 269.344 2.195 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1ccc(C(N)=O)cc1F 2179616756 CNZCJEAHHJJZMW-NSHDSACASA-N 277.303 2.199 10 10 CECE CC(C)[C@@H](COC(F)F)NC(=O)Cc1ccc(N)cc1 2187451346 KLNOTIHKFYEPTM-GFCCVEGCSA-N 286.322 2.191 10 10 CECE CC(C)C1(COC(=O)CCc2ccc(N)cc2)COC1 2198496830 NFOPAESSIFIMBQ-UHFFFAOYSA-N 277.364 2.417 10 10 CECE C[C@@H](NC(=O)[C@@H]1CC[C@H]2C[C@H]1CO2)c1ccccc1O 2192618740 ZENQRNRWYLVXEN-OWTLIXCDSA-N 275.348 2.385 10 10 CECE COc1cccc(CN[C@H](C)c2c(O)cccc2O)n1 2181840924 CSHJXFPJQZIORF-SNVBAGLBSA-N 274.320 2.352 10 10 CECE CC(C)C(=O)N1CCN(c2ccc(CN)c(Cl)c2)CC1 2182581795 MZDZQWCEQMFAKQ-UHFFFAOYSA-N 295.814 2.103 10 10 CECE C[C@@H]1C[C@H](N(C)c2cc3c(cc2F)[C@H](O)C(=O)N3)CS1 2189475852 ZQKIATRHCMEMOY-UJVNDKKSSA-N 296.367 2.141 10 10 CECE C[C@@]12CC[C@@](COC(=O)Cc3ccc(N)cc3)(C1)OC2 2193698999 AWMBSBHXCFJNOX-CVEARBPZSA-N 275.348 2.314 10 10 CECE COc1ccc(N2C[C@@H](N)CC[C@@H]2C)cc1OC 2044350118 ZYWCISZXUINVJM-QWRGUYRKSA-N 250.342 2.020 10 10 CECE C[C@@H](F)CN1CCN([C@H]2CCc3cccc(O)c32)CC1 2189984679 DIXNLOXCSWQHBD-OCCSQVGLSA-N 278.371 2.355 10 10 CECE Oc1ccc(CNCCC(F)(F)C(F)F)c(O)c1 2047846353 RYRDIRCBTWWTPR-UHFFFAOYSA-N 267.222 2.478 10 10 CECE CCN[C@H](C)c1ccc(N(C)C2(CCO)CC2)cc1O 2190077675 IDNSFFDVVYIDCV-GFCCVEGCSA-N 278.396 2.414 10 10 CECE CN[C@@H]1CCCc2cc(N3CC(C)(N(C)C)C3)ccc21 2184686257 FZWXIMRVQSRSNS-MRXNPFEDSA-N 273.424 2.424 10 10 CECE C[C@H](O)c1ccc(N2CCN(C)[C@@H]3C[C@@H]32)cc1Cl 2049407855 JQOXJYANYJEZAW-FZZIBODNSA-N 266.772 2.286 10 10 CECE CN(C)CC[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2184742791 CICWNKAWOVQQSB-GUYCJALGSA-N 273.424 2.411 10 10 CECE C[C@H]1CN2CCC[C@H]2CN1c1ccc2c(c1)CC[C@@H]2N 2184743899 OTKQBFSCKBHHJJ-NUTKFTJISA-N 271.408 2.306 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3C[C@@]3(O)C2)c(Cl)c1 2051365282 FAAWMBLFKKXRMG-GLXFQSAKSA-N 267.756 2.354 10 10 CECE C[C@H]1C[C@H](CO)CCN1c1ccc(CN)c(Cl)c1 2052348446 KGHWQBUXMCZXKP-WDEREUQCSA-N 268.788 2.396 10 10 CECE CN(C1CC1)C1CN(c2ccc(CN)cc2Cl)C1 2052835592 LOEKBGFUFUBZPK-UHFFFAOYSA-N 265.788 2.082 10 10 CECE CC(C)CO[C@H](C)C(=O)NCC1(CN=[N+]=[N-])CC1 2054031508 PAWAIPAPTCFVQB-SNVBAGLBSA-N 254.334 2.254 10 10 CECE Nc1ccc(NS(=O)(=O)[C@H]2CCCC[C@@H]2F)cc1 2055352327 RSBOKWMONSXEGS-RYUDHWBXSA-N 272.345 2.291 10 10 CECE C[C@@H](c1ccccc1O)N(C)S(=O)(=O)C[C@@H](C)F 2057400493 WLLKXHSCLQWCOH-ZJUUUORDSA-N 275.345 2.073 10 10 CECE CC(C)[C@@H]1[C@@H](O)CCN1c1ccc(CN)c(Cl)c1 2062179290 OJJOOVWWBDBEAA-UONOGXRCSA-N 268.788 2.394 10 10 CECE CN1CCCc2cc([C@]3(O)CCNCC34CC4)ccc21 2185944821 RIHRAIWASUZHDE-QGZVFWFLSA-N 272.392 2.030 10 10 CECE CC[C@H](N[C@H]1CCO[C@H](C(=O)O)C1)c1ccccc1O 2194355945 FDRDGTIGAMRZJQ-JKOKRWQUSA-N 279.336 2.065 10 10 CECE C[C@H]1CN(c2cc(Cl)c(CN)cc2F)C(C)(C)C(=O)N1 2186204163 UFHHGYHBGZKFPF-QMMMGPOBSA-N 299.777 2.041 10 10 CECE COC12CC(C1)N(c1ccc([C@H](C)N)cc1F)C2 2065708613 ZIVADOLRFGTACW-VOIZVOFFSA-N 250.317 2.213 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)[C@]23CCOC[C@@H]2C3)C1 2194439142 DPLWMAOWUJJUPZ-OBJOEFQTSA-N 278.356 2.352 10 10 CECE C[C@H](COC(F)F)NC(=O)Nc1ccc(N)cc1 2067273478 YCCZKPLLBYDZNS-SSDOTTSWSA-N 259.256 2.018 10 10 CECE CN(CCCN=[N+]=[N-])S(=O)(=O)c1cncc(Cl)c1 2067610041 OGLUQATVMWBCJP-UHFFFAOYSA-N 289.748 2.056 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@]3(C)C[C@]3(CO)C2)c(F)c1 2194502928 BRJRCOGTJFBBFL-ULKVUYOBSA-N 283.318 2.227 10 10 CECE CC[C@H](CN(C)c1ccc(CCN)c(C)c1)OC 2068261651 DTUNDXFFFOESMT-OAHLLOKOSA-N 250.386 2.357 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@H]1CF 2071413650 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COc1ccc(N(C)C[C@H]2CCCCO2)c(CN)c1 2227673114 MZVOVJBXWJJIQR-CQSZACIVSA-N 264.369 2.159 10 10 CECE COc1ccc(N2C[C@H](C)C[C@H](O)[C@H]2C)c(C=O)c1 2227696338 NCQRNWJNYOFLIG-HFAKWTLXSA-N 263.337 2.103 10 10 CECE Cc1cc(CO)ccc1N1C[C@H]2CCCC[C@@]2(CO)C1 2239165944 IPFBBEKRIZGQDJ-WBVHZDCISA-N 275.392 2.476 10 10 CECE OC1[C@H]2C[C@H]1CN(c1ccc(CNC3CCC3)cc1)C2 2240011124 QIAYHBHXAGPPNM-KBPBESRZSA-N 272.392 2.146 10 10 CECE Cc1ncc([C@](C)(O)[C@H](N)c2ccccc2O)s1 2257479099 JYLPTGYWWLQLAQ-OLZOCXBDSA-N 264.350 2.065 10 10 CECE C[C@@H]1CCN[C@@H]1CSCC(=O)c1ccc(O)c(O)c1 2273086878 RFHRTNHWXJXVKU-MWLCHTKSSA-N 281.377 2.012 10 10 CECE OC1C[C@@H]2CC[C@H](C1)N2c1ccc(OCF)cc1 2263933700 LYFKYGSNZFJKLA-FUNVUKJBSA-N 251.301 2.485 10 10 CECE COc1ccc(N(C)[C@@H]2CCC[C@](N)(CO)[C@@H]2C)cc1 2279055360 ZLBAYQCPSXFHHZ-WQVCFCJDSA-N 278.396 2.010 10 10 CECE CN[C@@H](C)c1ccc(N2CCN(C)[C@@H](C)C2)cc1C 2269662647 NJOSUNMHSZVSIF-KBPBESRZSA-N 261.413 2.416 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCN(C)C(=O)C2CC2)c1 2280522605 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C[C@@]1(C[S@@](=O)CCc2ccc(N)cc2)CCCOC1 2344957687 LKYUPVAUGVYNKQ-BEFAXECRSA-N 281.421 2.377 10 10 CECE CCCN(C[C@H]1C[C@@H]2OCC[C@@H]2O1)c1ccc(N)cc1 2354611593 XBZVKQFWKNKOMT-PMPSAXMXSA-N 276.380 2.432 10 10 CECE O=C(N[C@H](C1CC1)C(F)(F)F)c1ccc(O)c(O)c1 1893267293 NVLKSOJCWMOJMS-SNVBAGLBSA-N 275.226 2.169 10 10 CECE CCCNCc1ccc(N(CC)CC(=O)N(C)C)cc1C 50583834 UJYYKYOEYJXPLE-UHFFFAOYSA-N 291.439 2.409 10 10 CECE CCOC(=O)CN(c1ccc(OC)cc1[N+](=O)[O-])C(C)C 50085487 ILMFZQFEUXIFQX-UHFFFAOYSA-N 296.323 2.381 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2CC(=O)C3)cc1OC 54603057 AVWDMKGASBRQQW-PHIMTYICSA-N 261.321 2.404 10 10 CECE CC(C)NC[C@H](O)CCCSc1nccs1 309453772 PDXMWCNCGPRTSH-SNVBAGLBSA-N 260.428 2.374 10 10 CECE CCN(CC)[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2O)C1 173849802 UFJSPPMFQKGYQE-AWEZNQCLSA-N 293.367 2.217 10 10 CECE COCCNCc1ccc(N2CCC2)c(Br)c1 310303742 OJGZWDKTSASPBS-UHFFFAOYSA-N 299.212 2.395 10 10 CECE CC(C)CCCNC(=O)CN(C)c1ccc2c(c1)OCO2 178878151 OCLNJJIPTBIALD-UHFFFAOYSA-N 292.379 2.404 10 10 CECE COc1ccc(O)c(CNC(=O)NCC(C)(C)C)c1 172072081 DLSPVSILEOLFNU-UHFFFAOYSA-N 266.341 2.246 10 10 CECE CC[C@@](C)(N[C@H](C)c1ccc(C)cc1O)C(N)=O 306106107 SJSNAIDVMJOXJZ-QMTHXVAHSA-N 250.342 2.005 10 10 CECE Nc1ccc(-n2nccc2NC(=O)c2ccncc2)cc1 61628782 ATTXHWKSEHVLKV-UHFFFAOYSA-N 279.303 2.102 10 10 CECE CC(=O)c1ccc(O)c(CN2[C@@H]3CC[C@@H]2CC(O)C3)c1 111392257 UCJAGRMJZLOLRQ-ZIAGYGMSSA-N 275.348 2.083 10 10 CECE OCc1ccc(N2C[C@H]3C[C@@H]2[C@@H]3CO)c(C(F)(F)F)c1 2358059435 AYDRTTYXHXQUOI-GIPNMCIBSA-N 287.281 2.015 10 10 CECE CNCc1cc(F)c(N(C)[C@H]2CO[C@@H](C)C2)c(F)c1 401516535 KULQHPMCPSVTOS-GXSJLCMTSA-N 270.323 2.298 10 10 CECE Nc1ccc(CCN2C(=O)NC3(CCCCC3)C2=O)cc1 35677225 XRJQMJWZANCHEY-UHFFFAOYSA-N 287.363 2.066 10 10 CECE CC(C)(N)c1cc(F)c(O)c(Br)c1O 218177803 UKBNQHAUYAVPPG-UHFFFAOYSA-N 264.094 2.193 10 10 CECE COC(=O)c1cnc(-c2ccc(O)c(O)c2)s1 234625581 NGFGADGXLIGEMN-UHFFFAOYSA-N 251.263 2.008 10 10 CECE COC[C@@H](C)Oc1ccc(N2CCC[C@H](N)C2)cc1 70378395 PUMPKMGXUKWKSS-OLZOCXBDSA-N 264.369 2.028 10 10 CECE CC(C)(C)OC(=O)NC1(c2ccc(O)c(CN)c2)CC1 211212013 VGZIKYMYSTYSEO-UHFFFAOYSA-N 278.352 2.365 10 10 CECE CO[C@@H]1CCC[C@H](NCCc2ccc(O)c(O)c2)C1 1172922701 GTKCUURWNLXMJC-QWHCGFSZSA-N 265.353 2.188 10 10 CECE CCN(CC(=O)O)[C@H](C)c1ccc(N(C)C)cc1 86775076 INIFHBWMKYWOOR-LLVKDONJSA-N 250.342 2.220 10 10 CECE CC(C)C[S@@](=O)[C@@H](C)C(=O)Nc1ccc(N)cc1 40970068 PXQVBJQKBABTGS-YPMLDQLKSA-N 268.382 2.001 10 10 CECE COc1ccc(N2CC[C@@H](CO)C2)cc1Br 83869845 BUGAQYLJDPUZTM-SECBINFHSA-N 286.169 2.276 10 10 CECE CNCc1ccc(N2CCC[C@](C)(O)C2)cc1Cl 234445792 RSQDHCOTYQMZAO-AWEZNQCLSA-N 268.788 2.411 10 10 CECE CCCN1CC[C@H](CN)[C@H]1c1ccc2c(c1)CCN2C 250036644 SZRMOZBBISCVJG-NVXWUHKLSA-N 273.424 2.411 10 10 CECE Cn1c(-c2n[nH]cc2CCN)cc2cc(F)ccc21 606595887 QAPGMOCMAQPCQZ-UHFFFAOYSA-N 258.300 2.209 10 10 CECE COC(=O)C[C@H](N)c1c(O)cc(C)cc1Br 260925278 VZFFMVIUOGQITK-QMMMGPOBSA-N 288.141 2.026 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CC[C@@H](C(F)(F)F)C3)ccc21 383344861 TYDPGDFUMLBTPI-RDDDGLTNSA-N 285.269 2.027 10 10 CECE Nc1ccc(CC(=O)CC2=CSC3=NCCN23)cc1 700046810 JADVFKHDMXNGOL-UHFFFAOYSA-N 273.361 2.030 10 10 CECE COCCC1(C)CN(Cc2cccc(OC)c2O)C1 297444850 PXAAWJZMKLDGLJ-UHFFFAOYSA-N 265.353 2.259 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@H]2CCn3nccc3C2)cc1 2165227929 QMKNDNUIHDDWCT-CZUORRHYSA-N 271.364 2.245 10 10 CECE CC(=O)C(=O)COC(=O)CC12C[C@H]3C[C@@H](CC(F)(C3)C1)C2 808541753 QNPAMQDDRLZWGS-CPWXYTRJSA-N 296.338 2.386 10 10 CECE CC(=O)C(=O)COC(=O)c1cncc(-c2cccc(C)c2)c1 808527766 NMVSBBCQVYRKRX-UHFFFAOYSA-N 297.310 2.372 10 10 CECE CCO[C@@H]1C[C@@H](OC)CN(c2ccc(CN)c(Cl)c2)C1 2165447600 BBJHSGHWAYDGNJ-ZIAGYGMSSA-N 298.814 2.429 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3CCNC3(C)C)ccc21 2163097704 QIRQMJMSPJWPHZ-GOEBONIOSA-N 274.408 2.491 10 10 CECE CN1CCC[C@](N)(c2ccc3c(c2)CCCN3C)CC1 2163098278 BPHVJAYKXFDIPZ-QGZVFWFLSA-N 273.424 2.339 10 10 CECE CCOc1cccc(CN(C)[C@@H]2CNCC[C@@H]2C)c1O 2163612810 KSESIPWTUWCERQ-GXTWGEPZSA-N 278.396 2.221 10 10 CECE Cc1cc(CN)ccc1N1C[C@H]2C[C@@H](O)CC[C@H]2C1 398694324 OWTFSSXPQJBTHW-ZNMIVQPWSA-N 260.381 2.051 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NS(=O)(=O)C1CC(C(F)F)C1 2225797231 AKYCEZPQBFFOAF-GEPGNKONSA-N 294.327 2.181 10 10 CECE COc1ccc(CNC(=O)[C@@H]2CC[C@@H]3C[C@H]3C2)c(O)c1 817600678 RUXDPCMBHTUBJI-WZRBSPASSA-N 275.348 2.453 10 10 CECE O=C1Nc2cc(N(CC(F)F)CC(F)F)ccc2[C@@H]1O 719444332 CHRWVZNRQWYNPR-NSHDSACASA-N 292.232 2.009 10 10 CECE CC(C)(CCS(=O)(=O)NCCN=[N+]=[N-])C1CC1 717945630 PKMUMIALIDKJEF-UHFFFAOYSA-N 260.363 2.042 10 10 CECE COc1nscc1C[C@@H](O)c1ccc2c(c1)CCN2C 711555342 OAHPBGBRALZKIZ-CQSZACIVSA-N 290.388 2.420 10 10 CECE COc1cc(O)c(CN2C[C@@H](C)[C@@H]2C)cc1OC 816648691 NOZVOTPBVISFNM-ZJUUUORDSA-N 251.326 2.250 10 10 CECE Cc1cc(N2CC[C@H]3CC[C@H](O)[C@H]2C3)ccc1CO 721585873 XRADHLBLGRNOGP-WQVCFCJDSA-N 261.365 2.227 10 10 CECE CNCc1cc(F)c(N2CC[C@H]3OCC[C@H]3C2)c(F)c1 724838138 GWAOSKPXERJRTO-SMDDNHRTSA-N 282.334 2.299 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1CN(C)c1ccc(CO)c([N+](=O)[O-])c1 2132055918 XUFCLMVRZGNNLV-IWIIMEHWSA-N 264.325 2.425 10 10 CECE CC[C@H](O)c1ccc(N2CCN3CCC2CC3)cc1 722771683 VKLPZPBELITGMO-INIZCTEOSA-N 260.381 2.414 10 10 CECE O=C(NCc1cc(Cl)ccc1O)[C@@H]1C[C@H]1c1cnc[nH]1 824214467 YOHUNTXPRBAXMY-GHMZBOCLSA-N 291.738 2.189 10 10 CECE CCCCCN(CCO)C(=O)/C=C\c1ccc(O)c(O)c1 588407628 PTHSSUHTTUTMOO-VURMDHGXSA-N 293.363 2.122 10 10 CECE CCN(CC)c1ccc(CN2CC(C)(CO)C2)cc1 839145528 MYNGUQFCZMCEQF-UHFFFAOYSA-N 262.397 2.347 10 10 CECE CCN(CCNC(=O)NCc1c(O)cccc1F)C(C)C 916165787 WZCNSIHEVFWDFU-UHFFFAOYSA-N 297.374 2.061 10 10 CECE CN(C)c1ccc(CNC(=O)C2(C(F)F)CC2)cc1 843520098 JSQSDLFUCMVNQW-UHFFFAOYSA-N 268.307 2.414 10 10 CECE Nc1ccc(NC(=O)[C@H]2CCCc3n[nH]cc32)cc1 843291935 FZNOKPOXFDDRKH-NSHDSACASA-N 256.309 2.051 10 10 CECE C[C@@H](N[C@H]1CNOC1)c1ccc(N2CCCCC2)cc1 925870477 UJXWELIXLLABSV-HIFRSBDPSA-N 275.396 2.231 10 10 CECE COc1cccc(CNCCCN(C)CC(C)C)c1O 845995302 BRVYKXOZYFCLKJ-UHFFFAOYSA-N 280.412 2.468 10 10 CECE C[C@@H]1O[C@H](OCc2ccccc2)C[C@@H](N=[N+]=[N-])[C@@H]1N 687769803 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251.301 2.218 10 10 CECE Cc1ccc(CN2CC=C[C@@H](O)C2)c(O)c1Br 2307483397 ZMQGFRDOLCQSHG-LLVKDONJSA-N 298.180 2.196 10 10 CECE Cc1ccc(CN2CCN[C@H]3C[C@H]32)c(O)c1Br 2307565007 HJGQFMCYDYKZEJ-WDEREUQCSA-N 297.196 2.009 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCOC[C@H](F)C1 2315069047 SIMWPCDYYLKWCN-DGCLKSJQSA-N 253.317 2.223 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c(C)c1 2330779805 IHEKOJVANPYMBL-NUEKZKHPSA-N 260.381 2.064 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NS(=O)(=O)[C@H]1CCCC[C@H]1F 2333612679 XNXODNJONAAMIE-DBIOUOCHSA-N 290.364 2.418 10 10 CECE COc1cccc(O)c1CN[C@@H]1CC[C@H]2C[C@@H]1CO2 2334115836 SQKNZIZQSRDBCW-NTZNESFSSA-N 263.337 2.058 10 10 CECE CN(C)c1ccc([C@@]2(O)C[C@@H]3CC[C@H]2C[C@H]3N)cc1 2334461435 MXLKFDOGWSILAV-YUDUHTQSSA-N 260.381 2.088 10 10 CECE N[C@H]1CCCc2cc(N3CCOC[C@H](F)C3)ccc21 2336670676 HTQPXMDHMLIECE-DOMZBBRYSA-N 264.344 2.197 10 10 CECE CCN(CCN=[N+]=[N-])[C@H](C)C(=O)NC1CCCCC1 2337777677 OSVNQVWAAJRRPV-LLVKDONJSA-N 267.377 2.456 10 10 CECE 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CECE CC(C)(C)OC(=O)[C@@H]1CCN[C@@H]1c1cccc(O)c1O 1952824589 VMPKLBKOGIXWCN-ZYHUDNBSSA-N 279.336 2.090 10 10 CECE Cc1ccc(C(=O)NCCc2ccsc2)c(O)c1O 181948390 KIKXYLVISBRKEX-UHFFFAOYSA-N 277.345 2.440 10 10 CECE COC[C@@H](C)CN(C)Cc1ccc(N2CCOCC2)cc1 131909470 JLCGHFGTMYQYSN-HNNXBMFYSA-N 292.423 2.238 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)Cc1cccnc1 36770771 IVLNCJBGGWATIT-UHFFFAOYSA-N 284.363 2.124 10 10 CECE CC(C)N(Cc1ccc(N)cc1)[C@@H](C)C(=O)N1CCCC1 35365452 IUMOTHFXOLALFN-AWEZNQCLSA-N 289.423 2.490 10 10 CECE C[C@@H]1C[C@@H](C)CN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)C1 131341004 GPPZIBHGMBBNLR-UEKVPHQBSA-N 273.380 2.145 10 10 CECE O=C(Nc1ccc(N2CCCC2)nc1)c1cccc(O)c1O 186841230 COVCDESRORYBBL-UHFFFAOYSA-N 299.330 2.345 10 10 CECE CC[C@H](C)NC(=O)[C@H](C)N(c1ccc(CN)cc1)C1CC1 34655531 DGHARCXOIGXAIC-STQMWFEESA-N 289.423 2.417 10 10 CECE CCC(=O)NCc1nc(-c2ccc(O)c(O)c2)cs1 49699366 CJSIQDMQJMHCKN-UHFFFAOYSA-N 278.333 2.248 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)NC[C@@H](C)CO)c1 86629528 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10 10 CECE CCOC(=O)[C@H](N)c1c(O)cc(C)cc1Br 260219633 UKJYXGGRGDRWEY-SNVBAGLBSA-N 288.141 2.026 10 10 CECE CC[C@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(C)cc1O 279949796 BQHMZDCXHXRNLQ-JSGCOSHPSA-N 276.380 2.362 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@]2(O)CCO[C@@H]2C)cc1 2163149898 OXWSCORQESTPLW-KCXAZCMYSA-N 278.396 2.073 10 10 CECE CCc1cccc(CN2C[C@@H]3CC[C@H](C2)N3C)c1O 723686040 KVWBJHCWTDPGDS-GASCZTMLSA-N 260.381 2.233 10 10 CECE C[C@@H]1C[C@@H]1N(CCO)c1ccc(CN)c(C(F)(F)F)c1 2167107274 SQSFUKFAXOHKQR-RNCFNFMXSA-N 288.313 2.371 10 10 CECE O=C(N[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F)c1ccc(O)c(O)c1 2165985667 IZYPSOCYWVXJRP-BBBLOLIVSA-N 283.274 2.261 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC(C(=O)O)=C(F)C1 2167851171 PWHTXMSAEXOPPG-QMMMGPOBSA-N 281.283 2.173 10 10 CECE C[C@@H]1O[C@H](C)[C@H]([C@@H](NN)c2ccc(N(C)C)cc2)[C@H]1C 2163107172 NJUQEAQWBDFFNN-KSMPYDNASA-N 277.412 2.317 10 10 CECE CC(C)CC1(O)CN(c2ccc3c(c2)CC[C@H]3N)C1 2131839425 ROSBIHXGPGGLFM-OAHLLOKOSA-N 260.381 2.230 10 10 CECE 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10 10 CECE CC1CC(NC(=O)NCc2c(O)cccc2F)C1 921236853 MRWAMACQGRIPJO-UHFFFAOYSA-N 252.289 2.129 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)NC[C@@H]2C[C@@H]2C)c1 756456349 OHGYWIZEZGGXAZ-NHCYSSNCSA-N 263.337 2.485 10 10 CECE CC[S@](=O)CCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756577949 SYZQGSPMKMDOLZ-KKRWKGTOSA-N 285.384 2.438 10 10 CECE Cc1nc(C[C@@H](O)Cc2ccc(N)cc2)sc1C 696578203 JVIYDQOGJXMJTQ-ZDUSSCGKSA-N 262.378 2.488 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 869891495 POQYBINMVXRBJD-SASUGWTJSA-N 290.315 2.116 10 10 CECE C[C@@H]1C[C@H]2CN(Cc3cc(F)cc(F)c3O)CCN2C1 1876169431 RKNAAIOEMUYKGX-MFKMUULPSA-N 282.334 2.196 10 10 CECE O=C(CC[C@@H]1CCOC1)N1Cc2cccc(O)c2C1 871202809 GRUNZCQLHFVBJS-LLVKDONJSA-N 261.321 2.051 10 10 CECE Cc1ccc(CNCC=CCO)c(O)c1Br 1905180127 TWFUWWJUZFRDGR-UHFFFAOYSA-N 286.169 2.101 10 10 CECE CC(C)SC[C@@H](N)C(=O)N[C@@H](C)c1ccccc1O 1877595843 ODKIRNIGRCLACL-CMPLNLGQSA-N 282.409 2.038 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@H]1CC[C@@H]2CNC[C@@H]21 1877545633 PQDZNILSFYPWRM-RJZRQDKASA-N 260.381 2.383 10 10 CECE C[C@H](NC(=O)C[C@H]1CCCCN1)c1ccccc1O 1877588682 XGMZFJYYZJCIJG-NWDGAFQWSA-N 262.353 2.102 10 10 CECE Cc1ccc(CN)c(N(C)Cc2ccccc2O)n1 1877528554 GRAOZZDTXRSQIO-UHFFFAOYSA-N 257.337 2.191 10 10 CECE CNCCN(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 1956285019 QOHYNGGJRXNLBS-UHFFFAOYSA-N 293.411 2.367 10 10 CECE O=C(O)[C@@H]1C[C@@H]1c1csc(-c2ccc(O)c(O)c2)n1 1879524163 RLXVBHORLFLZFI-JGVFFNPUSA-N 277.301 2.409 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)Cc2ncon2)c(F)c1 1880925021 CADYGQGZZMLIMO-SSDOTTSWSA-N 268.267 2.004 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](O)[C@H](C)C2)c(F)c1 1880929152 SLKJCZCCIFDOJZ-VYUIOLGVSA-N 270.323 2.192 10 10 CECE CC(C)[C@@H](O)CN(C)c1c(F)cc([C@H](C)N)cc1F 1880930388 ATXIHERFDZDEBW-ZANVPECISA-N 272.339 2.438 10 10 CECE CCOc1cccc(CN[C@]23CCOC[C@H]2C3)c1O 1880136762 GCACEQHEONPKLS-DOMZBBRYSA-N 263.337 2.060 10 10 CECE O=C(Cc1ccsc1)NCc1cccc(O)c1O 1303194002 WJAFQMCXSFZMRK-UHFFFAOYSA-N 263.318 2.018 10 10 CECE Oc1cccc(O)c1CNc1ncncc1Br 1307216250 RJQDVYZSAFWXNS-UHFFFAOYSA-N 296.124 2.262 10 10 CECE NCc1ccc(N2CC[C@H](F)C2)c(Br)c1 701652798 CILIYHWPWRTMSF-VIFPVBQESA-N 273.149 2.456 10 10 CECE CN1C[C@]2(C)CN(Cc3ccccc3O)C[C@@]2(C)C1 706219842 NTMMZGVDRVLBRM-HZPDHXFCSA-N 260.381 2.166 10 10 CECE NC[C@]12CCC[C@H]1CCN2c1ccc2c(c1)CCO2 1889581336 RXFGUGTVRBTHMO-XJKSGUPXSA-N 258.365 2.329 10 10 CECE CSC[C@@H]1CCN(c2cc3c(cc2F)[C@@H](O)C(=O)N3)C1 706756018 OYYULXZSGUMZPN-AMIZOPFISA-N 296.367 2.001 10 10 CECE CSC[C@H]1CCN(C(=O)CCc2ccc(N)cc2)C1 706810990 QCVAYDGXRHKCKK-ZDUSSCGKSA-N 278.421 2.413 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCCSCC1 692448183 LQTSCWBAFNXJPT-NSHDSACASA-N 272.374 2.105 10 10 CECE COc1ccc(CN2CC[C@@H](C)O[C@H](C)C2)c(O)c1 709856532 YCYFNJWCLDTHIA-VXGBXAGGSA-N 265.353 2.400 10 10 CECE C[C@@]1(C(F)(F)F)CN(c2ccc(CN)cc2F)CCO1 712834669 RKGXHRKTFFEIBC-LBPRGKRZSA-N 292.276 2.442 10 10 CECE Cc1cc(N2CC[C@@H](CN(C)C)C2)ccc1C[C@@H](C)N 688525485 DVHGSPPQSFWUMC-CABCVRRESA-N 275.440 2.273 10 10 CECE C[C@H](NCC[C@@H](O)C(F)(F)F)c1cc(F)ccc1O 717344970 CWORKJBINMLTQK-WRWORJQWSA-N 281.249 2.495 10 10 CECE CC[C@H]1CN(C(=O)CCc2ccc(N)cc2)C[C@@H](C)O1 689161822 UCOGRDDFHBRKSL-DOMZBBRYSA-N 276.380 2.227 10 10 CECE CC[C@H]1CN(c2c(F)cc(CN)cc2F)C[C@@H](C)O1 689108521 HGIQIDVFISAFCH-KOLCDFICSA-N 270.323 2.427 10 10 CECE CCCOc1cc(N2C[C@H]3COC[C@H]3C2)ccc1N 718147937 CLUIFJGPFQSPNC-TXEJJXNPSA-N 262.353 2.140 10 10 CECE Oc1cc(Br)ccc1CN1C[C@H]2COC[C@@H]2C1 718153161 IYACLMNMMLCOJK-QWRGUYRKSA-N 298.180 2.233 10 10 CECE COc1ccc(O)c(CNC[C@H]2CC[C@@H](C3CC3)O2)c1 722334335 SSPSWAOLPCBCSK-ZBFHGGJFSA-N 277.364 2.448 10 10 CECE C[C@H](NCc1cnccn1)c1ccc(N(C)C)cc1 698142285 KGANCWBDGVUBCV-LBPRGKRZSA-N 256.353 2.393 10 10 CECE COC(=O)[C@@](C)(NCCCN=[N+]=[N-])c1cccc(O)c1 90259469 HVYNOSXVVNZALR-ZDUSSCGKSA-N 278.312 2.070 10 10 CECE COc1ccc(O)c(CN2CCC[C@@H]3COCC[C@@H]32)c1 775735672 BFMHNYDZRGIPGF-DOMZBBRYSA-N 277.364 2.402 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@]1(C)C(=O)NCCCN=[N+]=[N-] 1963699677 QVKIFPRJJAEJNE-ZDUSSCGKSA-N 297.359 2.203 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2CN(C)C[C@@]2(C)C1 897620308 MEEUODRZBYJFFD-CJNGLKHVSA-N 260.381 2.084 10 10 CECE CC1(F)CN(c2ccc(CN)cc2Br)C1 1930299688 QIGQVZUIMRXINN-UHFFFAOYSA-N 273.149 2.456 10 10 CECE Nc1ccc(N2CCO[C@H]([C@H]3CCCCO3)C2)cc1 2115137217 CLCJMLBJEZBMJU-CABCVRRESA-N 262.353 2.043 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H]2C[C@H]3O)c(Cl)c1 2115467508 LPAKYLUBIFKBAA-TYNCELHUSA-N 280.799 2.409 10 10 CECE COc1cccc(O)c1CNC[C@H]1CC[C@@H](C)CO1 2117402517 HQLIOWAGGRBDBR-VXGBXAGGSA-N 265.353 2.306 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H]2[C@@H]3CCO[C@@H]32)c(F)c1 2119943030 QBHRAINDMINSFG-FQMFCJFBSA-N 264.344 2.317 10 10 CECE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](C)[C@@H]1C 1626890406 YMQJADJEYZGZIO-MXWKQRLJSA-N 263.337 2.143 10 10 CECE CCSC[C@@H](N)CNCc1cnc(SC)s1 2243856284 NREKMTOYCWSENL-QMMMGPOBSA-N 277.484 2.035 10 10 CECE Cc1ccc(C(=O)NCc2c(O)cccc2F)cn1 1638862845 FNEDTTHRUAPYEP-UHFFFAOYSA-N 260.268 2.165 10 10 CECE O=C(COC(F)F)NCc1c(O)ccc2ccccc12 1639387450 LABHVVVHSHLEEC-UHFFFAOYSA-N 281.258 2.401 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCS(=O)(=O)C1CCCC1 2123014729 GWULPOWMCHFNFJ-NSHDSACASA-N 286.401 2.119 10 10 CECE Cc1cccnc1C(=O)NCc1c(O)cccc1F 1652295448 JKXYXOSVGHEQLN-UHFFFAOYSA-N 260.268 2.165 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H](F)Cc1ccccc1 1651225274 CPSRODMRBRYFAU-AWEZNQCLSA-N 289.306 2.295 10 10 CECE Cc1ccc(C(=O)NCc2cc(O)ccc2O)s1 1651222664 LXOBTQKWDGYWJZ-UHFFFAOYSA-N 263.318 2.398 10 10 CECE O=C(NCc1c(O)cccc1F)NOC/C=C\Cl 1681738154 CGIUPWYDZBMYNU-DJWKRKHSSA-N 274.679 2.015 10 10 CECE CO[C@H](CO)CN[C@@H](C)c1ccc2ccccc2c1O 1964493390 KDACCUHQFXKMER-AAEUAGOBSA-N 275.348 2.203 10 10 CECE Cn1ncc2c1CCC[C@H]2NCc1ccc(F)cc1O 1964545910 XOTAVRKKHTXBSK-CYBMUJFWSA-N 275.327 2.432 10 10 CECE Oc1cc(F)ccc1CN1CCO[C@@H](C(F)(F)F)C1 1964579107 KQRGRXRUBWSMGY-LLVKDONJSA-N 279.233 2.294 10 10 CECE CCOc1cccc(CN(C)[C@H]2CCC[C@H]2CN)c1O 250524708 WENKXNLZZOQNMX-JSGCOSHPSA-N 278.396 2.350 10 10 CECE CN(C)c1ccc(C2(O)CC(n3ccnc3)C2)cc1 2125723846 UYSUDBZQQMXVRF-UHFFFAOYSA-N 257.337 2.172 10 10 CECE COc1ccc(OC)c(NN=NC[C@H](C)NC(C)=O)c1 1860494462 HTHHLUYSMDAIFM-VIFPVBQESA-N 280.328 2.008 10 10 CECE COc1ccc(O)c([C@H]2CN[C@@H](C(C)C)CN2C)c1 251385779 IQROWTVSNNKDPX-ZIAGYGMSSA-N 264.369 2.002 10 10 CECE OCc1ccc(N2CCCC3(CC(O)C3)C2)c(F)c1 2129557728 XTOANZOVRVAPIO-UHFFFAOYSA-N 265.328 2.059 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2N)[C@@H]1COC2CC1C2 2128329769 YEALDRQLCHTKER-MOBWVJJFSA-N 258.365 2.246 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H]3CCO[C@H]3C2)cc1O 2128306274 JIVOLNRIKXMWFZ-PGUXBMHVSA-N 263.337 2.061 10 10 CECE CCN[C@H]1CCc2cc(N3CC[C@@]3(C)CO)ccc21 2128311455 VBASATLIWOJORU-HOTGVXAUSA-N 260.381 2.245 10 10 CECE COc1cccc(CNCCc2ncoc2C)c1O 2128995934 PARQYFCDSGXFAB-UHFFFAOYSA-N 262.309 2.030 10 10 CECE CN(CCCN=[N+]=[N-])CC[C@H]1CN2CCC1CC2 1912161896 OQZQFDNPAIIWIY-ZDUSSCGKSA-N 251.378 2.351 10 10 CECE CC(C)N(C(=O)CN1CC[C@H](CN=[N+]=[N-])C1)C(C)C 1912167390 KIXBHPNROCEXJE-GFCCVEGCSA-N 267.377 2.264 10 10 CECE NCc1ccc2c(c1)CCN2CCn1cc(Cl)cn1 2133393774 BHLCIMMCNZRVOK-UHFFFAOYSA-N 276.771 2.058 10 10 CECE CO[C@H]1C[C@H](CF)N(c2ccc3c(c2)CC[C@H]3N)C1 2133708796 MSJTUIKIXXJWFY-VNHYZAJKSA-N 264.344 2.196 10 10 CECE CC[C@H]1CO[C@@H](C)CN1c1ccc(CN)c(OC)c1 2139686284 JCAHNXGVKQKZTK-AAEUAGOBSA-N 264.369 2.158 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H](N(C)c3ccc(CN)cc3)C[C@H]21 2133902236 MCPPIJZXTUJDGJ-ARLBYUKCSA-N 260.381 2.395 10 10 CECE CN(CCOC1CC1)c1c(F)cc(CN)cc1F 1914541310 DSEXCQJUZLGWGQ-UHFFFAOYSA-N 256.296 2.039 10 10 CECE CN[C@@H](C)c1ccc(N(C)C2CC(O)C2)c(F)c1 1914597044 VXIBOFNVKRPKIS-GCVQQVDUSA-N 252.333 2.066 10 10 CECE CCNCc1ccc(OC)c(CN(C)CCF)c1 1917007413 WFVVXWORDLJORE-UHFFFAOYSA-N 254.349 2.206 10 10 CECE Cn1ccc(CNCc2ccc(N3CCCC3)cc2)n1 112340968 VWODECQUSGRXFU-UHFFFAOYSA-N 270.380 2.310 10 10 CECE CC[C@@H](COC)n1cc(COc2ccc(N)cc2)nn1 1968178719 CXTROJGGFLXHCV-ZDUSSCGKSA-N 276.340 2.037 10 10 CECE COC[C@]1(CN[C@H](C)c2ccc(F)cc2O)CCCO1 1967528360 JSVPLSGPPIADSF-IAQYHMDHSA-N 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10 10 CECE COc1ccc(N2CC[C@H](C)[C@@H](N)[C@@H]2C)c(OC)c1 2106369693 DQYRZBOVCHWUFW-ZIBATOQPSA-N 264.369 2.266 10 10 CECE CCN1CCc2cc([C@@H](NN)c3nccs3)ccc21 2106852248 DAXOUBRUVYQGRU-CYBMUJFWSA-N 274.393 2.078 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCNC12CC2 2106829090 SUTKHSWCKFKDLW-INIZCTEOSA-N 258.365 2.000 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@@H]1CC1(C)C 2106860478 SIUXNMNRVVRLTR-RRFJBIMHSA-N 262.397 2.420 10 10 CECE C[C@@]1([C@@H](O)c2ccc(N3CCCC3)cc2)CCCN1 2106830601 IFGQKLXOHFCMQQ-HOTGVXAUSA-N 260.381 2.462 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3C=C[C@H](N)C3)ccc21 2106802462 VBQNUOHIPRRSKZ-YCPHGPKFSA-N 258.365 2.006 10 10 CECE Oc1ccccc1CN[C@@H]([C@H]1CCOC1)C(F)(F)F 2087334092 ARYZUIVQOFDWQT-JQWIXIFHSA-N 275.270 2.449 10 10 CECE CCC[C@@H](CN)[C@@H](N)c1ccc2c(c1)CCN2CC 2107810581 AIEKLEQUIOHKGA-HOCLYGCPSA-N 261.413 2.444 10 10 CECE Oc1ccc(CN[C@H]2CC[C@H]3CC[C@H]2OC3)cc1O 2088259837 ALZDVSKBDYKWTC-ITDIGPHOSA-N 263.337 2.145 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@H]3CC[C@H]2OC3)c(O)c1 2088263026 WTQJVQMNDQGYFS-PSOPSSQASA-N 263.337 2.145 10 10 CECE CCN[C@H](C)c1ccc(N2CC=C[C@H](O)C2)c(F)c1 2108778460 DUOJKTGWGQQWOP-YPMHNXCESA-N 264.344 2.233 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](OC)[C@H](F)C2)c(F)c1 2090282759 VEHKWNXVKUVTBQ-IUPBHXKESA-N 270.323 2.279 10 10 CECE COc1ccc(CN[C@@H]2C[C@H](CO)[C@@H]3C[C@@H]23)cc1C 2110542665 FCIQWYKKTSHHGJ-LXTVHRRPSA-N 261.365 2.110 10 10 CECE COc1ccc(N2CCCC[C@H]2C(C)(C)O)c(N)c1 2093110216 AEQUFNKMKVQZLH-AWEZNQCLSA-N 264.369 2.407 10 10 CECE CCn1nccc1CN(C)CCc1ccc(N)cc1 2094313018 BNOZOEWKNGEEEY-UHFFFAOYSA-N 258.369 2.160 10 10 CECE C[C@@H](N)c1ccc(N2CC(C)(C)C[C@@H]2CO)cc1O 2094750788 JLADFHPYHOIDPN-ZYHUDNBSSA-N 264.369 2.009 10 10 CECE CN[C@H](c1ccccc1O)c1cccc2nccn12 2095388917 SGJVMQQAEALPLX-OAHLLOKOSA-N 253.305 2.349 10 10 CECE COc1ccc(O)c([C@H](C)NCc2ccnnc2)c1 2095523971 GQODYZWNMQZJDI-JTQLQIEISA-N 259.309 2.042 10 10 CECE Cc1c(CN(C)c2ccc([C@@H](C)N)cc2)cnn1C 2096575794 GZXASHFYEREQJX-LLVKDONJSA-N 258.369 2.385 10 10 CECE C[C@H](NC1CC2(CCOC2)C1)c1cc(O)ccc1O 2097792745 PLFYKYZYQMFITO-NLTNOIMHSA-N 263.337 2.318 10 10 CECE Nc1ccc(CCN2CC3(CC[C@@H]2CO)CC3)cc1 2097877111 LYDFNAGQIIPIKK-OAHLLOKOSA-N 260.381 2.048 10 10 CECE CN1[C@H]2CC[C@@H](NCc3ccc(N)cc3)C[C@H]1CC2 2097922834 HMNZSXHTYLFXEF-OWCLPIDISA-N 259.397 2.374 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CC2=CSC3=NCCN23)CC1 2099341237 LBIKSFMEKBYRDO-SNVBAGLBSA-N 278.385 2.411 10 10 CECE CCN(C)C[C@@H]1CCCN(c2ccc(CO)cc2)C1 2113976142 YRASHWITXCSBSK-HNNXBMFYSA-N 262.397 2.347 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3CN(C)CC[C@H]32)c1 2114506200 ZQLLXXBNRPBFEO-DZGCQCFKSA-N 260.381 2.227 10 10 CECE C[C@@H]1OCC[C@@H]1C[C@@H](N)c1ccc2c(c1)CCN2C 2121176851 UTIBJIQEUYLPLJ-YWPYICTPSA-N 260.381 2.494 10 10 CECE COc1ccc(CNCC23COC(CF)(C2)C3)c(O)c1 2202752235 NOFUSBFDVYVSJC-UHFFFAOYSA-N 281.327 2.009 10 10 CECE COc1cc(N(C)C[C@@]2(C)CCCOC2)ccc1CN 2204557875 VHOJGJWAZIHRQV-MRXNPFEDSA-N 278.396 2.407 10 10 CECE COc1cc(N2C[C@@H](C)[C@@H](O)C2)ccc1CNC(C)C 2204554075 LEEPQKOLFROMBV-DOMZBBRYSA-N 278.396 2.010 10 10 CECE COc1cc(N(C)CCCn2cccc2)ccc1CN 2204552820 ASXQESFVLFZHLG-UHFFFAOYSA-N 273.380 2.482 10 10 CECE COc1cc(N(C)C[C@@H]2[C@H]3CCCO[C@@H]23)ccc1CN 2204536551 NUODAJDFNQMSCT-IIAWOOMASA-N 276.380 2.015 10 10 CECE Cc1ccc(CN2CC[C@](CCF)(C(=O)O)C2)c(O)c1 2204631850 PEFZKTCCHMRWRW-HNNXBMFYSA-N 281.327 2.337 10 10 CECE Cc1cccc(CNC(=O)[C@H](O)c2ccccc2)c1O 2204610574 MPRXTAKQZCPIQB-OAHLLOKOSA-N 271.316 2.050 10 10 CECE C[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)NC(=O)[C@H]2O 2205110822 NPPPYTKFDWWBQZ-DDIVZENXSA-N 272.348 2.439 10 10 CECE COc1ccc(N2C[C@@H](CO)CC2(C)C)cc1F 2219611224 YVYWMZASAQIVEI-JTQLQIEISA-N 253.317 2.432 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](OC(F)F)C2)cc1O 2230673807 OWOWKDOQZUKXDG-WPRPVWTQSA-N 273.279 2.263 10 10 CECE C[C@@H](O)CN(C)c1ccc(CNC2CCC2)cc1F 2231477756 YMWPNNVAXFZZJR-LLVKDONJSA-N 266.360 2.285 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)Cc1ccncn1 2232095794 JJIYIQJLRXHWGB-LBPRGKRZSA-N 257.337 2.475 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC[C@@H](CN(C)C)C1 2232101578 ZIGLDMJGGMQXSB-KGLIPLIRSA-N 262.397 2.436 10 10 CECE Cc1cc(N2CC[C@H]3[C@H](CCC[C@H]3O)C2)ccc1CN 2233837136 PEQIKDMDZTXSEV-HYVNUMGLSA-N 274.408 2.441 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)Cc1sccc1C(=O)O 2234168255 ZXUQZNINZXOYFB-DTWKUNHWSA-N 294.336 2.336 10 10 CECE CNCc1ccc(N2[C@H]3CCC[C@H]2CN(C)C3)cc1C 2234734424 MPAYCEYVKRYUDF-IRXDYDNUSA-N 273.424 2.387 10 10 CECE CO[C@@H]1C[C@H](CO)N(c2ccc(OC3CCC3)cc2)C1 2234883181 MKTDFZFKGZKFGS-CZUORRHYSA-N 277.364 2.204 10 10 CECE COC[C@@]1(O)CCN(c2ccc(OC3CCC3)cc2)C1 2234886798 NLUJATMWZFVBFH-MRXNPFEDSA-N 277.364 2.206 10 10 CECE C[C@@H]1Cc2cc(N3[C@H]4CC[C@H]3[C@@H](F)[C@H](O)C4)ccc2O1 2235060787 FFTGMVYLGZQKMB-CXITWPJZSA-N 277.339 2.450 10 10 CECE COc1ccc(N2C[C@H](CO)C3(CCC3)C2)cc1OC 2235127703 VNPZTZJHOGDGGZ-GFCCVEGCSA-N 277.364 2.303 10 10 CECE CCCCN(c1ccc(OC)cc1CCN)C1COC1 2235974925 NVNQTOYUKOGFRR-UHFFFAOYSA-N 278.396 2.202 10 10 CECE CCNCc1cc(OC)ccc1N1CCC[C@H](OC)C1 2235974613 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O[C@@H]1C[C@@H]2CN(c3ccc(CNC4CCC4)cc3)C[C@H]21 2240049841 QALJDYMYWLACEW-KBRIMQKVSA-N 272.392 2.146 10 10 CECE O[C@H]1CCCN(c2ccc(CNC3CCC3)cc2F)C1 2240053786 TUBGSTFMZMLWDC-AWEZNQCLSA-N 278.371 2.429 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@@H]3[C@@H]2CO)c(C)c1 2240754901 BBWTZFCPAZNQNH-DYWXZXKOSA-N 274.408 2.483 10 10 CECE COCCNCc1ccc(OCCOCCF)c(C)c1 2240962513 RUSXCTPINVRTMH-UHFFFAOYSA-N 285.359 2.096 10 10 CECE CSc1ncc(CNCC[C@H](N)C(C)C)s1 2243845424 XQGAMGXOAGECHO-JTQLQIEISA-N 259.444 2.328 10 10 CECE CCNCc1ccc(OC)c(C[S@](=O)C[C@@H](C)OC)c1 2283926095 JEXXWRCFHSWCEL-MPBGBICISA-N 299.436 2.088 10 10 CECE COc1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]3C2)c2c1CCC2 2284525154 QUKZJGGWIGAMOS-WQGACYEGSA-N 273.376 2.391 10 10 CECE CCCC[C@H](N)CC(=O)NCc1cnc(SC)s1 2257015033 VJDQBGVKZWBDFR-VIFPVBQESA-N 287.454 2.389 10 10 CECE COc1cc(C)c(N2CC[C@](F)(CO)C2)c(C)c1 2257416751 UBJGHGHILNMSRF-CQSZACIVSA-N 253.317 2.223 10 10 CECE Cc1ccc(O)c(CN2C[C@H](CC(=O)O)C[C@@H]2C)c1 2270172675 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CECE CCCN(Cc1ccc(N)cc1)S(=O)(=O)C(F)F 35064507 NENXYKDJPYALAS-UHFFFAOYSA-N 278.324 2.033 10 10 CECE CCOCCN1CCN(Cc2cccc(C)c2O)C[C@@H]1C 180086601 XCMQIRZEIMCICK-HNNXBMFYSA-N 292.423 2.243 10 10 CECE CCN(Cc1cc(Cl)ccc1O)[C@H]1CCNC1 71312006 ADHFZWJYARZEHN-LBPRGKRZSA-N 254.761 2.229 10 10 CECE CC[C@H](C)N(C)CCNCc1cccc(F)c1O 226590724 QWXIKZAUYUDDTR-NSHDSACASA-N 254.349 2.351 10 10 CECE COc1cc(S(=O)(=O)Nc2ccc(O)cc2)ccc1F 190711748 VGETZMOLPPZWPW-UHFFFAOYSA-N 297.307 2.341 10 10 CECE CC1(CNCc2ccc(O)c(O)c2O)CCCC1 226755048 CVDGJTIQOQXVNK-UHFFFAOYSA-N 251.326 2.473 10 10 CECE CCc1cc(CN(C)Cc2ccc(N)cc2)n(C)n1 89186026 OQVJHYVMSUIEQX-UHFFFAOYSA-N 258.369 2.197 10 10 CECE COc1cc(Br)c(F)c(C(C)(C)N)c1O 238449436 UYYFORKQBPOINE-UHFFFAOYSA-N 278.121 2.496 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1cccc(C)c1 90259438 ILBJJWZTFUWCEB-GFCCVEGCSA-N 262.313 2.499 10 10 CECE CC(C)N1CC[C@H](N)[C@H]1c1ccc2c(c1)CCN2C 250518000 RIQNOWBBAQSRGM-GOEBONIOSA-N 259.397 2.161 10 10 CECE Oc1cc(Br)c([C@@H]2CCCN2)c(F)c1O 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CECE C[C@H](O)c1ccc(N2C[C@H](CO)OCC2(C)C)cc1Cl 2167523837 YFRFHEVSTVSFHI-CMPLNLGQSA-N 299.798 2.369 10 10 CECE COc1cccc([C@@H](N2CCNCC2)C(C)(C)C)c1O 575264566 IKMMJLTUWLXMPA-OAHLLOKOSA-N 278.396 2.393 10 10 CECE Oc1ccccc1[C@H](CC(F)(F)F)N1CCNCC1 575285991 SRYMNYNMFBKFEZ-NSHDSACASA-N 274.286 2.291 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CC23CC3)c1 818355329 CSTWBCINOIROIB-NOZJJQNGSA-N 261.321 2.382 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)C1(C(F)(F)F)CC1 720304746 SWRWCJREVPFLTJ-SNVBAGLBSA-N 285.269 2.170 10 10 CECE CC[C@H](c1ccccc1O)N(C)[C@H]1CC(=O)N(C)C1 2131936034 QQCDQGHURMTWIB-WCQYABFASA-N 262.353 2.006 10 10 CECE CO[C@@]1(CO)CCCN(Cc2c(O)cccc2Cl)C1 826952412 JYZPPIKEGJQMTO-AWEZNQCLSA-N 285.771 2.019 10 10 CECE CCCN[C@H](C)c1ccc(N(C)CCNC(C)=O)cc1 723153222 JUNHHMZBKVHOCE-CYBMUJFWSA-N 277.412 2.320 10 10 CECE CN(C)c1ccc(/C=C\CNC2(C(=O)O)CCC2)cc1 904007546 MLEWZVDDVBTGOP-HYXAFXHYSA-N 274.364 2.363 10 10 CECE CCOc1ccc(CN[C@@H]2CCCCNC2)c(O)c1 841089160 FUGCQTNVQBXMGM-CYBMUJFWSA-N 264.369 2.023 10 10 CECE CN(C)c1ccc(/C=C/CN2CCNC[C@H]2C(F)F)cc1 843124432 AGRQTPWIJWHIIU-BWPKMQGJSA-N 295.377 2.305 10 10 CECE CCN1C[C@@H](CN[C@H](C)c2ccc(N(C)C)cc2)OC1=O 846861748 RFGJONOIGUPQSY-IUODEOHRSA-N 291.395 2.244 10 10 CECE CCN(CC)c1ccc(CN(C)C2CNC2)cc1F 843124447 ASDGRIDEJNTACL-UHFFFAOYSA-N 265.376 2.076 10 10 CECE CCN(CCO[C@@H]1CCOC1)c1ccc(OC)c(OC)c1 929898253 SAPZACYNMCFPJY-CQSZACIVSA-N 295.379 2.336 10 10 CECE CCN(CCCO[C@H]1CCOC1)Cc1ccc(N)cc1 699539767 SVZCPBZASOKNIN-INIZCTEOSA-N 278.396 2.286 10 10 CECE Cc1ccc(/C=C\C(=O)N(C)c2ccc(C(N)=O)cc2)cn1 754171071 UZPZDCZPWZEFPJ-YHYXMXQVSA-N 295.342 2.165 10 10 CECE CCOc1ccc(CN(C[C@@H](C)O)C(C)C)c(O)c1 769343647 RTBDWYNFAFCTTE-GFCCVEGCSA-N 267.369 2.382 10 10 CECE COC(=O)C(C)(C)CSc1ncc([N+](=O)[O-])s1 866008094 QSRLUKPHRGSRFO-UHFFFAOYSA-N 276.339 2.343 10 10 CECE Cc1cc(CNC(=S)N[C@@H](C)c2ccccc2O)no1 865270519 SXDRQMFXAKZAOR-JTQLQIEISA-N 291.376 2.414 10 10 CECE COc1ccc2c(c1)CCN2C(=O)/C=C/c1cn(C)cn1 931141373 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CC1(C)CCOCCN1C(=O)Nc1ccc(N)cc1 2126003637 SPNXGOCCNBJBJF-UHFFFAOYSA-N 263.341 2.302 10 10 CECE CN(Cc1ccc(O)c(O)c1)[C@@H]1CCCC[C@H]1CN 250233319 NENGKPYULSBKKD-QWHCGFSZSA-N 264.369 2.047 10 10 CECE O=C(Nc1ccc(O)cc1C(=O)O)c1cnc(Cl)s1 2126226461 BXBVEWVKXSVDRV-UHFFFAOYSA-N 298.707 2.453 10 10 CECE CC1=CCN(c2cc3c(cc2Cl)[C@@H](N)C(=O)N3)CC1 167786841 PTFJNSPLNKMZON-CYBMUJFWSA-N 277.755 2.448 10 10 CECE CN1CCCc2cc(N3CC[C@@]4(CCNC4)C3)ccc21 250413070 WTOVZRGKVTWJOR-QGZVFWFLSA-N 271.408 2.259 10 10 CECE CN(c1ccc2c(c1)OCCO2)C1CCC(N)CC1 258919958 YAYRPIKTMDEOIM-UHFFFAOYSA-N 262.353 2.164 10 10 CECE CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)n1ccc(=O)cc1 33507495 VGGKAVWQRGMMLG-HNNXBMFYSA-N 285.347 2.266 10 10 CECE CN[C@@H]1CCCc2cc(N3CC[C@](C)(O)C3)ccc21 2128279787 TYNZAZMVVKOJQL-CVEARBPZSA-N 260.381 2.245 10 10 CECE CN(C[C@H]1CCC[C@@H]1O)c1ccc2c(c1)CC[C@H]2N 2128295384 NOKBNWCCUWOMJW-WQVCFCJDSA-N 260.381 2.230 10 10 CECE O[C@@H]1CCCc2cc(N3C[C@@H]4CCO[C@H]4C3)ccc21 2128272694 HSAKFCAEABZPPU-MAZHCROVSA-N 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CC[C@@H]1C(=O)NCCN1c1ccc([C@H](C)N)cc1Cl 110680446 QKOBEQWGXHXYRK-JOYOIKCWSA-N 281.787 2.075 10 10 CECE Oc1ccc(CNCCOC2CCCCC2)c(O)c1O 226754111 UMAJCEMRONEDCN-UHFFFAOYSA-N 281.352 2.242 10 10 CECE Nc1ccc(OC[C@H](O)COCCC2CCC2)cc1 229425901 VRZAMNXESUAQMO-CQSZACIVSA-N 265.353 2.215 10 10 CECE CN(CCc1ccc(N)cc1)C[C@]1(C)CSCCO1 2136545574 GMWTUKJDPVINBE-OAHLLOKOSA-N 280.437 2.265 10 10 CECE CCN=c1ccc(F)c(NCc2ccccc2O)[nH]1 2139614727 GSUKGSICWLKCPI-UHFFFAOYSA-N 261.300 2.392 10 10 CECE C[C@@H](CC1CN(Cc2ccc(F)cc2O)C1)C(=O)O 2139774829 BEJNSNPRRYIWRU-VIFPVBQESA-N 267.300 2.074 10 10 CECE Oc1cc(Cl)ccc1CN[C@@H]1C[C@H]2OCC[C@@H]12 1946508270 PZPRRSMXGFJIJP-DMDPSCGWSA-N 253.729 2.313 10 10 CECE CC[C@](C)([C@@H](NC)c1ccccc1O)N1CCOCC1 2146239510 FYVZBZHGSRQJGM-JKSUJKDBSA-N 278.396 2.154 10 10 CECE CN1CCc2cc(CNC[C@@H](CO)C(C)(C)C)ccc21 2146396827 MTUBSDVGBLDSIW-HNNXBMFYSA-N 276.424 2.423 10 10 CECE COc1cccc(O)c1[C@](C)(N)CC(=O)OC(C)(C)C 1951863000 ITCRVNOIQVFISU-OAHLLOKOSA-N 281.352 2.307 10 10 CECE 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C[C@H](NCCc1cccnc1)c1cc(O)ccc1O 37717780 WZWNQFDYHXVTTL-NSHDSACASA-N 258.321 2.386 10 10 CECE C[C@]12CC[C@H]1CCN2c1cc2c(cc1F)[C@H](O)C(=O)N2 2157284852 MUFDBFAUIZOQRP-IIRLODAESA-N 276.311 2.190 10 10 CECE Oc1cccc2c1[C@@H](NC[C@@H]1CN3CCC1CC3)CC2 2150797802 NBACGWHNBHNUFT-CABCVRRESA-N 272.392 2.311 10 10 CECE CN[C@H]([C@@H](O)c1ccc2c(c1)CCN2C)[C@@H]1CC1(C)C 2151072284 FESNMFYLFZDOGZ-BPUTZDHNSA-N 274.408 2.346 10 10 CECE CC1(NS(=O)(=O)Cc2ccc(N)cc2)CCCCC1 45040613 DCLKZNTYLULQFD-UHFFFAOYSA-N 282.409 2.411 10 10 CECE C[C@@H]1CN(c2cc3c(cc2N)OCCO3)CC(C)(C)O1 45687151 IXRSRTWPZHQEBQ-SNVBAGLBSA-N 278.352 2.044 10 10 CECE CCc1nccn1CCCC(=O)Nc1ccc(N)cc1 48821497 UCDJANUWHSEITO-UHFFFAOYSA-N 272.352 2.447 10 10 CECE C[C@H]1CCN(C(=O)CCOc2ccc(N)cc2)C[C@H]1F 2152261283 IGXMKWDUOJIHJK-SMDDNHRTSA-N 280.343 2.244 10 10 CECE CCCNCc1ccc(N2CC3(CN(C)C3)C2)cc1C 2152272680 PCILPRJYYVRZSG-UHFFFAOYSA-N 273.424 2.246 10 10 CECE CN(C[C@]1(C)CSCCO1)c1ccc(N)cc1 2023101650 CLKUCAGSZAIKCR-CYBMUJFWSA-N 252.383 2.227 10 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CO[C@H]1CCC[C@H]1N(C)c1ccc(CN)cc1F 687425321 NFTRYOQVVDZYOY-KGLIPLIRSA-N 252.333 2.288 10 10 CECE CCCC1([C@H](NCCCN=[N+]=[N-])C(=O)OC)CC1 687554651 ORHMPSNOTANMRA-SNVBAGLBSA-N 254.334 2.398 10 10 CECE CCc1cccc(CN[C@@H](C)C(=O)N(CC)CC)c1O 709508007 GLYNEDMUORVWOM-LBPRGKRZSA-N 278.396 2.301 10 10 CECE CCCN(CC(C)(C)O)c1ccc([C@@H](C)N)c(O)c1 690081531 HSEIQCPIPXZXIO-LLVKDONJSA-N 266.385 2.399 10 10 CECE COC(C)(C)COC(=O)CCOc1ccc(N)cc1 379281544 DHRJZCJMDKASKR-UHFFFAOYSA-N 267.325 2.006 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1C[C@H](C(=O)O)CC1(C)C 2162154688 LXXONUZTZJZLJP-VHSXEESVSA-N 279.336 2.344 10 10 CECE C[C@H]1CCN(c2ccc(CO)cc2F)C[C@H](C)O1 694896637 DHEMKEXDBRJUET-QWRGUYRKSA-N 253.317 2.322 10 10 CECE CN1CCc2cc([C@@H](O)c3cnc(Cl)n3C)ccc21 696501694 XAPAYAXHEPUWQZ-CYBMUJFWSA-N 277.755 2.148 10 10 CECE CC(C)(O)[C@H]1CCCN(c2c(F)cc(CO)cc2F)C1 719681411 JXFGHKVGKWDBBU-NSHDSACASA-N 285.334 2.444 10 10 CECE C[C@H]1CCN(c2ccc(CO)cc2Cl)CCO1 720405894 KLKYXNSTUJXEPT-JTQLQIEISA-N 255.745 2.448 10 10 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COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1[C@H]2CCC(F)(F)[C@H]21 2176030841 DZPLAWKPRPWVHL-ZYUZMQFOSA-N 288.298 2.109 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3CCCCNC3)ccc21 2179067649 RPUIALODGYZXBU-NVXWUHKLSA-N 274.408 2.492 10 10 CECE C[C@@H](O)c1ccc(N(C[C@@H]2CCOC2)C2CC2)cc1O 2170066048 FDEDFOPGKVQIJU-NEPJUHHUSA-N 277.364 2.451 10 10 CECE CCCN1C[C@H]2C[C@H]1CN2c1ccc(CCN)c(C)c1 2187599141 SZRHWADWSYLUOC-DLBZAZTESA-N 273.424 2.169 10 10 CECE CCC[C@@H](C(=O)O)N1CCOc2cc(N(C)C)ccc21 2195425505 HLZHJABJGRBSBI-ZDUSSCGKSA-N 278.352 2.205 10 10 CECE CO[C@@H]1CCC[C@@H](CNC(=O)c2ccc(O)c(O)c2)C1 2182789845 KJXQAXQOYJHHLN-ZYHUDNBSSA-N 279.336 2.033 10 10 CECE Oc1cc(Br)ccc1CNC[C@@H]1[C@@H]2CCO[C@@H]21 1907558843 YOOHGUBUPMHHRD-LOWVWBTDSA-N 298.180 2.279 10 10 CECE C[C@H]1[C@@H](C)[C@@H](N(C)c2ccc(CN)c(F)c2)CCN1C 2193645933 NACODYLWGFPHQD-WQGACYEGSA-N 279.403 2.449 10 10 CECE C[C@@]1(O)CCC[C@@H](NCc2c(O)cccc2F)C1 2042605996 VVZAERJBFPCDDG-QMTHXVAHSA-N 253.317 2.315 10 10 CECE N[C@H]1CCCc2cc(N3CC(OCC(F)F)C3)ccc21 2184687965 BLHDJQCOTBERKT-AWEZNQCLSA-N 282.334 2.493 10 10 CECE CN(C)c1ccc([C@@H](NN)[C@H]2CSCCS2)cc1 2044755481 YPWDYJFBKNEVKX-CHWSQXEVSA-N 283.466 2.106 10 10 CECE CN(C)C[C@@H]1CCCN(c2ccc3c(c2)CC[C@H]3O)C1 2184734473 TXQCLMCEHBXHAR-SUMWQHHRSA-N 274.408 2.444 10 10 CECE Cc1nn(C)cc1CN(C)c1ccc2c(c1)CC[C@H]2O 2184733510 IMIUXCYPLXPPFH-MRXNPFEDSA-N 271.364 2.345 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1C[C@@H](n2ccnc2)C1 2184864965 ICWBWRQRRDEIKO-VDISTLRHSA-N 275.327 2.469 10 10 CECE C[C@H](NC[C@]1(O)C[C@H]2CCC[C@@H]21)c1cc(O)ccc1O 2197550536 VJCVWXFFZWFFBM-FJXFWJLJSA-N 277.364 2.300 10 10 CECE C[C@@H]1CN(c2ccc([C@@H](C)N)cc2Cl)C(C)(C)C(=O)N1 2186205531 FBEWREILHDCOPJ-NXEZZACHSA-N 295.814 2.463 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H](O)CC3(CC3)C2)c(F)c1 2194521082 WNQAQXNNSLWTIL-GXSJLCMTSA-N 283.318 2.369 10 10 CECE Cc1cc(N(C)[C@@H]2CCOC[C@H]2F)ccc1C[C@H](C)N 2186750676 RLEGBSFPJWQRDF-APHBMKBZSA-N 280.387 2.448 10 10 CECE CN(C[C@@H]1OCCOC1(C)C)c1ccc(CO)c(Cl)c1 2186855811 UZRFVRXVPZGGOI-AWEZNQCLSA-N 299.798 2.463 10 10 CECE CCCOc1cc(N2C[C@@H](N)C3(CCC3)C2)ccc1N 2191600630 JONQGPTXSUKGEN-OAHLLOKOSA-N 275.396 2.375 10 10 CECE Nc1ccc(OCCN2CCCC[C@H]2C2(O)CC2)cc1 2187042727 RHWMMLPRAMAGSH-HNNXBMFYSA-N 276.380 2.027 10 10 CECE COc1ccc(CC(=O)Nc2ccc(N)cc2)cc1N 2191753790 JZHKDGOQDNLBIN-UHFFFAOYSA-N 271.320 2.041 10 10 CECE O=C(O)C12CC(CN1Cc1c(O)cccc1Cl)C2 2072395063 ZBXOZSNNBLAXPK-UHFFFAOYSA-N 267.712 2.095 10 10 CECE CN1CCCc2cc(N3C[C@H]4CCC[C@@]4(N)C3)ccc21 2198077347 CRFBFSPRTDDUHB-RHSMWYFYSA-N 271.408 2.387 10 10 CECE C[C@H](CO)CN(C)c1c(F)cc([C@@H](C)N)cc1F 2074214294 MJZCBFSRXKTJSL-DTWKUNHWSA-N 258.312 2.049 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)C1(CCF)CC1 2074484543 QAAZACLQWJFESE-UHFFFAOYSA-N 250.317 2.367 10 10 CECE CN(CC[C@H]1CC1(F)F)Cc1cc(N)ccc1O 2075414820 BFXPBGXBWFXQHT-JTQLQIEISA-N 256.296 2.452 10 10 CECE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H]2CC[C@@H]3O2)cc1O 2198715991 FXRWGAGXMDCLMT-BHLUBLJJSA-N 274.364 2.311 10 10 CECE C[C@@H](NCc1ccc(F)c(F)c1O)c1nncs1 2077146066 GOOIVRBAFHXGMJ-ZCFIWIBFSA-N 271.292 2.373 10 10 CECE CCN[C@@H](c1ccccc1O)[C@](C)(COC)OC 2077493686 CFIRHTABYTZVRI-KBPBESRZSA-N 253.342 2.094 10 10 CECE CCC[C@@H]1C[C@@H]1[C@@H](NCCN=[N+]=[N-])C(=O)OCC 2079778111 CETLLHFJZOTSOD-OUAUKWLOSA-N 254.334 2.254 10 10 CECE CN1CCCC[C@@H](N[C@H]2CCc3cccc(O)c32)C1 2102361154 FLYJQSUEQIZMRT-KGLIPLIRSA-N 260.381 2.453 10 10 CECE CN(c1ccc(CN)c(F)c1F)[C@H]1CC[C@H](O)CC1 2103883723 VKDQKHBFADPHCL-XYPYZODXSA-N 270.323 2.163 10 10 CECE COC1CC(CCC(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2104644601 DTAKJXOCCHVALP-MOENNCHZSA-N 266.345 2.493 10 10 CECE CCN[C@@](CSc1nccs1)(CC(C)C)C(N)=O 2086598108 AVHGFPDJTGAPST-GFCCVEGCSA-N 287.454 2.115 10 10 CECE CC[C@@H](C)NC[C@H](O)c1ccc2c(c1)CCN2CC 2106790443 IIRVOAUFMOBYQI-WBMJQRKESA-N 262.397 2.491 10 10 CECE CCN1CCc2cc([C@]3(N)COC(C)(C)C3)ccc21 2106791101 OXHJHHOGKKSQPX-MRXNPFEDSA-N 260.381 2.422 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)[C@H](COC)OC 2106793775 QIIJDOBSPWVUHT-GJZGRUSLSA-N 266.385 2.065 10 10 CECE CN1CCc2cc([C@H](N)[C@](C)(O)C3CCC3)ccc21 2106849476 WPTKDDGSASHXTO-JKSUJKDBSA-N 260.381 2.230 10 10 CECE CN(C)c1ccc([C@H](O)[C@]2(C)CC(F)(F)CN2)cc1 2106802936 XVDDRKKKGQVRJN-STQMWFEESA-N 270.323 2.173 10 10 CECE C[C@H]1NCCC[C@]1(O)c1ccc(N2CCCC2)cc1 2106825459 JUJPVOROSGIBKR-CZUORRHYSA-N 260.381 2.246 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@H](O)CCSC 2106848988 PIJKHJOMXBRCLP-CABCVRRESA-N 280.437 2.053 10 10 CECE CO[C@H](C1CCC1)[C@@H](NN)c1ccc(N(C)C)cc1 2106823557 QBPULOMCARRLDW-LSDHHAIUSA-N 263.385 2.072 10 10 CECE C[C@H](c1ccccc1O)N(C)CCN1CCCC1=O 2087053212 KSEPRUQQJXAOCH-GFCCVEGCSA-N 262.353 2.007 10 10 CECE COc1cc2c(cc1OC)N(CC(C)(C)OC)CC2 2087096133 JELIJPCMHPRDGD-UHFFFAOYSA-N 265.353 2.491 10 10 CECE c1cc(N2CCNCC2)ccc1O[C@H]1C[C@@H]2C[C@@H]2C1 2107709287 SWNSYDDBOFVOQE-YWVIFJGQSA-N 258.365 2.274 10 10 CECE CCNCc1ccc(N2CC[C@H](O)[C@H](F)C2)cc1C 2088305963 JSVOIIBFEJCKNS-CABCVRRESA-N 266.360 2.014 10 10 CECE CN1CCC[C@@H](NCc2ccc(F)c(F)c2O)CC1 2088300417 XAYKFWOSUNAVIJ-LLVKDONJSA-N 270.323 2.244 10 10 CECE Cc1cc(CN)ccc1N1[C@H](CO)C[C@H]2CCC[C@@H]21 2108589791 DFYHPHVJNYEGDB-YCPHGPKFSA-N 260.381 2.193 10 10 CECE COc1ccc(N(C)CC2=CSC3=NCCN23)cc1 2108891890 NHBMURRWNVDPPI-UHFFFAOYSA-N 275.377 2.391 10 10 CECE COC[C@]12CN(c3ccc(CN)c(C)c3)C[C@@]1(C)C2 2109169492 LYICDMPKGJIICO-CVEARBPZSA-N 260.381 2.317 10 10 CECE Cn1nnc(COCc2ccc(N)cc2)c1C(F)F 2089424285 AINVAIINIZIBDB-UHFFFAOYSA-N 268.267 2.052 10 10 CECE CC(C)(c1ccncc1)[C@@H](NN)c1ccccc1O 2090036558 DHNJHBAWISWRIP-AWEZNQCLSA-N 257.337 2.269 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@H]2CN1Cc1ccc(Cl)cc1O 2090125261 SPIHVMMGGBKIES-IACUBPJLSA-N 280.799 2.475 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@@H](N)CC(C)(C)C1 2090168558 JRPPLWGHIMARSZ-QWRGUYRKSA-N 264.369 2.218 10 10 CECE Nc1ccc(CCC(=O)NCCc2cncs2)cc1 2090436500 IBJFKHBDFOSVRZ-UHFFFAOYSA-N 275.377 2.017 10 10 CECE COCC[C@H](C)C(=O)[C@H](O)c1ccc(N(C)C)cc1 2090854455 LQPYVMWBVSFIJW-XHDPSFHLSA-N 265.353 2.028 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@H]1[C@H]2CCC[C@H]21 2111124904 BNMZLFUWAZOQBV-WRWGMCAJSA-N 266.345 2.254 10 10 CECE Cc1cc(CN)ccc1N(C)Cc1c(Cl)cnn1C 2111845622 IPHYKVNFVLRCOY-UHFFFAOYSA-N 278.787 2.477 10 10 CECE CCN(C)[C@@H]1CCN(c2ccc([C@@H](C)O)cc2F)C1 2097754508 WKRHQKQFSXKQTK-DGCLKSJQSA-N 266.360 2.409 10 10 CECE CCC[C@H]1C[C@H]1CN(C)C(=O)c1cc(O)c(O)c(O)c1 2200102702 SHYWTBLAQAVEJQ-ONGXEEELSA-N 279.336 2.312 10 10 CECE NCc1ccc(N2CCOC[C@@H]2c2ccco2)cc1 2115078162 RYYDETWUJSNAGU-CQSZACIVSA-N 258.321 2.316 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3[C@@H](CO)C[C@H]3C2)c(Cl)c1 2117691080 VDPUKYJIPGFVOH-MGAJPHDKSA-N 281.783 2.458 10 10 CECE COc1cc(CN(C)c2ccc(CN)c(OC)c2)sn1 2204557191 NAEHESYVLAIRAU-UHFFFAOYSA-N 293.392 2.255 10 10 CECE CCNCc1ccc(N2CC[C@@H]3COC[C@H]32)cc1OC 2204537800 GQQOEVUURHDBPG-UKRRQHHQSA-N 276.380 2.030 10 10 CECE CCNCc1ccc(N(C)C[C@H]2C[C@@H](O)C2)cc1OC 2204558531 DRTGQEDAYBRHLJ-JNSHFYNHSA-N 278.396 2.012 10 10 CECE COc1cc(N2CC[C@H]3OCCC[C@H]3C2)ccc1CO 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10 10 CECE COc1ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)c2c1CCC2 2269170199 CUSRCPCQYZBXGU-CFVMTHIKSA-N 259.349 2.143 10 10 CECE Cc1cccc(CN2C[C@@H](S(C)(=O)=O)CC[C@H]2C)c1O 2279354514 PVAQNSHNYUNZNE-OCCSQVGLSA-N 297.420 2.098 10 10 CECE CN[C@@H](C)c1ccc(N2CC3(CC[C@H]3O)C2)cc1C 2269662985 UWLWPIWDSAZCMQ-SWLSCSKDSA-N 260.381 2.237 10 10 CECE CO[C@H](CS(=O)(=O)CCCc1ccc(N)cc1)C(C)C 2283825726 IBBFSSDFDMOCOD-OAHLLOKOSA-N 299.436 2.287 10 10 CECE Cc1cc(N2C[C@H]3CCN(C)C[C@H]3C2)ccc1[C@H](C)O 2285160204 IVNNGPSCDRTYEM-ZNMIVQPWSA-N 274.408 2.436 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@@H](O)[C@H]3C2)c(OC)c1C 2295357367 LPAMJDAGOLQLCW-SGMGOOAPSA-N 277.364 2.219 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)NCCc1cccc(O)c1 2308002002 MCQSNWBKEKWHSK-UHFFFAOYSA-N 299.326 2.176 10 10 CECE C[C@@H]1CNCC[C@@](Sc2nccs2)(C(=O)O)C1 2306963362 YOTQUPNKUUBUBM-KWQFWETISA-N 272.395 2.078 10 10 CECE Cc1ccc(CN(C)C2CN(C)C2)c(O)c1Br 2307473209 QWYJFZZOWRBVLI-UHFFFAOYSA-N 299.212 2.209 10 10 CECE COc1cc(Cl)c(N2CCC(O)CC2)c(OC)c1 2319559139 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10 10 CECE Fc1cc(OC[C@@H]2CCCO2)ccc1N1CCCNCC1 87439355 NJRVRMXPUQXTOJ-AWEZNQCLSA-N 294.370 2.183 10 10 CECE Nc1ccc(CC(=O)NCc2cc(F)ccc2F)cc1 82284218 ZJLDNZBSIGWMGX-UHFFFAOYSA-N 276.286 2.406 10 10 CECE Fc1cc(OCCC2CC2)ccc1N1CCNCC1 88493433 FAVGCUGRAOEXJL-UHFFFAOYSA-N 264.344 2.414 10 10 CECE CCCc1nc(NN)cc(Sc2nccs2)n1 87908309 RIPRGOYJGUUPEH-UHFFFAOYSA-N 267.383 2.322 10 10 CECE C[C@@H](NCc1c(O)cccc1Cl)c1nnc[nH]1 226746139 XYCVWBBCKSLLLC-SSDOTTSWSA-N 252.705 2.015 10 10 CECE CNC[C@@H](C)[C@H](C)N1CCN(c2ccc(OC)cc2)CC1 93068382 XYOBKTCWDVILEL-CABCVRRESA-N 291.439 2.061 10 10 CECE CC[C@H]1CCN(c2ccc(OC)cc2OC)CCN1 49661194 IXGPOSKONFATIW-LBPRGKRZSA-N 264.369 2.282 10 10 CECE Cc1cc(N2CCN3CCC[C@@H]3C2)ccc1/C=C/C(=O)O 94462846 BIHRNYSLLUUVMU-BIENSFFJSA-N 286.375 2.377 10 10 CECE Cc1nc(-c2ccc(O)c(O)c2)[nH]c(=O)c1C(C)C 232792283 NUXIQJKNZPUNJN-UHFFFAOYSA-N 260.293 2.280 10 10 CECE CCCO[C@H]1CCCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 249797868 QMFHACSEAKFCDY-WFASDCNBSA-N 289.379 2.034 10 10 CECE 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CC[C@@H](c1ccccc1O)N(C)[C@H]1CC(=O)N(C)C1 2131936032 QQCDQGHURMTWIB-AAEUAGOBSA-N 262.353 2.006 10 10 CECE COC(=O)/C=C/c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1 828443150 QXMQHACOVSZXSF-JOAKQRRISA-N 294.282 2.329 10 10 CECE CC[C@H](O)CC(=O)NCc1c(O)ccc2c1CCCC2 827317271 QXGIWHYTULAEPE-LBPRGKRZSA-N 277.364 2.048 10 10 CECE CN1C[C@@H]2CCN(C/C=C/c3ccc(N(C)C)cc3)[C@H]2C1 835057053 XTSHHAKRGKWEFO-NCWIEVAOSA-N 285.435 2.402 10 10 CECE O=C(N[C@@H](C1CC1)[C@H]1CCCCO1)c1cccc(O)c1O 848268066 YPNHWDBSOOVLMY-KGLIPLIRSA-N 291.347 2.175 10 10 CECE CCN(CC)c1ccc(CN2CN(C)C(=O)[C@H]2C)cc1 843434570 AZDHOWOEYYJQLG-CYBMUJFWSA-N 275.396 2.153 10 10 CECE COc1ccc(N(C)CCN(C)C(=O)C2=CCC2)cc1 844853954 HOZXMTFPBGJFRO-UHFFFAOYSA-N 274.364 2.310 10 10 CECE CCc1cccc(CNCC(C)(C)[C@]2(O)CCOC2)c1O 848918973 CQKIJYVZLOKILL-KRWDZBQOSA-N 293.407 2.222 10 10 CECE COC1(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 843766959 UWHYLVXHCUECCW-UHFFFAOYSA-N 274.364 2.082 10 10 CECE C[C@@H]1COC[C@H]1NC/C=C/c1ccc(N(C)C)cc1 922642294 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C[C@@H](c1ccccc1O)n1cncc1C(C)(C)CN 1877585556 GJQMINZHSGBGPF-NSHDSACASA-N 259.353 2.434 10 10 CECE O=C(O)c1cnc(S[C@H]2CCC[C@@H](O)C2)s1 1896478242 VAOUECKIMSEZKF-RQJHMYQMSA-N 259.352 2.237 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](CCO)C2)c(F)c1 1880930989 GTQASPNDXKUVCE-UWVGGRQHSA-N 270.323 2.193 10 10 CECE O=C(NCc1ccc(O)c(Cl)c1)c1cccc(O)c1O 1303299558 XWRDVDJIVKHNLH-UHFFFAOYSA-N 293.706 2.387 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccoc1Cl 1304053471 LQDQLBTVBQHFJA-UHFFFAOYSA-N 267.668 2.274 10 10 CECE CCN(CC)Cc1ccc(N2CCNCC2)cc1F 84857623 QZYQLDIWTCJQFY-UHFFFAOYSA-N 265.376 2.077 10 10 CECE CNCCc1nc2ccccc2n1-c1ccc(N)cc1 76040697 GQMWMRUYBMLLTK-UHFFFAOYSA-N 266.348 2.370 10 10 CECE CCCN1C[C@@H](C)Oc2ccc(N3CCNCC3)cc21 77017103 WBEKPILJDNPXDC-CYBMUJFWSA-N 275.396 2.094 10 10 CECE COc1ccc(O)c([C@@H](N)c2nc3c(s2)CCC3)c1 83548283 MIDMMNITCOFTHA-CYBMUJFWSA-N 276.361 2.394 10 10 CECE Cc1ccc([C@@H]2NCCc3c(O)ccc(O)c32)c(O)c1 83657902 KAQDELRATYTSHA-INIZCTEOSA-N 271.316 2.347 10 10 CECE COc1cccc([C@@H]2NCCc3c(O)ccc(O)c32)c1 83657694 QANRJRSAEMHGGY-INIZCTEOSA-N 271.316 2.342 10 10 CECE N#Cc1cccc([C@H]2NCCc3c2ccc(O)c3O)c1 83656104 NSZKROVRLXAPDD-OAHLLOKOSA-N 266.300 2.205 10 10 CECE COc1cccc(CNCC(F)(F)Br)c1O 390520931 FGVOMPSTJBCPOK-UHFFFAOYSA-N 296.111 2.478 10 10 CECE CC(=O)Nc1nc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)cs1 701297634 WASCTOAKGAQYBT-QMMMGPOBSA-N 294.340 2.016 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccnc(F)c1F 701318803 IHRXLRIYAWEMDF-UHFFFAOYSA-N 255.228 2.180 10 10 CECE COc1ccc(N2CC[C@@H](OC(C)C)C2)c(N)c1 701799394 LUUGPZVYZWUGLX-GFCCVEGCSA-N 250.342 2.281 10 10 CECE Oc1ccc(Cl)cc1CNCc1csnn1 398236835 MJSNIGURNHVSJN-UHFFFAOYSA-N 255.730 2.187 10 10 CECE CC(C)(C)OC(=O)N1C[C@@H](NCc2ccccc2O)CO1 703372787 KYGZQVSYEVTOMB-GFCCVEGCSA-N 294.351 2.033 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2cn(C)nn2)c(Cl)c1 689203046 AUIIEQODGAQMBJ-VIFPVBQESA-N 280.759 2.158 10 10 CECE C[C@H]1C[C@]1(C)CN(C)CC(=O)Nc1ccc(N)cc1 704079868 WTXZJFQSCSPKGB-XHDPSFHLSA-N 261.369 2.185 10 10 CECE Cc1cocc1C(=O)Nc1ccc(O)cc1C(=O)O 704762500 ZLNULYVLGKFBOY-UHFFFAOYSA-N 261.233 2.244 10 10 CECE CCO[C@@H]1CCN(c2ccc(CNC)cc2F)C1 706397376 NSZVGHMTIKOSDI-GFCCVEGCSA-N 252.333 2.160 10 10 CECE CCCCN(c1ccc([C@@H](C)N)c(O)c1)C1COC1 1889954730 HNRLCAJHBCURAY-LLVKDONJSA-N 264.369 2.417 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1CCC[C@@H](O)C1 708549326 PSINQOJHPKLTQS-GHMZBOCLSA-N 257.280 2.064 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1CN 708888915 IUUWGGFTWLGVHU-NXEZZACHSA-N 254.761 2.072 10 10 CECE CCN(CC)[C@@H]1CCN(c2ccc(CN)cc2F)C1 62967198 WRNLHCNHQGUETA-CYBMUJFWSA-N 265.376 2.205 10 10 CECE CN(CCN1CCCC1)c1ccc(CNC2CC2)cc1 63052531 XRVLVLJSJVQXJJ-UHFFFAOYSA-N 273.424 2.471 10 10 CECE Oc1ccc(Br)cc1CNCCc1cc[nH]n1 714521109 JZPXFIGIRZGFFL-UHFFFAOYSA-N 296.168 2.210 10 10 CECE C[C@@H](N[C@@H]1CCCC12OCCO2)c1cc(F)ccc1O 715604201 UGAXMLGSHOTOSK-QMTHXVAHSA-N 281.327 2.478 10 10 CECE C[C@H](NC(=O)CCOc1ccc(N)cc1)c1ccns1 715928291 TWWYGIQKNFNOAG-JTQLQIEISA-N 291.376 2.372 10 10 CECE 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264.325 2.194 10 10 CECE COc1ccc(N(C)CCC[C@@H](C)O)c(OC)c1 789350727 HEJFGWBDQNXTEY-LLVKDONJSA-N 253.342 2.301 10 10 CECE Nc1ccc(CCNC(=O)C2CC(=C3CC3)C2)cc1 1969320820 PICCSISYPSURAC-UHFFFAOYSA-N 256.349 2.428 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCO[C@H]2C[C@@H]21 2115228869 JTEIPYKMEUAXMS-KBPBESRZSA-N 259.305 2.070 10 10 CECE COc1cccc(CNC(=O)[C@@H]2CCC(=O)C[C@H]2C)c1O 1445964219 CGDLUSSWPYUZBU-ZWNOBZJWSA-N 291.347 2.022 10 10 CECE CN1CCCc2cc3c(cc21)[C@](C)(N(C)O)CCO3 211977448 MZLTZAPQRVXBQH-OAHLLOKOSA-N 262.353 2.388 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N1C[C@@H]2C[C@H](C1)N2 2117057561 BIRYGAZQBFLWIB-NDBYEHHHSA-N 258.365 2.295 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1c(N)cccc1Cl 2249934778 KDYWKSFGBBKULJ-UHFFFAOYSA-N 253.693 2.352 10 10 CECE F[C@@H]1CCC[C@@H]1Oc1ccc(N2CCNCC2)cc1 2118871004 RQULBWBCLLZCSK-CABCVRRESA-N 264.344 2.366 10 10 CECE C[C@H]1CN(c2cc(Cl)c(CN)cc2F)C[C@@]1(C)CO 2120885894 TUAIGAYLPHEBGE-XPTSAGLGSA-N 286.778 2.393 10 10 CECE C[C@H](N[C@H](CCF)C(=O)O)c1ccc(N(C)C)cc1 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CECE C[C@H](O)c1ccc(N(C)C[C@H]2[C@@H]3CCCO[C@@H]32)cc1O 2355544794 RRXGZDBKMCKOOV-CFMVVWHZSA-N 277.364 2.307 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCc1nncn1C 109421367 BCAGGJHTGXECJG-NWDGAFQWSA-N 286.379 2.210 10 10 CECE COc1ccccc1N/C=C1/SC(=S)NC1=O 100987975 PRAKRLHILNUUJS-RMKNXTFCSA-N 266.347 2.096 10 10 CECE NCc1ccc(N2[C@@H]3CC[C@@H]2CC(O)C3)c(Cl)c1 113507927 HGVVSSASHXACFO-GHMZBOCLSA-N 266.772 2.291 10 10 CECE CCCOc1ccc(CNC[C@H]2CC[C@@H](O)C2)c(O)c1 188828586 PZAGKKBGRXAIPG-GXTWGEPZSA-N 279.380 2.432 10 10 CECE C[C@H]1[C@@H](C)SCCN1Cc1cc(N)ccc1O 132239921 ZHWOKKNCYAALLD-VHSXEESVSA-N 252.383 2.300 10 10 CECE COc1ccc(CN[C@H](CCO)c2ccco2)c(O)c1 184506631 HDMBXLRJOPLKPM-CYBMUJFWSA-N 277.320 2.207 10 10 CECE CCCN(CCn1ccccc1=O)Cc1ccc(N)cc1 214605254 GTAQYZRNUZZEJD-UHFFFAOYSA-N 285.391 2.343 10 10 CECE COC[C@H](Nc1c(N)cccc1C(=O)O)C(C)C 130438401 TYJAQAMAFOSEIO-NSHDSACASA-N 252.314 2.050 10 10 CECE CCC1(NS(=O)(=O)Cc2ccc(N)cc2)CCC1 229467236 FWYOFXIUVYNQHK-UHFFFAOYSA-N 268.382 2.021 10 10 CECE CCn1ncc(CN[C@@H](C)c2cc(C)ccc2O)n1 527923039 IGRRWGVKQLBFPV-NSHDSACASA-N 260.341 2.163 10 10 CECE CCN(CC)c1ccc(CN[C@H](C(N)=O)C(C)C)cc1 223958739 VZCDDEWCQTWRMA-HNNXBMFYSA-N 277.412 2.132 10 10 CECE C[C@@H]1COCCN1c1ccc(CN)c(Br)c1 228147904 WKBFHWPDNCCGAL-SECBINFHSA-N 285.185 2.133 10 10 CECE CN1CCC[C@@H](N(C)c2ccc(/C=C\C(=O)O)cc2F)C1 226947947 ZUTLNBWOUHZMLE-FWPCIQOSSA-N 292.354 2.454 10 10 CECE CO[C@@H]1C[C@H](NCc2ccc(O)c(O)c2)C1(C)C 227541316 CNFDLIVKUNZJQT-QWHCGFSZSA-N 251.326 2.001 10 10 CECE CC(=O)NC1CCN(c2ccc(CNC3CC3)cc2)CC1 228303301 ZZDQTSUDWTXFAK-UHFFFAOYSA-N 287.407 2.044 10 10 CECE CNC[C@@H]1CCCN(Cc2ccc3c(c2)CCN3C)C1 50287739 PQOTULFABXYXDN-HNNXBMFYSA-N 273.424 2.110 10 10 CECE CC[C@H](NC[C@H](O)[C@@H]1CCCO1)c1ccc(C)cc1O 527959923 ZUBKGTSUPATPFG-BPUTZDHNSA-N 279.380 2.281 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H]2[C@@H]2CCCN2)cc1 51357245 OGBXGASEFHTAMF-DLBZAZTESA-N 273.424 2.469 10 10 CECE COC(=O)/C=C(\C)N=Nc1ncccc1[N+](=O)[O-] 255978864 IKGCTJPSPMIZIZ-MVEAHZITSA-N 250.214 2.150 10 10 CECE CCCN(Cc1ccccc1O)C(=O)c1cnn(CC)n1 293404982 OKHSDEYEIPWVEF-UHFFFAOYSA-N 288.351 2.056 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)c1ccc(C(=O)O)o1 2164152068 RFQINHJQCWZVGG-AWEZNQCLSA-N 274.320 2.353 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@H](C(=O)O)CC1(C)C 2162155026 NJQHEJIJHBCYAB-ZJUUUORDSA-N 279.336 2.344 10 10 CECE COC(=O)[C@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 295254705 GIDNVBRWNXMEHP-QMMMGPOBSA-N 287.718 2.180 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)[C@@H]3[C@H]4CCC[C@H]43)ccc21 2167419741 LRKHQPBSEKUERC-YRVYGCIDSA-N 272.392 2.086 10 10 CECE NCc1ccc(N2CC[C@H]3CC[C@H](O)[C@H]2C3)cc1F 722205236 QRUFEVLXNAMMMC-KMUNFCNLSA-N 264.344 2.024 10 10 CECE Nc1ccc(CCCN2[C@H](CO)C[C@H]3CCC[C@@H]32)cc1 2164831737 IJVPJMWWHRFJFN-PVAVHDDUSA-N 274.408 2.437 10 10 CECE CC[C@H](CC(=O)O)CC(=O)N1CCC[C@H]1CN=[N+]=[N-] 2225794907 JLWXUPMWVVBWCW-UWVGGRQHSA-N 268.317 2.179 10 10 CECE CN1CCc2cc([C@H](O)[C@@H](N)C3=CCC=CC3)ccc21 2163073312 HXCNQYHXQLETGO-IRXDYDNUSA-N 270.376 2.316 10 10 CECE CN1CCc2cc([C@@]3(O)CCN4CCCC[C@@H]43)ccc21 2163076652 PPGUUZQJLVJPGZ-SJORKVTESA-N 272.392 2.125 10 10 CECE CN1CCCc2cc(N3C[C@@H](CN)C(C)(C)C3)ccc21 2163093153 ZGYQIXNDVMTCPJ-CQSZACIVSA-N 273.424 2.490 10 10 CECE C[C@@H]1CC[C@@H](C[C@H](NN)c2ccc3c(c2)CCN3C)O1 2163149179 GOABFJSNEMPXHI-UGFHNGPFSA-N 275.396 2.141 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CCO[C@@H]2C[C@H]21 814172348 JGCFYHGVTWCOPS-GHMZBOCLSA-N 257.692 2.158 10 10 CECE CN1CC[C@@H]2CC[C@H](C1)N2c1c(F)cc(CO)cc1F 717501497 SVCPRNJABGQOAR-NWDGAFQWSA-N 282.334 2.130 10 10 CECE CC[C@@H]1CN(c2ccc(CNC3CC3)cc2C)C[C@H]1O 399854482 MBJAIBCSDSSJIF-RHSMWYFYSA-N 274.408 2.454 10 10 CECE Cc1cc(Cl)cc(CN2CC[C@H]3CN(C)C[C@H]32)c1O 814173407 LDDRBYFARIUUOT-SMDDNHRTSA-N 280.799 2.490 10 10 CECE CCCN(Cc1ccccc1O)C(=O)CN1CC[C@H](C)C1 816914103 DMXXPPBDBHFXJB-AWEZNQCLSA-N 290.407 2.473 10 10 CECE C/C(=C\C(=O)N(C)c1cccnc1N(C)C)c1cnccn1 826929475 OEUPKMLRIMQVMS-ZRDIBKRKSA-N 297.362 2.004 10 10 CECE COc1ccc2c(c1)CCN2Cc1cnc(C)n1C 824477450 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COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CC3(F)F)C2)cc1 855227701 YEQWGKNMEFYPEV-GWCFXTLKSA-N 296.317 2.045 10 10 CECE C[C@H](NC[C@H]1CCN1C1CCOCC1)c1ccccc1O 927105289 DOKBLDWIHZIMJS-DZGCQCFKSA-N 290.407 2.296 10 10 CECE CCOc1ccc(CNCC[C@@H](N)C(C)C)c(O)c1 853247324 LVKQMYPCEOHDFN-CQSZACIVSA-N 266.385 2.254 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@H]1OC 930905771 PKAALYPJMIIFIY-HUUCEWRRSA-N 276.380 2.136 10 10 CECE C[C@](O)(Cc1ccccc1)C(=O)N1Cc2cccc(O)c2C1 871203132 UMWUOQKCEQBUOR-SFHVURJKSA-N 297.354 2.228 10 10 CECE CC(C)Oc1ccc(N2C[C@H](C)O[C@@H](CN)C2)cc1 71597037 PTZVYMRVPDHJTM-WFASDCNBSA-N 264.369 2.026 10 10 CECE CCN(c1ccc(OC)cc1N)[C@H]1CCC[C@@H]1CN 1876294265 PFAWUOSYQPSCBQ-RISCZKNCSA-N 263.385 2.231 10 10 CECE COC(=O)[C@H]1CC[C@H](N[C@@H](C)c2ccccc2O)C1 895459733 HNBOMDFUJUJMDN-SRVKXCTJSA-N 263.337 2.385 10 10 CECE COc1cccc(CNC(=O)c2nc(Cl)cs2)c1O 789995774 MCOXMUXTOYKZHA-UHFFFAOYSA-N 298.751 2.441 10 10 CECE Cc1ncc(/C=C\C(=O)N2C[C@@H](C)Cn3nccc32)s1 893879839 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Nc1ccc(CCc2nnc3ccccc3n2)cc1 82555113 RJLQYZAMCMASGO-UHFFFAOYSA-N 250.305 2.392 10 10 CECE CC[C@@H]1CN[C@H](C)CN1c1ccc2c(c1)OCCO2 83456580 AZOSFJUHRRLEAB-VXGBXAGGSA-N 262.353 2.035 10 10 CECE COc1ccc([C@H]2NCCc3c(O)cccc32)c(O)c1 83619679 YCAKWYTVTTXXIW-INIZCTEOSA-N 271.316 2.342 10 10 CECE N#Cc1ccc([C@H]2NCCc3ccc(O)c(O)c32)cc1 83621004 AZUVRKONDSGISW-OAHLLOKOSA-N 266.300 2.205 10 10 CECE Oc1ccc(O)c([C@H]2NCCc3c(O)cccc32)c1 83619862 RMMFQKXICAQKED-HNNXBMFYSA-N 257.289 2.039 10 10 CECE Oc1cc2c(cc1O)[C@@H](/C=C/c1ccncc1)NCC2 83724161 ZLFUVPKXYNHQGB-VSZDKKFSSA-N 268.316 2.393 10 10 CECE COc1cncc(CNCc2ccc(F)c(F)c2O)c1 703258093 SQLAEKMEYFZWSH-UHFFFAOYSA-N 280.274 2.364 10 10 CECE C[C@@H]1OCCN(Cc2ccc(F)c(F)c2O)[C@H]1C 703441070 ZWYFWIVQMZXLOR-IUCAKERBSA-N 257.280 2.280 10 10 CECE CN(C[C@@]1(C)CC1(F)F)C(=O)Cc1ccc(N)cc1 689223874 IKLRZVGXCRUGGL-CYBMUJFWSA-N 268.307 2.315 10 10 CECE O=C1Nc2cc(N3CCC[C@H]3C3CC3)ccc2[C@@H]1O 706446188 XBLGZZYNGRWYQT-KBPBESRZSA-N 258.321 2.051 10 10 CECE COc1cccc(CNC[C@@H]2CCN2C(C)(C)C)c1O 690389841 GLHWCYORRYLBFJ-ZDUSSCGKSA-N 278.396 2.363 10 10 CECE C[C@H](NCCOCCCO)c1ccc(Cl)cc1O 1327469860 FMQTXOXZUAYRAF-JTQLQIEISA-N 273.760 2.095 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1CO[C@@H](C2CC2)C1 708516738 KXDXYFNGQSPQJT-WCQYABFASA-N 269.291 2.328 10 10 CECE CN(c1ccc(CN)cc1Br)[C@H]1CCC[C@H]1O 709398775 IORRREHRCYVWDI-QWHCGFSZSA-N 299.212 2.257 10 10 CECE CNCc1cc(F)c(N(C)[C@@H]2CCCN(C)C2)c(F)c1 62719089 FOBZSNZMKDOMDB-GFCCVEGCSA-N 283.366 2.215 10 10 CECE CNCc1ccc(N2CCC[C@H](C)[C@H]2CO)c(C)c1 688779598 SAQIXAPJBVTWLY-BLLLJJGKSA-N 262.397 2.312 10 10 CECE C[C@H](CNCc1ccc(O)c(O)c1O)C1CCC1 692901812 ZONTXBHYIZLZDO-SECBINFHSA-N 251.326 2.329 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])c1ccc(Cl)cn1 695214589 VUVLSHNLTIYIKA-GFCCVEGCSA-N 297.746 2.413 10 10 CECE Nc1cccc(Br)c1N[C@@H]1CCCCNC1=O 697500240 JVKITDLUACMJPD-SNVBAGLBSA-N 298.184 2.112 10 10 CECE Cc1nc2c([nH]1)CCN[C@H]2c1ccc(N(C)C)cc1 215543180 XZBWOCYWVDNAFU-AWEZNQCLSA-N 256.353 2.019 10 10 CECE C[C@H]1Oc2ccccc2[C@@H]1NC(=O)Cc1ccc(O)c(O)c1 1468658784 DNXHFUDXOHMXJK-BMLIUANNSA-N 299.326 2.279 10 10 CECE COc1ccc(CNC(=O)c2cc(O)ccc2C)c(O)c1 1467472134 ZHNPGTPQCYEPJX-UHFFFAOYSA-N 287.315 2.345 10 10 CECE CO[C@@H]1C=C[C@H](NCc2ccc3c(c2)CCCO3)C1 2119393373 JKHPLLZOPRMQRW-LSDHHAIUSA-N 259.349 2.445 10 10 CECE Cc1ccc2oc(C(=O)NCc3cccc(O)c3O)cc2n1 1558159578 IBERRNZCXQJNSJ-UHFFFAOYSA-N 298.298 2.477 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC(=O)NCc1cccs1 2123016578 YZIWPJRSVJVBKT-SNVBAGLBSA-N 279.369 2.139 10 10 CECE COc1ccc(/C=C2\SC(=S)N(C(C)=O)C2=O)cc1 3157391 AZVNNJWMSREBKF-XFFZJAGNSA-N 293.369 2.443 10 10 CECE C[C@@H](NC(=O)c1ccc(CO)nc1)c1ccc(N(C)C)cc1 1634448127 JMNFJHVNUSZUAY-GFCCVEGCSA-N 299.374 2.131 10 10 CECE Cc1ccc(O)c(CNC(=O)c2ccc(Cl)nc2N)c1 1641733251 NPYMZFSMTOEBQD-UHFFFAOYSA-N 291.738 2.261 10 10 CECE CC[C@@H](C)N(C)CCNCc1c(O)cccc1F 1964032243 HXSRMJRVLVGQAS-LLVKDONJSA-N 254.349 2.351 10 10 CECE O=C(N[C@H]1CCC[C@H]1C1CC1)c1cccc(O)c1O 1965394501 KRGWQPRIGIRCSF-JQWIXIFHSA-N 261.321 2.406 10 10 CECE CNC(C)(C)CN(C)c1cc(F)c(OC)cc1F 258836353 HQNSFYWLWUUPNT-UHFFFAOYSA-N 258.312 2.408 10 10 CECE COc1ccc(N(C)C(C)(C)C(=O)O)c(OC)c1 258909311 YPWBLTZAQLCJOV-UHFFFAOYSA-N 253.298 2.003 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@H](CCO)C3)ccc21 2128279522 QJZZIOOOKDMYSH-MLGOLLRUSA-N 260.381 2.231 10 10 CECE CCN1CCN(c2ccc3c(c2)CC[C@H]3N)[C@H](C)C1 2128295903 PJVVTDQMLNMMRU-MLGOLLRUSA-N 259.397 2.163 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@@H](C)[C@H]3CO)ccc21 2128315209 PNCPJNNKFWLKDV-HFBAOOFYSA-N 260.381 2.100 10 10 CECE CN(C)CCC1CN(c2ccc3c(c2)CC[C@@H]3N)C1 2128321504 LFMFZTNUQSFIBY-INIZCTEOSA-N 259.397 2.021 10 10 CECE O[C@H]1CCc2cc(N3C[C@H](O)CC34CCC4)ccc21 2128320786 FMSXKQXZMXLEKQ-HIFRSBDPSA-N 259.349 2.160 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3CCO[C@H]3C2)cc1O 2128423128 VQQACUJJDXDPPH-PGUXBMHVSA-N 262.353 2.027 10 10 CECE COc1cccc(O)c1CN[C@H]1CCC[C@@H](CO)C1 840977485 ITGMYBZXFRAUDA-NEPJUHHUSA-N 265.353 2.042 10 10 CECE CC[C@@H](NC(=O)Cc1ccc(N)cc1)[C@H]1CCCCO1 848442298 BAKCBITUDHOAII-HUUCEWRRSA-N 276.380 2.275 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2Cc1cnc[nH]1 1912964339 RXEFPTZYUGKKEK-NSHDSACASA-N 256.353 2.382 10 10 CECE C[C@H](F)[C@H](N)[C@@H](O)c1ccc(N2CCCCC2)cc1 2133634850 ZPUQRLJJNDAEJD-CQDKDKBSSA-N 266.360 2.396 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CCS(=O)(=O)C2CCCC2)C1 1912197632 WTQHTDAXHBRJGD-LLVKDONJSA-N 286.401 2.119 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H]2CCCC[C@H]21 1912157594 RUQOOHOIZJORBS-WZRBSPASSA-N 266.345 2.398 10 10 CECE CCC(C)(C)NC(=O)CN1CCC[C@H](CN=[N+]=[N-])C1 1912197949 AOELZHPEQJFJQM-LLVKDONJSA-N 267.377 2.314 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C[C@@H]2CC3(CCOCC3)CO2)C1 1912189075 TZFBYCMFKUUGNC-OLZOCXBDSA-N 280.372 2.204 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)c2cscn2)CC1 1912176312 XMGQYIOCHPVGLG-UHFFFAOYSA-N 251.315 2.306 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H]2CCCCNC2=O)CC1 2134668062 AHGZXXLJAZWYLN-NWDGAFQWSA-N 265.361 2.068 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@H]1C[C@@H]2CC[C@@H]2C1 2134948759 PWMRTJJMGTVZEL-LKWSVKKZSA-N 261.365 2.450 10 10 CECE CCCN(c1ccc([C@@H](C)O)cc1F)C1COC1 1915724086 PTBRTAKBGLGIQN-SNVBAGLBSA-N 253.317 2.494 10 10 CECE C[C@@H]1[C@H](N)CC(C)(C)CN1Cc1ccc(O)c(O)c1 1916274868 VGGFHRKIIQZMAB-ZYHUDNBSSA-N 264.369 2.046 10 10 CECE C[C@@H]1OC2(C)CC1(NCc1cc(F)ccc1O)C2 1966078130 WRDFAGRRDJEKGG-SQNUNTJVSA-N 251.301 2.331 10 10 CECE CO[C@H](C)COc1ccc(N2CCCNCC2)c(C)c1 228593609 MOKJAFQVQMPZDM-CQSZACIVSA-N 278.396 2.208 10 10 CECE Cc1ccccc1S(=O)(=O)NCCCCN=[N+]=[N-] 231733888 ZTVGBIUNKZZYAF-UHFFFAOYSA-N 268.342 2.364 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c(OC)c2)CCCO1 2139682289 FXYBLTKSVDWWHH-CQSZACIVSA-N 265.353 2.193 10 10 CECE CCCNCc1ccc(N2CC(OC)C2)cc1OC 2139699297 SWBIBDYPKILLDK-UHFFFAOYSA-N 264.369 2.030 10 10 CECE Cc1ccc(CNC[C@@]23COC[C@@H]2C3(F)F)c(O)c1 2139774119 OVOAYJGZQOLMIW-QWHCGFSZSA-N 269.291 2.072 10 10 CECE Cc1cccc(Cn2cncc2[C@@H]2CCNC2)c1O 2139742410 VHQZZGMKIAVFPZ-GFCCVEGCSA-N 257.337 2.022 10 10 CECE CN1C(=O)C(=Cc2ccc(C=O)cc2)SC1=S 1935502618 DLDRJVRRHBGGBZ-UHFFFAOYSA-N 263.343 2.330 10 10 CECE CO[C@H]1C[C@@H](C)CN(CCOc2ccc(N)cc2)C1 2140965371 QSMZZDIXOOOMTK-DOMZBBRYSA-N 264.369 2.004 10 10 CECE CCN[C@H](CC)c1ccc(N(C)CCS(C)(=O)=O)cc1 233584029 VQKIKZFBFCXLIG-OAHLLOKOSA-N 298.452 2.228 10 10 CECE CCNCc1cc(F)c(N2CC[C@H](OC)C2)c(F)c1 233522492 YEJWYDIMTWQFDF-NSHDSACASA-N 270.323 2.299 10 10 CECE CC[C@H](N)c1ccc(N(CCOC)CCOC)cc1 234051528 LVTZNZOMGWWRFS-HNNXBMFYSA-N 266.385 2.196 10 10 CECE CNCc1ccc(N2CCC(CO)CC2)cc1Cl 234426731 IMDHKEYGZMGWGV-UHFFFAOYSA-N 268.788 2.268 10 10 CECE Cc1ccc(CN[C@H]2C[C@@H]3CCCCN3C2)c(O)c1 1969661643 MNAKBOHCMOKWAU-GJZGRUSLSA-N 260.381 2.417 10 10 CECE Oc1ccc(CNc2cccc3[nH]ncc23)c(O)c1O 236597251 XQMMTFFKIFQLQR-UHFFFAOYSA-N 271.276 2.292 10 10 CECE Cc1cccc(O)c1CN1CCCC[C@H](C(=O)O)C1 1972909559 PTYVFBFGXDUWMH-LBPRGKRZSA-N 263.337 2.387 10 10 CECE CN(C)c1ccc(CNCC23CC(C)(CO2)C3)cc1 1973322267 MGXOHDRXIRGTDR-UHFFFAOYSA-N 260.381 2.411 10 10 CECE CSC[C@H]1C[C@@H](NCc2cccc(O)c2O)C1 2004101246 YJSHKEJFSYKIKI-JGZJWPJOSA-N 253.367 2.329 10 10 CECE COc1cccc(O)c1CN[C@H]1CC(C)(C)[C@@H]1OC 1974252751 NYGRPOQUCXPXHX-SMDDNHRTSA-N 265.353 2.304 10 10 CECE Nc1ccc(OCc2nc(-c3ccc[nH]3)no2)cc1 159549251 PERXJZZVRABQRT-UHFFFAOYSA-N 256.265 2.226 10 10 CECE CN[C@H](C)c1ccc(N2CC(=O)NC(C)(C)C2)c(Cl)c1 2150468774 HQJZWRGIFUXZEL-SNVBAGLBSA-N 295.814 2.335 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)c1csnc1OC 2148166751 ZBDPCCSPKDAZKK-OLZOCXBDSA-N 294.376 2.242 10 10 CECE CN(C)c1ccc([C@@H](N)c2cnn3ccccc23)cc1 2145407654 HFHDIUGCMVYXGV-MRXNPFEDSA-N 266.348 2.448 10 10 CECE CC(C)(F)[C@@H]1CCN(CC(=O)c2ccc(O)c(O)c2)C1 2145555934 LDNOQUGMKHKSJI-LLVKDONJSA-N 281.327 2.351 10 10 CECE CC[C@H]1CCCN1CC(=O)N(C)c1ccc(N)cc1 37913148 FAZOIAXCRJPJJU-ZDUSSCGKSA-N 261.369 2.106 10 10 CECE Cc1cc(C)nc(CNCc2ccc(N(C)C)cc2)n1 2149974781 XMUYPJLNALITBU-UHFFFAOYSA-N 270.380 2.449 10 10 CECE CC(C)N(C(=O)CN(C)Cc1ccc(N)cc1)C(C)C 2148886979 DYHVPJHGBJHQPI-UHFFFAOYSA-N 277.412 2.346 10 10 CECE C[C@@H](N)c1ccc(N2CC=C[C@@H](O)C2)c(Br)c1 2000824131 MJVHOBYOCGJUJN-MWLCHTKSSA-N 297.196 2.206 10 10 CECE CCOc1cccc(CN2[C@H]3CC[C@@H]2C[C@H](N)C3)c1O 2151258345 SMMJYPGGRXFGHK-BTTYYORXSA-N 276.380 2.245 10 10 CECE CNCc1ccc(N2CC[C@H]3CCN(C)[C@@H]3C2)c(C)c1 2158541742 MYWDUTDRHIFIQO-NVXWUHKLSA-N 273.424 2.245 10 10 CECE CC1(C)[C@@H](CO)CCN1CCCOc1ccc(N)cc1 2151556096 PVCGEBXIZPOUAO-CYBMUJFWSA-N 278.396 2.131 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@@H]3OCCO[C@H]3C2)cc1 2151738741 NMKXDWWGQCJLON-JYJNAYRXSA-N 276.380 2.091 10 10 CECE C[C@@H](NCCc1ccnnc1)c1ccc(N(C)C)cc1 2151876907 NUWWXKDDNWYFPO-CYBMUJFWSA-N 270.380 2.436 10 10 CECE CN(C[C@H]1CCCCCO1)C(=O)Cc1ccc(N)cc1 2152618060 MHSIVUZAQSJATP-OAHLLOKOSA-N 276.380 2.229 10 10 CECE C[C@@H](NCc1cncn1C1CC1)c1c(O)cccc1O 2153018044 LCERLUYWRPCRIT-SNVBAGLBSA-N 273.336 2.480 10 10 CECE CN(C[C@H]1C=CCCC1)S(=O)(=O)Cc1ccc(N)cc1 2153100520 IIRRFVASHGPQPQ-ZDUSSCGKSA-N 294.420 2.387 10 10 CECE CCN[C@@H](c1ncco1)[C@@H](O)c1ccc(N(C)C)cc1 2153941198 QLMCHRWEECXBOH-KGLIPLIRSA-N 275.352 2.125 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1c[nH]nc1Br 2016264710 CAWBAUQVFKUCKA-ZCFIWIBFSA-N 299.132 2.087 10 10 CECE Oc1c(Cl)cccc1CNOC1CCOCC1 2017850878 FGRMXFUDFAKHBA-UHFFFAOYSA-N 257.717 2.246 10 10 CECE CCC[C@H](O)CCN[C@@H](C)c1cc(O)ccc1O 2029922020 JSSLODGLDWBTSX-QWRGUYRKSA-N 253.342 2.300 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(Cl)c2)[C@H](C)C[C@@H]1O 2032209626 ZGEMNIREERHLOO-RULNRJAQSA-N 268.788 2.394 10 10 CECE CC=C1SC(=S)N(CCCCCC(=O)O)C1=O 2040488995 DYWCWGFIJCYLCL-UHFFFAOYSA-N 273.379 2.396 10 10 CECE CC(C)NCc1ccc(N2CC[C@H](C)[C@H](O)C2)cc1 300001569 HUZYCBJTQAHXJS-XJKSGUPXSA-N 262.397 2.392 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H]1CC12CCCC2 2039091888 LZBKPXKUPMWTNF-UWVGGRQHSA-N 252.318 2.008 10 10 CECE CN(C[C@@H]1C[C@@]12CCOC2)C(=O)Nc1ccc(N)cc1 2156763387 CPIXCGCGVBXTHY-XHDPSFHLSA-N 275.352 2.159 10 10 CECE C[C@@H](N)c1ccc(N2CCC(CCO)CC2)c(F)c1 401145010 UTAALBDJSAHHEA-LLVKDONJSA-N 266.360 2.444 10 10 CECE Nc1cc2c(cc1N1CCCC(F)(F)C1)OCCO2 405094218 WGQYBSKAWYLCSE-UHFFFAOYSA-N 270.279 2.276 10 10 CECE COc1ccc([C@@H](C)NC[C@@](C)(O)C(C)C)c(O)c1 312017419 XUDMJAOPLYLSSN-IAQYHMDHSA-N 267.369 2.458 10 10 CECE CSC[C@H]1CCCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 312616409 AMYRKYRTPWQWRJ-IINYFYTJSA-N 291.420 2.218 10 10 CECE C[C@@H](CC1CC1)N(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 2158006567 GJPGTPFPNJCPKB-BONVTDFDSA-N 273.380 2.288 10 10 CECE CCN(C)c1cc(N(C)Cc2ccc(N)cc2)ncn1 2158172298 MMOCUIKMILPCQY-UHFFFAOYSA-N 271.368 2.151 10 10 CECE CC[C@H]1CN(Cc2ccc(F)c(F)c2O)C[C@H]1N(C)C 2170467746 TWZAJVBETDLAGD-GXFFZTMASA-N 284.350 2.442 10 10 CECE C[C@H](NCc1cc2c(cc1O)OCO2)c1cscn1 700444371 PYQIDVBHCGXGGA-QMMMGPOBSA-N 278.333 2.428 10 10 CECE CN1CCCc2cc(CN[C@H]3[C@H]4OCCC[C@@H]43)ccc21 2176419557 TYNFEDFKUBSPJU-OIISXLGYSA-N 272.392 2.336 10 10 CECE CCC1(OC)CCC(O)([C@H](N)c2ccccc2O)CC1 2161462274 DVRWZQMAVIHLLP-QQFBHYJXSA-N 279.380 2.492 10 10 CECE C[C@H]1CC(C)(C)CN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2170900668 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COCCN(c1ccc([C@H](C)O)c(C)c1)[C@H]1CCOC1 2285172123 AJYOYFQTDSPAAD-ZFWWWQNUSA-N 279.380 2.290 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@]3(CO)C2)cc1C 2285141553 UPTZKOCPXVQIMR-CKEIUWERSA-N 274.408 2.484 10 10 CECE CNC[C@H]1CCCN(c2ccc(OC)c(C)c2OC)C1 2295429545 BEEOJRFNAGNRGU-CYBMUJFWSA-N 278.396 2.448 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@H]2CC[C@@H](C(N)=O)CC2)c1 2287895996 YCLKKUFWVDDMNP-UPJWGTAASA-N 276.380 2.395 10 10 CECE CCN(CC)c1ccc(CNCC2CN(C)C2)cc1 379476158 SJMZSUOLJSOXRH-UHFFFAOYSA-N 261.413 2.184 10 10 CECE C[C@H](CC1CC1)NC(=O)C=Cc1ccc(O)c(O)c1 2308001155 FDWAPPRKCHMQLP-SNVBAGLBSA-N 261.321 2.416 10 10 CECE CCN1CCC[C@](Sc2nccs2)(C(=O)O)C1 2306965945 YWDHIURNDFLFLZ-LLVKDONJSA-N 272.395 2.174 10 10 CECE Cc1ccc(CN2CC[C@H](CN)C2)c(O)c1Br 2307439867 RWUNFKCUFCAFAK-SNVBAGLBSA-N 299.212 2.244 10 10 CECE CNCc1ccc(N2CCOC[C@H](F)C2)cc1Cl 2315062918 FAVQCTZEBXYWDU-LLVKDONJSA-N 272.751 2.234 10 10 CECE FCOc1ccc(N2CCN[C@@H]3CCC[C@@H]32)cc1 2319246109 KONLZVIJFBXJOD-KGLIPLIRSA-N 250.317 2.323 10 10 CECE CN1CCN(N=Nc2ccc([N+](=O)[O-])cc2Cl)CC1 2330197095 NHVGQCUIVKFWHI-UHFFFAOYSA-N 283.719 2.494 10 10 CECE COc1ccc([C@H](C)N[C@H]2[C@@H]3CCCO[C@@H]32)c(O)c1 2330686322 IAIBXORXSFVDLN-HLHNXRDNSA-N 263.337 2.229 10 10 CECE COC[C@H]1CC[C@@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2333611985 APIACBHCLFVRHH-QCNOEVLYSA-N 266.345 2.397 10 10 CECE CNCc1ccc(N2CCC3CC2(CO)C3)cc1C 2336481060 WCRHXGBOGKNQGQ-UHFFFAOYSA-N 260.381 2.066 10 10 CECE C[C@@]1(CNCc2cc(F)cc(F)c2O)CC=CCO1 2340186702 MDLQJPXZUPNMJI-AWEZNQCLSA-N 269.291 2.495 10 10 CECE C[C@@H]1[C@H](O)CCN(CCCc2ccc(N)cc2)[C@@H]1C 2344553595 GANQXSOMGIDCIY-WOSRLPQWSA-N 262.397 2.293 10 10 CECE CSc1cc(N2CC[C@H](O)[C@@H](C)[C@@H]2C)ccc1CN 2353857863 ZJOPOSCYJIEOHA-MJVIPROJSA-N 280.437 2.463 10 10 CECE CSc1cc(N2CCN(C3CC3)CC2)ccc1CN 2353858505 LUEPWCJVSUTLAU-UHFFFAOYSA-N 277.437 2.152 10 10 CECE CCN(Cc1cc([N+](=O)[O-])ccc1O)C[C@H]1CCCO1 173406537 IRAQXXHTJHJTTQ-CYBMUJFWSA-N 280.324 2.301 10 10 CECE Cc1cccc(CN2Cc3ccccc3C[C@H]2C(N)=O)c1O 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252.383 2.300 10 10 CECE Cc1cc(Br)cc(CN[C@@H](C)CCO)c1O 133242689 PQLGGMQIAPPMCX-VIFPVBQESA-N 288.185 2.324 10 10 CECE COc1ccc([C@H](C)N[C@H](C)C[C@@H](C)O)c(O)c1 228073081 KSHGOTOEQSPLHO-MXWKQRLJSA-N 253.342 2.211 10 10 CECE Fc1cc(OC2CCOCC2)ccc1N1CCCNCC1 87439341 YYGIPCXVZZYWJV-UHFFFAOYSA-N 294.370 2.183 10 10 CECE OCC1(NCc2c(O)cccc2Cl)CCCC1 94512586 FFEQBEXMHFADJJ-UHFFFAOYSA-N 255.745 2.440 10 10 CECE CCNCc1ccc(N2CC[C@H](OC)C2)c(F)c1 233542325 ZNTYSRRZJADFTM-LBPRGKRZSA-N 252.333 2.160 10 10 CECE CC(C)CC[S@@](=O)CCOc1ccc(N)cc1 232578228 GWOXUWQRNAJLOZ-QGZVFWFLSA-N 255.383 2.442 10 10 CECE CCN(C)c1ccc([C@H](C)N[C@@H]2CCN(C)C2=O)cc1 90075358 XTOHTCBMFBMDAW-SWLSCSKDSA-N 275.396 2.024 10 10 CECE CNCc1cc(F)c(N2CC[C@H](C)[C@H](CO)C2)c(F)c1 700388104 AQTBLVRGNNTSFJ-JQWIXIFHSA-N 284.350 2.139 10 10 CECE COCCCCCCNCc1ccc(O)cc1O 2221362528 KBQGIUQJOACWFZ-UHFFFAOYSA-N 253.342 2.394 10 10 CECE COCC[C@H]1CCCCN(C(=O)c2cccc(O)c2O)C1 365769450 UZSURFIGXJZITH-GFCCVEGCSA-N 293.363 2.377 10 10 CECE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CC2(C)C)c1O 278634283 HGCRJPNAYUDBKC-SNVBAGLBSA-N 266.297 2.197 10 10 CECE C[C@H]1CN(Cc2c(O)ccc3ccccc23)CC(=O)N1C 281732967 AWEKGQLSJSDDGR-LBPRGKRZSA-N 284.359 2.208 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CCNC34CC4)ccc21 2163096048 GLDBRKWSXAKEFF-HOCLYGCPSA-N 272.392 2.245 10 10 CECE CCN(CC)c1ccc([C@@H](COCCOC)NC)cc1 2163106041 LTBKGIJUNDORBP-MRXNPFEDSA-N 280.412 2.456 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@@H]1NC[C@H]2C[C@@H]21 2163110516 JNKQYVLRLLQKTI-XLNGHYISSA-N 272.392 2.318 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2C[C@H]3CC[C@H]2O3)cc1O 2168074837 POODYGXBPYKEHR-DDFXLWFNSA-N 277.364 2.449 10 10 CECE Cc1nn(C)c(Cl)c1[C@H](N)c1ccc2c(c1)CCN2C 2164023038 QYUNXDFUKFHZMS-CQSZACIVSA-N 290.798 2.422 10 10 CECE CCO[C@H]1C[C@@H](OC)CN(c2ccc(CO)c(C)c2)C1 2165439454 BDPMCKBNDFCVPR-CVEARBPZSA-N 279.380 2.118 10 10 CECE C[C@H]1C[C@@H]1COC(=O)c1ccn(-c2ccc(N)cc2)n1 722625347 BZBJZXORVRKYGJ-WDEREUQCSA-N 271.320 2.267 10 10 CECE COc1cc([N+](=O)[O-])cc([C@@H](N)[C@H](O)CCC(C)C)c1O 725415885 XPOXLXBOSDXBKB-DGCLKSJQSA-N 298.339 2.106 10 10 CECE Oc1ccc(F)cc1CN1CCCc2n[nH]cc2C1 828013807 LCIPJOVBUVPWQK-UHFFFAOYSA-N 261.300 2.203 10 10 CECE CCC/C=C\[C@@H](O)C(=O)N[C@@H](C)c1ccccc1O 913763813 SBLZQSHFCCJPKT-XAXUSYLVSA-N 263.337 2.287 10 10 CECE CC1(C)CN(Cc2cccc(Cl)c2O)[C@@H]2COC[C@H]2O1 846118545 PDJVDHDRODZLJO-CHWSQXEVSA-N 297.782 2.424 10 10 CECE COC[C@H](N[C@@H](C)c1ccccc1O)C1CCOCC1 850493368 VWGUZDVSHZWVCV-WFASDCNBSA-N 279.380 2.484 10 10 CECE C[C@]12COC[C@@H]1CN(Cc1cc3c(cc1O)CCC3)C2 853565629 HXTYWEUBEHUYRZ-RDJZCZTQSA-N 273.376 2.349 10 10 CECE C[C@@H](CN(C)CCCN(C)C)N[C@@H](C)c1ccccc1O 850500081 COKDJGZNNXUNAC-GJZGRUSLSA-N 293.455 2.315 10 10 CECE CCC1(S(=O)(=O)N2CCC[C@@H](N=[N+]=[N-])C2)CC1 696329129 POBTXXFUQHUMAQ-SECBINFHSA-N 258.347 2.034 10 10 CECE O=C(NCc1ccc2cccnc2c1O)[C@@H]1C[C@H]2CC[C@@H]1O2 862025665 ZFYLFJZZZFEQJR-MCIONIFRSA-N 298.342 2.124 10 10 CECE CCCN(Cc1ccccc1O)C(=O)c1ncccc1N 866598622 KMXWBVSAZARCCK-UHFFFAOYSA-N 285.347 2.422 10 10 CECE CC(C)(C)[C@@H]1C[C@H]1C(=O)NCc1ccc(O)c(O)c1 866769060 HBLYTANXVKGGTM-GHMZBOCLSA-N 263.337 2.396 10 10 CECE C[C@@]12CN(C(=O)c3cccc(O)c3O)C[C@@H]1[C@@H]1C=C[C@H]2C1 1117818734 OESDKFGEEHSGFF-PCUPFXIVSA-N 285.343 2.382 10 10 CECE COC(=O)[C@H]1[C@@H](CN[C@H](C)c2ccccc2O)C1(F)F 895460059 ITSWAJXVJGFKED-HLUHBDAQSA-N 285.290 2.097 10 10 CECE COC[C@@H](NCc1ccc(C)cc1O)[C@@H]1CCCOC1 895857386 BLYPNKYOGBYRLK-HUUCEWRRSA-N 279.380 2.232 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCC=C[C@H]2CO)c(F)c1 1880478835 IRUCVKIELKSGOW-KOLCDFICSA-N 269.291 2.145 10 10 CECE COc1ccc(N2C[C@H](F)[C@H](O)C2)c2ccccc12 1144605825 GNQMWAWEQSSWFH-GXTWGEPZSA-N 261.296 2.367 10 10 CECE CNC(=O)C1CCN([C@@H](C)c2cc(C)ccc2O)CC1 133343382 GVRWNFFKNVXOIN-LBPRGKRZSA-N 276.380 2.220 10 10 CECE c1cc2c(cc1CN[C@@]13CCOC[C@@H]1C3)CCCO2 1880172114 ORBFIBXMIGBKEB-GOEBONIOSA-N 259.349 2.280 10 10 CECE C[C@H](N)CCCC(=O)N(C)[C@H](C)c1ccccc1O 133534836 SUUPDBJUOGFVIX-NWDGAFQWSA-N 264.369 2.429 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@@H]1CCN(C)C1 386892113 XXGCHBLPPIKSAC-ZYHUDNBSSA-N 252.333 2.228 10 10 CECE COc1ccc(CCC(=O)NCCN=[N+]=[N-])cc1OC 74320382 JOIBBBKYRZLVGK-UHFFFAOYSA-N 278.312 2.063 10 10 CECE Nc1ccc(Cn2c(N)nc3cc(F)ccc32)cc1 75948157 GQJUJUHTKNLAOK-UHFFFAOYSA-N 256.284 2.388 10 10 CECE COc1cc(C(=O)O)c(N2CCCC2)cc1OC 93956052 SAMWLBQHKFHLAK-UHFFFAOYSA-N 251.282 2.002 10 10 CECE COc1ccc([C@@]2(C)COC(C)(C)CN2)c(O)c1 83385093 SPISYJWENQPOPX-CQSZACIVSA-N 251.326 2.014 10 10 CECE Oc1cccc2c1[C@H](c1cnc(Cl)cn1)NCC2 83660274 LTJWHZTVUHKDOO-ZDUSSCGKSA-N 261.712 2.071 10 10 CECE CC(C)N(C[C@@H]1CCN(C)C1)c1ccc(CN)cc1 691348539 JMWUPAUYURIPIX-OAHLLOKOSA-N 261.413 2.312 10 10 CECE CCc1cccc(CN(C)[C@@H]2COCC2(F)F)c1O 1888234171 OYPWAHBAPQXVDU-GFCCVEGCSA-N 271.307 2.421 10 10 CECE Nc1ccc(OCCC(=O)N2C[C@@H]3CCCC[C@@H]32)cc1 706861099 HFBMJMMYKCIVII-WFASDCNBSA-N 274.364 2.439 10 10 CECE C[C@H](NCc1cc(F)cc(F)c1O)[C@@H]1CCCO1 708559727 IATPLRSDVLSKGC-UFBFGSQYSA-N 257.280 2.328 10 10 CECE 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CN(C)c1ccc(CN2CC(CO)(c3ccccc3)C2)cc1 840970126 PPVUFPLYRZLQBF-UHFFFAOYSA-N 296.414 2.499 10 10 CECE COc1cccc(CNCc2nccc(OC)c2F)c1O 850381187 WFNQHCHIQDCDJZ-UHFFFAOYSA-N 292.310 2.233 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)cc1 852870535 DOBKIKUUEKMRNT-CGTJXYLNSA-N 296.345 2.405 10 10 CECE Cc1ccc([C@@H](C)NC[C@@](C)(O)C(F)F)c(O)c1 698676443 GWLGJKUHEJZMTB-NOZJJQNGSA-N 259.296 2.367 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCS[C@@H](C(=O)O)C1 699257640 KEQLBBMADYCOPJ-QPUJVOFHSA-N 285.340 2.094 10 10 CECE COc1nc(C)nc(N2Cc3cccc(O)c3C2)c1C 866118192 YCZWGQNEZGRIIG-UHFFFAOYSA-N 271.320 2.328 10 10 CECE Cc1cc(O)c(CN2CCNCC2)c(C)c1Cl 71455035 WNYFARQODTUHHU-UHFFFAOYSA-N 254.761 2.068 10 10 CECE CCCOc1cc(N2CCCC[C@@H](N)C2)ccc1N 1876265536 ITFUETPNEMLFHW-GFCCVEGCSA-N 263.385 2.375 10 10 CECE Nc1ccc(CNc2ncnc3sc(N)cc23)cc1 1876389238 JIJPXCFKASETBX-UHFFFAOYSA-N 271.349 2.468 10 10 CECE C[C@H]1C[C@H](COC(=O)c2cccc(O)c2O)CCO1 784788158 PVFRULKZRXDMDS-VHSXEESVSA-N 266.293 2.070 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC2CC1(C(=O)O)C2 1877381016 OIOXUWSQNZNCOG-JUXJKVCFSA-N 265.284 2.141 10 10 CECE C[C@H](O)[C@H]1CCCN1c1c(F)cc([C@@H](C)O)cc1F 1880478616 GVLGIPHAFBRKRQ-VYUIOLGVSA-N 271.307 2.368 10 10 CECE Oc1ccc(Cl)c(F)c1CN[C@H]1CCCOC1 790960700 ZLULDZFARYZDPI-QMMMGPOBSA-N 259.708 2.453 10 10 CECE CCCN(CCC(=O)N(C)OC)Cc1ccccc1O 799125969 VZQBFMWHWXVFOD-UHFFFAOYSA-N 280.368 2.014 10 10 CECE NC(=O)CN(Cc1c(O)cccc1Cl)C1CCCC1 132987776 UJUOTOMZZXSEIY-UHFFFAOYSA-N 282.771 2.276 10 10 CECE CN(C)c1ccc([C@@]2(O)CCN[C@H](C3CC3)C2)cc1 1879702053 VSCJOHBMHBWAOX-JKSUJKDBSA-N 260.381 2.102 10 10 CECE CC1(C)CN(CCC(=O)O)c2cc3c(cc21)OCCO3 84804598 HYKJPXWYPRRPLJ-UHFFFAOYSA-N 277.320 2.030 10 10 CECE CCOc1ccc(N2CC[C@@H](CNCCOC)C2)cc1 76365018 DFTPOMRAOPFIAZ-AWEZNQCLSA-N 278.396 2.148 10 10 CECE CCN1CCC(N(C)c2ccc(CN)c(F)c2)CC1 135225377 YEQNGMZCHFYOCI-UHFFFAOYSA-N 265.376 2.205 10 10 CECE CC[C@H](C)N1CCN(c2ccc(CN)c(F)c2)CC1 135226933 CDQZZYZUSLHJFR-LBPRGKRZSA-N 265.376 2.205 10 10 CECE COc1ccc([C@@H]2CN[C@H](C(C)C)CN2C)c(O)c1 83479553 BGFLXXZTEOETFC-KBPBESRZSA-N 264.369 2.002 10 10 CECE Oc1cccc2c1[C@@H](c1cnn3ccccc13)NCC2 83594393 YGEZXPDPRINAPI-MRXNPFEDSA-N 265.316 2.275 10 10 CECE N[C@H](c1nnc(-c2ccoc2)o1)c1cccc(F)c1O 83542585 UDMYOWHQIYCYIG-JTQLQIEISA-N 275.239 2.222 10 10 CECE Oc1ccc([C@H]2NCCc3cc(F)ccc32)cc1O 83621868 YPEZPMOZJJRKLT-OAHLLOKOSA-N 259.280 2.472 10 10 CECE O=Cc1ccc(O)c([C@@H]2NCCc3cccc(O)c32)c1 83659669 WBEDNEKBPKKWMO-INIZCTEOSA-N 269.300 2.145 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1ccnc(F)c1F 701319380 NFBZAXVKHJJDFZ-SSDOTTSWSA-N 267.239 2.275 10 10 CECE COCC(C)(C)N(C)c1c(F)cc(CN)cc1F 386495097 KNFVAVMZHHFQIL-UHFFFAOYSA-N 258.312 2.285 10 10 CECE C[C@@H]1C[C@@H](O)CN(c2ccc(CN)cc2Br)C1 401695524 JMSMSHKUHZPIPP-MWLCHTKSSA-N 299.212 2.115 10 10 CECE COc1ccc(O)c(CN[C@@H]2CCCSC2)c1 164751861 AHNMZCNCDCVGHJ-LLVKDONJSA-N 253.367 2.386 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@H]2CN(C)CCO2)cc1Cl 707867029 OBPGTVUFIIAMDB-DGCLKSJQSA-N 297.830 2.127 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H](CO)[C@@H](C)C2)cc1 708178539 WOUGSVQVYYDSRR-HOCLYGCPSA-N 276.424 2.497 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CCC[C@@H]2O)cc1O 689849765 VIJUTACXFBZKHE-MJVIPROJSA-N 264.369 2.009 10 10 CECE CCCCOCCOC(=O)Cc1ccc(N)cc1 41665372 APMPBHJWRBHOND-UHFFFAOYSA-N 251.326 2.171 10 10 CECE CCNCc1ccc(N2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1 718175652 QMPDJADLHUIART-YYIAUSFCSA-N 272.392 2.410 10 10 CECE CCNCc1ccc(N(C)[C@H]2CCN(CC)C2)cc1 688446739 JWFNSGFLGGILQB-INIZCTEOSA-N 261.413 2.327 10 10 CECE CC(C)OC(C)(C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 692870217 BGJLUEXEPNIMSH-JTQLQIEISA-N 254.334 2.491 10 10 CECE NC[C@@H]1CN(Cc2cc(F)ccc2O)CC12CCC2 693722822 ZJGALYKTLRBSHO-GFCCVEGCSA-N 264.344 2.092 10 10 CECE Nc1ccc(OCCNC(=O)[C@@H]2CCC[C@H]3C[C@H]32)cc1 694364328 BPVJIGXNUIOZNP-NILFDRSVSA-N 274.364 2.200 10 10 CECE C[C@@H]1CC(=O)N(CCCc2ccc(N)cc2)C[C@@H](C)O1 695538969 JZLTWSGHVLUORI-CHWSQXEVSA-N 276.380 2.227 10 10 CECE CSCCN(CC(=O)O)[C@H](C)c1ccc(F)cc1O 696929683 KUDAMIQKEBKMBX-SECBINFHSA-N 287.356 2.342 10 10 CECE OCc1ccc(N2CCO[C@H](CC(F)(F)F)C2)c(F)c1 699153685 YVCJIZHNHZNVNP-SNVBAGLBSA-N 293.260 2.476 10 10 CECE COC(=O)c1cnc(Sc2nc(C)ncc2C)s1 1346540144 ISADVYWHPAIBNX-UHFFFAOYSA-N 281.362 2.488 10 10 CECE CNC(=O)c1ccccc1N(C)C(=O)/C=C/c1cccnc1 1439222695 GUORVXMQELKYEM-MDZDMXLPSA-N 295.342 2.117 10 10 CECE CN(C(=O)/C=C/c1cn(C)cn1)c1ccc(F)c(F)c1 1356299349 JJGOHOYXJPLBJP-ZZXKWVIFSA-N 277.274 2.375 10 10 CECE Cc1cnc2c(c1)N(C(=O)/C=C/c1cccnc1)CCN2 1454473388 VRCODZCASSKNCN-SNAWJCMRSA-N 280.331 2.257 10 10 CECE CNCCN1C[C@H](C)Sc2cc(OC)ccc21 215031900 AEYYSHNRTYBJAH-JTQLQIEISA-N 252.383 2.215 10 10 CECE C[C@@H]1N(C(=O)CCc2ccc(N)cc2)CCC1(F)F 2115415313 MEVMYXIYKDWNQE-JTQLQIEISA-N 268.307 2.458 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CC[C@@]23C[C@H]3C(=O)O)c1 2115870158 ILWFPTQZPJZRFU-LNSITVRQSA-N 261.321 2.044 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cccc(F)c1C 2119438574 JBIXNCPVBMKBTQ-NSHDSACASA-N 266.276 2.248 10 10 CECE C[C@@H](N[C@@H](CO)c1cscn1)c1ccc(F)cc1O 2119001523 LBPPOMROVVVAIR-KCJUWKMLSA-N 282.340 2.372 10 10 CECE NCc1cc(F)c(N2C[C@H]3[C@H](O)CC[C@H]3C2)cc1Cl 2120880130 VSJBJTMMRMULQR-LLHLLMPMSA-N 284.762 2.145 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H]2C[P@@](C)(=O)C[C@@H]2O)c1 2121368149 LHKKXBXNHWETGH-FGGFUMCESA-N 283.308 2.087 10 10 CECE C[C@H]1CCCC[C@@H]1NC(=O)Cc1ccc(O)c(O)c1 1624009721 MPXIWOMFVRAOEE-JQWIXIFHSA-N 263.337 2.335 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)CCCCCO 1623386809 LCCIHZHYZCMPOZ-UHFFFAOYSA-N 278.396 2.264 10 10 CECE C[C@@]12CC[C@@](C(=O)N3CCC[C@@H]3CN=[N+]=[N-])(CO1)C2 2121865468 XEPGCMFKUUHGGC-WXHSDQCUSA-N 264.329 2.247 10 10 CECE COc1ccc(CNCc2cncnc2C)cc1C 2122297826 XRGVLYDNOAMDLZ-UHFFFAOYSA-N 257.337 2.392 10 10 CECE O=C(c1cccc2c1OCO2)N1Cc2cccc(O)c2C1 1632703896 RQARETVLMPSBIC-UHFFFAOYSA-N 283.283 2.277 10 10 CECE Cc1ccc(C(=O)NC[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)c(O)c1O 1638338986 SOUBMRWGSUHKST-DNIRFERGSA-N 275.348 2.428 10 10 CECE Cc1cccc(OCC(=O)NCc2ccc(O)cc2O)c1 1570460739 CBOJLXPDJXDWRT-UHFFFAOYSA-N 287.315 2.101 10 10 CECE Cc1c(CN[C@@H]2C[C@@H]2[C@H](C)O)n(C)c2ccccc12 2125867545 NDMOCZJMLADSJV-IACUBPJLSA-N 258.365 2.346 10 10 CECE CCCOc1cc(N2CCN3CCC[C@H]3C2)ccc1N 249784453 JJDHSPGRFNILOA-AWEZNQCLSA-N 275.396 2.342 10 10 CECE CC(C)[C@@H]1[C@@H](O)CCN1c1ccc([C@@H](C)O)cc1F 2126101628 QYKFAJJCZGDXPO-WKPIXPDZSA-N 267.344 2.475 10 10 CECE Cc1cc(O)c(CN2CCS(=O)(=O)C(C)(C)C2)cc1C 151439946 ZGMPXSSZBGZODJ-UHFFFAOYSA-N 297.420 2.018 10 10 CECE CCOC(=O)[C@H]1CCCN(/N=N/c2cccnc2)C1 1860488450 SCJMCEFSHPLGGZ-RJLNKPMYSA-N 262.313 2.355 10 10 CECE COc1cc(C)c(N(C)CC(C)(C)O)c(OC)c1 258954324 XGCSWTYJUHPPMK-UHFFFAOYSA-N 253.342 2.219 10 10 CECE CNCc1ccc(N2CC[C@@H](O)[C@@H]2C2CC2)c(Cl)c1 2130608719 VLMSULWTQXNNMW-CABCVRRESA-N 280.799 2.409 10 10 CECE CCCC1(O)CN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128275802 WKQLMALLPCSMKM-HNNXBMFYSA-N 261.365 2.408 10 10 CECE CN[C@@H]1CCc2cc(N3CCOC[C@@H]3CF)ccc21 2128312654 KSZWJYOBDRPYGK-DZGCQCFKSA-N 264.344 2.068 10 10 CECE Cc1ncnc(C)c1CNCc1cccc(F)c1O 2130856994 JOVHYZRHFQVDGM-UHFFFAOYSA-N 261.300 2.228 10 10 CECE Cc1ccc(CN2CCC[C@]23CCCNC3)c(O)c1 1222247382 DWFUVDUYSFOCTE-INIZCTEOSA-N 260.381 2.419 10 10 CECE CC(C)N1C[C@@H]2C[C@H]1CN2c1ccc([C@H](C)O)cc1 2131064079 XZNUTKMDQXHMJO-RCBQFDQVSA-N 260.381 2.411 10 10 CECE CN[C@H](c1ccc2cncn2c1)c1ccccc1O 2131247373 LAOLTCKOJPSXDF-OAHLLOKOSA-N 253.305 2.349 10 10 CECE O=C(NC1CC2(C1)CC2(F)F)c1cccc(O)c1O 1261752329 AYSCXCGYZGZRHQ-UHFFFAOYSA-N 269.247 2.015 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(OCCF)cc2)C1 2132973294 GOBLXDGXCLPYTP-UHFFFAOYSA-N 264.260 2.170 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cnn(-c3ccccc3)c2)C1 1912180963 IOHOREZELCVRRB-UHFFFAOYSA-N 268.280 2.007 10 10 CECE Cc1ccc(S(=O)(=O)N(C)CCN=[N+]=[N-])c(F)c1 1912153761 DOLDKJANEPLGOR-UHFFFAOYSA-N 272.305 2.065 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@H]2C[C@@H]2C1 1912190538 FLWNOJNWMUHHBA-LOWVWBTDSA-N 266.345 2.398 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3CCC[C@H]2COC3)cc1O 1900653238 PKRWCGUNVZOAHV-DRZSPHRISA-N 263.337 2.203 10 10 CECE CC(C)(O)[C@H]1CCN1c1ccc2c(c1)CCC[C@H]2N 2134632397 LDVSXVFGLMIJFG-HUUCEWRRSA-N 260.381 2.372 10 10 CECE CNC(=O)[C@H](C)N(C)c1ccc(C=CC(=O)O)c(Cl)c1 1916239575 OXZXRIUOPILXET-VIFPVBQESA-N 296.754 2.009 10 10 CECE CN(C)CCCN(C)c1ccc(CNC2CC2)cc1F 111140984 VIPVEUQRTORZOT-UHFFFAOYSA-N 279.403 2.466 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1917447555 JFAQZPMHBIAUBZ-XUEPZPCASA-N 258.321 2.423 10 10 CECE COC[C@@]1(CN[C@@H](C)c2cc(F)ccc2O)CCCO1 1967530882 RUKAGBSPNNXPSE-NHYWBVRUSA-N 283.343 2.378 10 10 CECE COc1ccc(CN2CCO[C@@H]3CCC[C@H]32)c(O)c1 228144582 QJIMTHDODYQLDS-UKRRQHHQSA-N 263.337 2.154 10 10 CECE CN(C)[C@H]1CCC[C@@H]1CNCc1cc(F)cc(F)c1O 1924711751 BYPXYKYCPABLOO-YGRLFVJLSA-N 284.350 2.490 10 10 CECE CC(C)C[C@H](C(=O)O)[C@@H](N)c1ccc2c(c1)CCN2C 1927351546 ZEWAJKSCBNCMCI-ZFWWWQNUSA-N 276.380 2.426 10 10 CECE CC1(C)CC(=O)N(c2ccc(N)c3ncccc23)C1=O 122201322 AIQRTALRAPQJLT-UHFFFAOYSA-N 269.304 2.107 10 10 CECE COc1ccc([C@H](C)NCCSCCCO)c(O)c1 230661123 CHTDJHJOKQEPJI-NSHDSACASA-N 285.409 2.167 10 10 CECE Oc1ccc(F)cc1CN1CC[C@H]([C@H]2CCCN2)C1 1967991142 PDYFJYWDXPOVNU-SMDDNHRTSA-N 264.344 2.105 10 10 CECE COc1ccc(N2C[C@H]3C[C@@H](N)C[C@H]2C3)c(F)c1F 2136973927 AUWKREIWYAAGEP-IVZWLZJFSA-N 268.307 2.289 10 10 CECE CCN(C[C@H]1CCCN1)[C@@H](C)c1cc(O)ccc1O 233474060 CUEVSYSZNHZGAB-NWDGAFQWSA-N 264.369 2.233 10 10 CECE CC[C@H]1OCC[C@@H]1C(=O)N(C)Cc1ccc(N)cc1 234073447 OXAWGJPGUSIEEI-UONOGXRCSA-N 262.353 2.042 10 10 CECE CN(C)c1ccc([C@@H](NN)C2(P(C)(C)=O)CC2)cc1 2139577627 GFKSIJRHHSTJSJ-CYBMUJFWSA-N 281.340 2.412 10 10 CECE C[C@H](N)Cc1cccc2c1ccn2Cc1ccncn1 2145811086 FEPJFBRHHNNWHH-LBPRGKRZSA-N 266.348 2.369 10 10 CECE C[C@@H]1C[C@@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]21 2141487774 FSUFEAQPPKMUTI-GMTAPVOTSA-N 260.337 2.132 10 10 CECE CCN(c1ccc(CO)c(Br)c1)C1CN(C)C1 1943087994 PXLLVWQBEYMTPN-UHFFFAOYSA-N 299.212 2.082 10 10 CECE CCNCc1ccc(N2CC[C@H]2CO)cc1Cl 1944085767 HMOAOBZLKBWIJP-LBPRGKRZSA-N 254.761 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C[C@@H](O)c1ccc(N2CC3(CCC3)C[C@@H]2CO)cc1 2095167905 HZMBTPRZOHQJPW-IUODEOHRSA-N 261.365 2.481 10 10 CECE C[C@@H]1CC[C@H](C(=O)NCCOc2ccc(N)cc2)S1 2095333831 GOFPLCKZCILDHP-ZWNOBZJWSA-N 280.393 2.048 10 10 CECE COc1ccc([C@H](C)NCc2ccnnc2)c(O)c1 2095523683 CBLJTYSLBLRSOB-JTQLQIEISA-N 259.309 2.042 10 10 CECE CCC(CC)CNC(=O)NCc1cc(N)ccc1O 2095763426 KWFROUOPFNCTAY-UHFFFAOYSA-N 265.357 2.210 10 10 CECE FC1(F)CN(c2ccc(CNC3CC3)cc2)CCO1 2095973582 PIVYOWIISQNRRC-UHFFFAOYSA-N 268.307 2.368 10 10 CECE CC1(F)CCN(c2ccc3c(c2)NC(=O)[C@@H]3O)CC1 2096017246 VONSBZSWWHZMOP-GFCCVEGCSA-N 264.300 2.001 10 10 CECE CC(C)[C@@H]1CNCCN1c1ccc2c(c1)COCC2 2096493572 QQNIVAHUQZJTMY-INIZCTEOSA-N 260.381 2.194 10 10 CECE COc1cc(N)c(N(C)C[C@H]2CC2(F)F)cc1OC 2097319582 AYJXVBQHQFREMF-MRVPVSSYSA-N 272.295 2.377 10 10 CECE CN1CCc2cc([C@H](N)C[C@@H]3CCCOC3)ccc21 2098491316 IBUQCCYTEMOUCM-SWLSCSKDSA-N 260.381 2.495 10 10 CECE CCn1nnnc1Sc1ncc(CNC(C)(C)C)s1 2099111443 QSNWGZGGCSPDAR-UHFFFAOYSA-N 298.441 2.189 10 10 CECE COc1ccc(CN2CCC[C@H](C)[C@@H]2C(=O)O)c(O)c1 2201052242 XKNDNLPRLWHLFO-IINYFYTJSA-N 279.336 2.086 10 10 CECE CC(C)[C@@H]1C[C@@H]1[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2200548554 ZIMDZQJUEJJOKO-NXNVCVFFSA-N 274.408 2.332 10 10 CECE CCN(C)[C@@H]1CCCN(c2ccc(CN)cc2F)C1 2114843751 KXGAICBRUSCRQT-CYBMUJFWSA-N 265.376 2.205 10 10 CECE COCC[C@]1(CN(C)c2ccc(OC)cc2)CCCN1 2202117683 OTWUUVGKNMOUFE-INIZCTEOSA-N 278.396 2.290 10 10 CECE Cc1ccc(CNCCCNC(=O)C(C)(C)C)c(O)c1 2204634928 UBDFHJWMDFCHJF-UHFFFAOYSA-N 278.396 2.343 10 10 CECE CSc1ncc(CNC(=O)C23CCC(CC2)NC3)s1 2269257135 PDTIMYHKUOPBNK-UHFFFAOYSA-N 297.449 2.013 10 10 CECE Nc1ccc(NC(=O)N2CCCC[C@@H]2CCCO)cc1 2206676484 DUFKNKFPICMTCC-CQSZACIVSA-N 277.368 2.428 10 10 CECE COc1ccc(CNC[C@@]23CCC[C@@]2(CO)C3)c(O)c1 2208165100 PYNPKJIXTGKGBP-HOTGVXAUSA-N 277.364 2.043 10 10 CECE CO[C@]12CC[C@@H]1CN(c1ccc([C@@H](C)N)cc1F)C2 2230468383 LZSWRYFLDZZFBK-HCKVZZMMSA-N 264.344 2.461 10 10 CECE CN[C@H](C)c1ccc(N2CC(C[C@@H](C)CO)C2)cc1 2230516760 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COc1ccc(N2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c(CCN)c1 2227684146 RCUMZRMTLJTJIS-UJDVCPFMSA-N 258.365 2.041 10 10 CECE CN(C[C@H](F)[C@@H]1CCOC1)c1c(F)cc(CO)cc1F 2238342586 IGAZMUNPARXOES-MFKMUULPSA-N 289.297 2.268 10 10 CECE CNCc1ccc(OC)c(COC[C@H]2C[C@@H](OC)C2)c1 2238443105 FPGCKADOFKFDHF-OTVXOJSOSA-N 279.380 2.356 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@@H]2COCCO2)c(C)c1 2240766266 ZNYYUEAZGIARSD-DZGCQCFKSA-N 278.396 2.127 10 10 CECE CNC(=O)C1CCN(c2ccc([C@H](C)O)cc2C)CC1 2240830656 PBGHBSWKQIYKBY-LBPRGKRZSA-N 276.380 2.011 10 10 CECE CN(Cc1ccccc1O)C(=O)Cc1cnsc1 2254335774 ICVGKIBDUFSDTG-UHFFFAOYSA-N 262.334 2.050 10 10 CECE COC1(CSc2ncc(C=O)s2)CCOCC1 2246984013 NEWVOHWSUHUUOA-UHFFFAOYSA-N 273.379 2.243 10 10 CECE CSc1ncc(CNC[C@H](O)c2ccccn2)s1 2257027162 RFJDBPLWGSXDAH-NSHDSACASA-N 281.406 2.083 10 10 CECE COc1cc(OC)c(N2C[C@H](C)[C@@H](O)C2)cc1Cl 2258078152 FDVJPERZNDZUTM-KWQFWETISA-N 271.744 2.174 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CC23CC(C(F)F)(CO2)C3)C1 2266338909 HHPUZYJBVCAQKM-GCVQQVDUSA-N 272.299 2.433 10 10 CECE COc1ccc(N2CCC[C@H]2CCO)c(OC)c1C 2278069828 SCSKIZQMFYMMTF-LBPRGKRZSA-N 265.353 2.363 10 10 CECE OC1(C(F)(F)F)CN(c2ccc(OC(F)F)cc2)C1 2278514343 KONHFCUOJDCVPW-UHFFFAOYSA-N 283.196 2.401 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]3CNC(=O)[C@@H]32)cc1Cl 2279243210 MYZWJBCVHQCXLD-IMSIIYSGSA-N 294.782 2.108 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@H]3CNC(=O)[C@@H]32)c(Cl)c1 2279278992 ZRPZIUWBHCNPAH-DRCTWCGVSA-N 294.782 2.108 10 10 CECE Cc1cc(N2CC[C@@H]2c2ncon2)ccc1[C@H](C)O 2269674215 OTLCVTCGXGPNSV-GXFFZTMASA-N 259.309 2.383 10 10 CECE Cc1cc(N(C)C[C@]23COC[C@H]2C3)ccc1[C@H](C)N 2269651841 PPQJCTVLPGRGTC-WOSRLPQWSA-N 260.381 2.487 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@H](O)CC2)cc1C(C)C 2284573651 LFWPXKVZMKNEJH-HUUCEWRRSA-N 279.380 2.141 10 10 CECE COc1ccc(N2C[C@H]3C[C@H]2CC[C@@H]3O)c(OC)c1C 2295378541 QMFBGCINHIPRIR-BZPMIXESSA-N 277.364 2.362 10 10 CECE COc1cccc(O)c1CNC[C@@H]1C[C@@H]2CC[C@H]1O2 2296633802 FHYBPUSZLFLKMG-COPLHBTASA-N 263.337 2.058 10 10 CECE Cc1cc(N2CCOC[C@H](F)C2)ccc1[C@H](C)O 2315071675 OUPKFZRGORKKEX-NWDGAFQWSA-N 253.317 2.223 10 10 CECE CN[C@@H](CSc1nccs1)c1ncnn1C(C)C 2318093146 WIDKNRMZLTZNRE-VIFPVBQESA-N 283.426 2.368 10 10 CECE CN(C)c1ccc([C@H](CN)N2C[C@H]3C=C[C@@H]2C3)cc1 2329321222 HOFQULAPWATQMU-MAZHCROVSA-N 257.381 2.013 10 10 CECE CN(C)c1ccc(CN[C@@H]2CC[C@@H]3C[C@H]2CO3)cc1 2334122008 CWKFRNHNJYMBMN-NUEKZKHPSA-N 260.381 2.410 10 10 CECE C[C@@H]1C[C@@H](C)C1N(C)CC(=O)Nc1ccc(N)cc1 2339132949 XHFQOFCATLXGMD-GHMZBOCLSA-N 261.369 2.184 10 10 CECE C[C@@]1(CO)C=CCN1c1ccc(CO)c(C2CC2)c1 2339148014 PJTDJZMOTAKWAI-INIZCTEOSA-N 259.349 2.184 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1N(c1cc(Cl)c(CN)cc1F)C2 2339636522 NCQLVXSEYNFDFF-GFWSLJDESA-N 284.762 2.287 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])C[C@H](C)S[C@H](C)C1 2339894237 GYURVSBPBSUDFE-IAZYJMLFSA-N 286.401 2.492 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)CCCCOC 2341118889 ZWIXGACIIHKNFH-LSDHHAIUSA-N 267.369 2.220 10 10 CECE O=C(NC[C@@H]1CC[C@H]1C1CC1)c1ccc(O)c(O)c1 2342366612 ZLEROVWSOUWJLD-RYUDHWBXSA-N 261.321 2.264 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1[C@H]2CCC[C@H]2C[C@@H]1CN 2354708186 VKSHOZKUWSMLLG-OHTBPHCPSA-N 276.380 2.361 10 10 CECE Nc1ccc(OC[C@H](O)Cn2ncc3ccccc32)cc1 51327387 LYCVPWYGVULERI-CQSZACIVSA-N 283.331 2.058 10 10 CECE Nc1ccc(OCC(=O)NCc2cc(F)ccc2F)cc1 111404834 JWNTTYGMBUURDI-UHFFFAOYSA-N 292.285 2.242 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@H]1C[C@@H]2CCC[C@@H]21 2356927795 SMRDMSHUDNUONI-YIVQXAGMSA-N 272.348 2.297 10 10 CECE COc1cc(C)cc(CN2C[C@@H](C)O[C@H](C)C2)c1O 125090571 JEBTUQKNLZUWEG-VXGBXAGGSA-N 265.353 2.318 10 10 CECE CC(C)COC1CCN(C(=O)c2cccc(O)c2O)CC1 187031795 VJMYTIOLHLRGLO-UHFFFAOYSA-N 293.363 2.375 10 10 CECE Oc1ccccc1CN1CCC[C@H]1Cn1ccnc1 185223066 RGWAYYJPYNBPAT-AWEZNQCLSA-N 257.337 2.253 10 10 CECE CCN(C)C(=O)[C@@H](C)NCc1cc(Cl)cc(C)c1O 188045389 IDLDYZRNTCGIPX-SNVBAGLBSA-N 284.787 2.310 10 10 CECE CCC[C@H](O)CN[C@@H](C)c1ccc(F)c(F)c1O 187716963 XAYMJGHWKGLKJY-IUCAKERBSA-N 259.296 2.482 10 10 CECE COc1cccc(CNC[C@@H]2CCCC[C@H]2C(=O)O)c1O 89445521 TXYNGHHZDVBPJZ-WCQYABFASA-N 293.363 2.381 10 10 CECE CCN(Cc1ncnn1C(C)C)c1ccc(CN)cc1 88585881 VEPDBGPNWMYISM-UHFFFAOYSA-N 273.384 2.344 10 10 CECE CCOC(=O)CCN[C@H](CC)c1ccccc1O 45685706 RJGYKSPSVQHYRN-GFCCVEGCSA-N 251.326 2.386 10 10 CECE CCc1cc(CNCc2ccccc2O)n(CC)n1 228413742 PXDKXNQEGAZOIR-UHFFFAOYSA-N 259.353 2.461 10 10 CECE Fc1cc(OC[C@H]2CCOC2)ccc1N1CCCNCC1 87439377 ZJIXSDOSJYKDER-ZDUSSCGKSA-N 294.370 2.041 10 10 CECE CSCCCN1CCN(c2ccc(N)cc2)CC1 228650294 PESXBOBLLAODBS-UHFFFAOYSA-N 265.426 2.144 10 10 CECE Cc1nc(CN(C)Cc2cc(N)ccc2O)cs1 44595056 UKEGEYIVEOXPCZ-UHFFFAOYSA-N 263.366 2.371 10 10 CECE CC[C@]1(C)CN(c2cc(OC)c(OC)c(OC)c2)CCN1 86122430 YXWVTPBHNYHTBL-MRXNPFEDSA-N 294.395 2.291 10 10 CECE C[C@H]1CN(c2ccc(OC(F)F)cc2)CCCN1 86286819 MAIUDRSAHKEIPP-JTQLQIEISA-N 256.296 2.476 10 10 CECE CO[C@@H](C)COc1ccc(N2CCC[C@@H](N)C2)cc1 228593333 BSFMMQXGPKDUCW-QWHCGFSZSA-N 264.369 2.028 10 10 CECE COc1cc(OC)c2c(c1)C(=O)[C@H]1C=C(C)N=C[C@@H]1C2=O 199028160 AVFNYSXEZDEYNP-JQWIXIFHSA-N 285.299 2.303 10 10 CECE CC(C)(C)[C@H]1CCCC[C@@]1(NCCN=[N+]=[N-])C(N)=O 90258174 YBRFDAPXZCLNOH-MFKMUULPSA-N 267.377 2.347 10 10 CECE CCN[C@@]1(C(N)=O)CCC[C@H]1CCSc1nccs1 93629919 DYQRVLJUTWSQKU-GWCFXTLKSA-N 299.465 2.259 10 10 CECE CNCc1ccc(N(C)CC[C@@H](C)O)cc1Cl 234404286 FKFGOEQMKMJQMJ-SNVBAGLBSA-N 256.777 2.267 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)c1c(F)cccc1F 90258847 PSFVZIVXLUEHLZ-JTQLQIEISA-N 270.239 2.381 10 10 CECE COC[C@H]1CN(Cc2cc(C)c(C)cc2O)C[C@@H](C)O1 253294182 CKTBPRCVQOILND-UKRRQHHQSA-N 279.380 2.245 10 10 CECE COc1cc(O)c(CN2CCC23CCOCC3)cc1OC 365815104 KOTWBDAAWCBXHE-UHFFFAOYSA-N 293.363 2.164 10 10 CECE Cc1cc(N(C)Cc2cccc3c2CCNC3)n[nH]1 631893927 FIAHDHYZGLOTFH-UHFFFAOYSA-N 256.353 2.000 10 10 CECE CSc1ncc(CNCC[C@@H]2CCCCN2)s1 2248746552 UZUUHNNLIUTYGU-JTQLQIEISA-N 271.455 2.487 10 10 CECE C[C@H]1[C@H](C)[C@@H](N)CCN1c1ccc(CN(C)C)cc1 709710024 CMNUUNCCKQUVPF-XEZPLFJOSA-N 261.413 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CCC1(CN(C)C(=O)c2cc(O)c(O)c(O)c2)CC1 2132412430 DHWFNPDFXRTISW-UHFFFAOYSA-N 265.309 2.066 10 10 CECE C[C@H](O)C[C@@H](C)NC(=O)C=Cc1ccc(N(C)C)cc1 1911934103 GVTVLFXICNGAKF-OLZOCXBDSA-N 276.380 2.041 10 10 CECE CN1CC[C@@H](CN(C)c2ccc(C=CC(=O)O)cc2)C1 1911938736 DVRAIOFOYFZFIH-CQSZACIVSA-N 274.364 2.172 10 10 CECE CCNCc1cc(F)c(N2CC[C@H](O)[C@H]2C)c(F)c1 1914253667 CEOWPVITPSLCES-RNCFNFMXSA-N 270.323 2.034 10 10 CECE CCC(CC)NC(=O)[C@H](C)N1CCC(N=[N+]=[N-])CC1 1912159631 KKQWILHYAIJXAV-JTQLQIEISA-N 267.377 2.454 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)OCCC(F)(F)F)C1 1912157862 UYMBSPSXWYIEQM-ZCFIWIBFSA-N 252.196 2.460 10 10 CECE COc1cccc(OC)c1C(=O)N(C)CCN=[N+]=[N-] 1912163878 PBNVBYPSJFZRDR-UHFFFAOYSA-N 264.285 2.086 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2nccnc2Cl)C1 1912148751 XCJNOSBECRXZTO-QMMMGPOBSA-N 280.719 2.293 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3c(O)cccc3F)C[C@H]21 2133898110 QYAREBJPPPHQJM-MYQWFSQQSA-N 265.328 2.434 10 10 CECE C[C@@H]1[C@H](O)CCN1c1ccc(CO)c(C(F)(F)F)c1 1914412215 SXSHGMCHPYVOBR-PRHODGIISA-N 275.270 2.157 10 10 CECE Oc1c(F)cccc1CNC[C@@H]1CCC(F)(F)CO1 1967824321 HGTTZOUJIWQIMY-JTQLQIEISA-N 275.270 2.435 10 10 CECE COC[C@@H]1CC[C@@H](NCc2cccc(OC)c2O)C1 1918597095 WYKDWLQTKUUKBJ-DGCLKSJQSA-N 265.353 2.306 10 10 CECE COC[C@@H]1CC[C@H](NCc2cccc(F)c2O)C1 1918663703 PMNWDFPPJWNKJD-PWSUYJOCSA-N 253.317 2.436 10 10 CECE COc1ccc(CNC[C@@H](O)CC(C)(C)C)c(O)c1 227372917 RLHAVKPSWCYTPI-LBPRGKRZSA-N 267.369 2.288 10 10 CECE CN(C)[C@@H]1CCCC[C@H]1CNCc1ccc(O)c(O)c1 1924662040 ZCLYMILZFOTICH-UONOGXRCSA-N 278.396 2.308 10 10 CECE CCCN(C(=O)c1ccnnc1)c1ccc(N)cc1 229152469 UGCDXOQFYHJBEG-UHFFFAOYSA-N 256.309 2.116 10 10 CECE CC(C)[C@@H](C(=O)O)[C@@H](N)c1ccc(N(C)C)cc1 1927706938 SZGSQBWJXLGVMJ-OLZOCXBDSA-N 250.342 2.109 10 10 CECE C[C@@H]1CCCN(C(=O)[C@H]2CNc3ccccc3N2)C1 229876498 QKUNNIGJFOBAQV-BXUZGUMPSA-N 259.353 2.151 10 10 CECE CC1CC(=O)N(c2ccc(N)c3ncccc23)C(=O)C1 122201097 RLVPFZYJKOTHTG-UHFFFAOYSA-N 269.304 2.107 10 10 CECE CN(C[C@H]1CCCCO1)c1ccc(CN)c(F)c1F 234313191 RMYFIFNSIICPCH-LLVKDONJSA-N 270.323 2.429 10 10 CECE CO[C@@H]1CC[C@H]1CC(=O)NCc1cccc(C)c1O 2139752611 ZJLIZMCZDUHYTH-WCQYABFASA-N 263.337 2.132 10 10 CECE CC[C@H](N)CN(CC)c1ccc(OC)c(OC)c1 1968816504 YYTZKLWCELTBCP-NSHDSACASA-N 252.358 2.267 10 10 CECE CCc1c(CNCc2ccc(N(C)C)cc2)cnn1C 1968439291 XKLPTFBNMPQKAV-UHFFFAOYSA-N 272.396 2.338 10 10 CECE CC(C)(C)OC(=O)N1CCN[C@@H](c2ccc(F)cc2O)C1 1952211297 OMYNPRBWAUUJGC-GFCCVEGCSA-N 296.342 2.413 10 10 CECE CN(Cc1ccccc1O)C[C@H]1CC12CCNCC2 1968857891 ULVOKYPZAOEAOR-CQSZACIVSA-N 260.381 2.214 10 10 CECE CC[C@@H](CCCO)NCc1ccc(F)c(F)c1O 1969983346 BMQRRPMXGQPLJJ-JTQLQIEISA-N 259.296 2.311 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@H]2CC[C@@H](C1)N2 252689238 QOXLLHFUZLLXLZ-UHTWSYAYSA-N 264.344 2.419 10 10 CECE COc1cc(CN(C)c2ccc(N)cc2)cc(OC)n1 1971392014 UIPRHKFPHCHIQA-UHFFFAOYSA-N 273.336 2.317 10 10 CECE C[C@H]1CN(c2ccc(CN)cc2C(F)(F)F)CC[C@H]1O 253191473 MTPLDFXTPXVJJV-TVQRCGJNSA-N 288.313 2.371 10 10 CECE COC(=O)[C@H](CC(C)C)NCc1ccc(OC)cc1O 42288329 ZKFOBSUIURZTEF-ZDUSSCGKSA-N 281.352 2.078 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2[C@@H]3CCOC[C@@H]32)cc1O 2150195481 SPKILHDWWJLPSQ-HPEDKQMDSA-N 276.380 2.131 10 10 CECE Cn1ncc(-c2cc(O)c(O)cc2C(F)(F)F)c1N 258390712 DIOPSNLNQNHLCC-UHFFFAOYSA-N 273.214 2.099 10 10 CECE COC(=O)CC[C@H](N)c1c(C)cc(C)c(C)c1O 260196472 IBHRIZCHLYCKTN-NSHDSACASA-N 251.326 2.270 10 10 CECE COC(=O)C1(c2cc(O)c(O)c(F)c2)CCCC1 260130987 HYRSSXCLPRKTBL-UHFFFAOYSA-N 254.257 2.222 10 10 CECE CCOC(=O)CC[C@@H](N)c1ccc(OC)c(C)c1O 260406169 GZWZRQXDCFWCIT-LLVKDONJSA-N 267.325 2.052 10 10 CECE O=C1Nc2cc(N3CCC(CCF)CC3)ccc2[C@H]1O 2144565783 CYOXWEIEHLAHHM-CQSZACIVSA-N 278.327 2.248 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)[C@H](C)C(C)C)ccc21 36194903 JKDLGCZSVABALT-QMTHXVAHSA-N 261.369 2.380 10 10 CECE CN[C@@H](C)c1ccc(N2CCC(N(C)C)CC2)cc1 36192358 PYSZQPVLONIMOL-ZDUSSCGKSA-N 261.413 2.497 10 10 CECE OC[C@H]1CCCN(c2ccc(CNC3CC3)cc2)C1 36227809 VPWWZUQUJYEYHT-AWEZNQCLSA-N 260.381 2.147 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@H](CCOC)C2)cc1 2148073759 PRBNHORAAOMALC-XJKSGUPXSA-N 278.396 2.209 10 10 CECE NC(=O)Nc1cccc(NCc2ccc(O)cc2O)c1 37135882 RIRYLVUCSOFDPQ-UHFFFAOYSA-N 273.292 2.201 10 10 CECE C[C@@H](NC[C@@H]1CCN(C2CC2)C1)c1cc(O)ccc1O 37649250 MLPAXDYPFBHBMN-NEPJUHHUSA-N 276.380 2.233 10 10 CECE CCNCc1ccc(N(CCOC)[C@@H](C)COC)cc1 42609281 CBLWKTZOWFLCGN-AWEZNQCLSA-N 280.412 2.284 10 10 CECE C[C@@H](CC1CC1)N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 2158012331 KFARJNIRSBRKBQ-ZUZCIYMTSA-N 274.364 2.321 10 10 CECE CC1(CO)CC(NCc2ccc(Cl)cc2O)C1 2007016644 DSSUDVMWXIREHC-UHFFFAOYSA-N 255.745 2.296 10 10 CECE C[C@@](CCC(F)F)(NCCCN=[N+]=[N-])C(=O)O 2008557980 KPYQAWMKXRNEED-VIFPVBQESA-N 250.249 2.165 10 10 CECE CCC[C@](C)(CO)NCc1ccc(OC)cc1O 177581634 PAMQRDDSYMGRIQ-CQSZACIVSA-N 253.342 2.042 10 10 CECE CCNCc1ccc(OCC(=O)N[C@H](C)CC)c(C)c1 2155014014 RZIHETFTGHFRJV-CYBMUJFWSA-N 278.396 2.398 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)[C@@H]1CCC[C@@H]2C[C@H]21 2155395312 PEAHGNXZTARUGE-WZZPKWGDSA-N 271.364 2.263 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@H]2CN3CCC2CC3)CC1 2155552655 CAGYCRDZPGKOPP-STQMWFEESA-N 277.372 2.020 10 10 CECE CCCSC[C@H](C)NC(=O)c1cccc(O)c1O 2028118190 ISEGDFZYPGGPHW-VIFPVBQESA-N 269.366 2.359 10 10 CECE CC1(C)OC[C@H](CNCc2ccc(Cl)cc2O)O1 2029641195 KNNNBWYNZWVLOU-NSHDSACASA-N 271.744 2.287 10 10 CECE CC[C@H](CN(C)C)N[C@@H](C)c1cc(O)ccc1O 2029868999 BPNVEHPQRCQQGS-WDEREUQCSA-N 252.358 2.089 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1cnc(C)s1 2031152917 HCMKDNCUOAIIQF-STQMWFEESA-N 264.350 2.151 10 10 CECE C[C@@H]1CCO[C@@H]1CN(C)Cc1cc(F)ccc1O 2034983965 IFTIRLVTVPBAGA-QMTHXVAHSA-N 253.317 2.388 10 10 CECE COc1cc(N)c(N(C)CCC(F)F)cc1OC 2035488833 XHMVUBSIEJGXTP-UHFFFAOYSA-N 260.284 2.377 10 10 CECE NCc1ccc(N2CCO[C@H]3CCC[C@H]32)c(F)c1F 300460732 YHRJBRIMFWSHPM-PWSUYJOCSA-N 268.307 2.181 10 10 CECE CCOCCOCCN1CCC[C@@H](N=[N+]=[N-])CC1 2038001759 FZIRCYCVQXONDK-GFCCVEGCSA-N 256.350 2.204 10 10 CECE C[C@@H]1C[C@H](C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)CO1 2038003366 VXTSXCCFXCIVER-VWYCJHECSA-N 252.318 2.103 10 10 CECE CCC(=O)NCCCN[C@H](C)c1ccc(N(C)C)cc1 2158722233 SUWYZHRCZNTKLX-CYBMUJFWSA-N 277.412 2.320 10 10 CECE CCC(=O)NCCCNCc1c(O)cccc1Cl 2040874276 LNFYRQILELDDMM-UHFFFAOYSA-N 270.760 2.052 10 10 CECE Nc1ccc(OCC(=O)OCCCCCF)cc1 310899525 BIARHWBUPGQWJP-UHFFFAOYSA-N 255.289 2.331 10 10 CECE Oc1ccccc1CNC1=Nc2ccccc2CN1 311581881 CYNCAABCYMDUKW-UHFFFAOYSA-N 253.305 2.273 10 10 CECE CC[C@H](NCc1ccc2c(c1)CCN2C)[C@H](O)CC 313098513 XTTQBUYFRIRNPO-GOEBONIOSA-N 262.397 2.318 10 10 CECE NCc1cc(F)c(N2CCC[C@@H]2c2ncon2)c(F)c1 2160434121 VDYRSOAXOWNJBX-LLVKDONJSA-N 280.278 2.148 10 10 CECE CNCc1ccc(N(C)[C@H]2CCN(C)[C@H](C)C2)c(F)c1 2170392170 YRACJTJCQACEQA-OCCSQVGLSA-N 279.403 2.464 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCN(C)C[C@@H]2C)cc1C 2170382944 SWZSXJQEAKJXJC-WMLDXEAASA-N 275.440 2.491 10 10 CECE Cc1nnc2n1CCN(c1ccc([C@@H](C)N)cc1Cl)C2 2170359439 WSGPZHALXROBJP-SECBINFHSA-N 291.786 2.280 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CC[C@@H](OC)CC1 2160666189 VERXREOMCUGHSL-PHIMTYICSA-N 278.352 2.425 10 10 CECE COc1cccc(O)c1CN1C[C@@H](N(C)C)CC1(C)C 2161734708 KNFBWHZIOPPCGS-LBPRGKRZSA-N 278.396 2.315 10 10 CECE C[C@@H]1O[C@H](C)[C@H](CNCc2cccc(O)c2O)[C@H]1C 701021235 RYSILKANNNVXAW-MEWQQHAOSA-N 265.353 2.247 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2[C@H]3CCC(F)(F)[C@@H]32)cc1 2170819161 LTZACOGMRZSXRV-FPMFFAJLSA-N 280.318 2.361 10 10 CECE CCCN(c1ccc([C@H](C)O)cc1Cl)[C@H]1CCNC1=O 2171240759 ZWRWFWDRDZQDPP-HZMBPMFUSA-N 296.798 2.498 10 10 CECE CCCN(c1ccc(CN)cc1Cl)[C@@H]1CCCNC1=O 2171231234 UVYNNBIDQMAWHL-CQSZACIVSA-N 295.814 2.294 10 10 CECE COc1ccc(CN2CC[C@@H](C(F)F)C2)c(O)c1 707170249 IEQVKUDYTKROAV-SNVBAGLBSA-N 257.280 2.488 10 10 CECE Cc1cc(CO)ccc1N1CCN([C@@H]2CCSC2)CC1 2171553010 KCUFESWZEUJVEE-OAHLLOKOSA-N 292.448 2.115 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@@](C)(CO)C2)cc1O 688055971 WMMQLEGOHPCSPM-IAQYHMDHSA-N 265.353 2.044 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1COC2(CCOCC2)C1 2178970052 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COc1cc(C)c(N2CC[C@H]3[C@H](C2)[C@@H]3CO)c(C)c1 2269600632 PWIGQVAQPKKRRY-SOUVJXGZSA-N 261.365 2.377 10 10 CECE Cc1cc(N2C[C@H](O)CC3(CC3)C2)ccc1[C@@H](C)N 2269661055 CRKTYIYXYNHFKK-TZMCWYRMSA-N 260.381 2.366 10 10 CECE COc1ccc(N2CC[C@@H](CO)[C@H](C)C2)c(OC)c1C 2295357587 NODNMXFDDLSIIU-YPMHNXCESA-N 279.380 2.467 10 10 CECE CC1(C)CC[C@H]1NCc1ccc(N2CCNCC2)cc1 2286065130 GKOIDQVTANLTSX-MRXNPFEDSA-N 273.424 2.374 10 10 CECE COc1ccc(N2CCN(C)C[C@H]2C(C)(C)C)c(N)c1 2289229275 CGZUVOWCLNAYGQ-HNNXBMFYSA-N 277.412 2.444 10 10 CECE COc1cc(OC)c(N2CCCC[C@@H](N)C2)cc1OC 2289361998 HYYDHTOHSNYLCC-LLVKDONJSA-N 280.368 2.030 10 10 CECE CC(C)[C@H](CO)N(C)c1ccc(CO)c(Cl)c1 2302599089 NFGFLBXEYXTLPC-ZDUSSCGKSA-N 257.761 2.285 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)Nc1cccc(O)c1 2307987566 TUCRGTOIEKYIRD-UHFFFAOYSA-N 271.272 2.455 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@@H](F)C2)c(F)c1 2315055557 IWTRXHVGWDYNFG-ONGXEEELSA-N 256.296 2.020 10 10 CECE Cc1ccc(CN(C)[C@@H]2CN[C@@H]2C)c(O)c1Br 2307470242 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CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1C[C@]12C[C@@H](N)C2 2354276843 BCQOLYXYWGIMOP-RLSLPTNOSA-N 274.364 2.039 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H]2[C@H]3CNCC[C@H]32)cc1 2354608840 LQMPDTGLMMLFTC-QZWWFDLISA-N 274.408 2.422 10 10 CECE COc1ccc(O)c(CN[C@H]2C[C@@H]3C[C@H]2C[C@@]3(C)O)c1 2355726957 FPBDPZAGRJWWGE-YLUJIRGKSA-N 277.364 2.040 10 10 CECE CC[C@@H](c1ccccc1O)N1CCN2C(=O)CC[C@@H]2C1 211540733 SKCDKUFTZNOMOU-OCCSQVGLSA-N 274.364 2.150 10 10 CECE C[C@@H]1CN(c2ccc([C@@H](C)N)cc2F)CCCO1 61919088 JDPYFZJSISOKAR-GHMZBOCLSA-N 252.333 2.461 10 10 CECE COC(=O)c1ccc(NC(=O)Cc2ccc(N)cc2)cc1 20185814 XKMPVNAFEHFBBY-UHFFFAOYSA-N 284.315 2.237 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@]34CCOC[C@@H]3C4)ccc21 2357342889 DYCRTGWJABNRCA-USXIJHARSA-N 272.392 2.495 10 10 CECE COC(C)(C)C(=O)NCc1ccc(N2CCCC2)cc1 171593132 CADPFFUFAIFQPY-UHFFFAOYSA-N 276.380 2.328 10 10 CECE C[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)OC(C)(C)C 123287888 HZGUGEGPOQZYOT-SECBINFHSA-N 296.323 2.120 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@@H](O)[C@@H]1C[C@H]1C 2357641306 DEGRKSJDVTVHMO-OFIKQIQMSA-N 274.408 2.346 10 10 CECE CN(CC(=O)Nc1ccccc1F)c1ccc(CN)cc1 34653723 DKLHCBYYRGBHOA-UHFFFAOYSA-N 287.338 2.359 10 10 CECE COc1ccc(O)c(CNc2cc(C(N)=O)ccc2F)c1 37012633 ABFLJLBXJSGYCN-UHFFFAOYSA-N 290.294 2.251 10 10 CECE CO[C@H](C)[C@H](C)NCc1cc(Cl)cc([N+](=O)[O-])c1O 189117491 XWKNZMAAUCKDNJ-JGVFFNPUSA-N 288.731 2.467 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H](CO)C2)c(F)c1 36227316 BMSGQQBPKOTUHJ-MNOVXSKESA-N 252.333 2.054 10 10 CECE Cc1ncc(CNCc2cccc(O)c2O)s1 41117959 LMYMOPBVJKZKRZ-UHFFFAOYSA-N 250.323 2.153 10 10 CECE COc1ccc(CN[C@H]2CCC[C@@H](C(=O)O)C2)c(O)c1 86785991 MZGONLGUTPHUTF-PWSUYJOCSA-N 279.336 2.134 10 10 CECE CO[C@](C)(CNCc1cccc(F)c1O)C1CC1 291008147 DLUDMTVQDSFCLW-CQSZACIVSA-N 253.317 2.436 10 10 CECE Nc1ccc(CCNC(=O)/C=C/c2cccnc2)cc1 238129903 OMFNHYUXHLPBAA-VMPITWQZSA-N 267.332 2.036 10 10 CECE C[C@@H](N)c1ccc(N2CCSC[C@H]2C)cc1O 93671775 SXMFUBSVCZAWND-NXEZZACHSA-N 252.383 2.354 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)C2)cc1Br 233538574 GSIAFUCSRNUGCM-GFCCVEGCSA-N 299.212 2.130 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H]3CCCN3C[C@@H]2C)c1 93437633 VVADUHOSRKGTLZ-ZFWWWQNUSA-N 290.407 2.459 10 10 CECE COCc1nc(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])cs1 2225791611 FXVQDPVHCMJBBW-HTQZYQBOSA-N 281.341 2.251 10 10 CECE CN(C(=O)OC(C)(C)C)[C@H](Cc1ccc(N)cc1)C(=O)O 238304566 MCYUFTCNKOOWDL-GFCCVEGCSA-N 294.351 2.131 10 10 CECE CN(C)C(=O)[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 1231911778 MNQWFFKHBMQGDB-GFCCVEGCSA-N 296.798 2.346 10 10 CECE C[C@@H]1CSCCN(c2cc3c(cc2N)OCCO3)C1 379532421 RYVZPTAYVKIOQK-JTQLQIEISA-N 280.393 2.229 10 10 CECE CCN(Cc1ccc(OC)cc1O)[C@@H]1CCC[C@@H]1CN 89113581 XIFBWNYHVOGBBS-IUODEOHRSA-N 278.396 2.350 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@H]2CCCC[C@H]2O)cc1O 705987895 MXPSONMTAAWYCM-NILFDRSVSA-N 278.396 2.412 10 10 CECE c1cc(N2CCOCC2)ccc1CN[C@H]1CCCOCC1 386879835 YWGXZWFIINQORC-INIZCTEOSA-N 290.407 2.182 10 10 CECE CC[C@@H](NCc1cc(C)ccc1O)[C@@H](O)C(F)F 294989582 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2.292 10 10 CECE CCC[C@@H](O)[C@H](N)c1ccc(Br)c(F)c1O 713727279 CYPPTMAMDITDFY-PSASIEDQSA-N 292.148 2.455 10 10 CECE C[C@H](N[C@@H]1CNCCC1(F)F)c1ccccc1O 817982088 XEPDMPGSFBFCPW-JOYOIKCWSA-N 256.296 2.040 10 10 CECE Cc1cc(Cl)cc(CN2C[C@@H](CO)OC(C)(C)C2)c1O 817412309 IPYGIKLYINFCCQ-ZDUSSCGKSA-N 299.798 2.326 10 10 CECE CCCCNCCNCc1cnc(SC)s1 2243844677 PECRCKYADMOMAF-UHFFFAOYSA-N 259.444 2.344 10 10 CECE CSc1ncc(CN2CC[C@@H](N)C[C@H]2C)s1 2243814201 ZFHKQMGYARSWSL-RKDXNWHRSA-N 257.428 2.177 10 10 CECE Cc1cc(O)c(CNC[C@]2(CCO)CCOC2)cc1Cl 825341564 OFYVMYIHNQZOMV-HNNXBMFYSA-N 299.798 2.233 10 10 CECE CCc1cccc(CN[C@@H]2C[C@@H](O)C23CCC3)c1O 827366498 WJBDMYXQMHPQNI-ZIAGYGMSSA-N 261.365 2.348 10 10 CECE C[C@@H](NC[C@@H]1CCCCN1CCO)c1ccc(F)cc1O 834849347 BBCHMWGWVLHONS-OCCSQVGLSA-N 296.386 2.029 10 10 CECE CCc1cnc(CCNC(=O)c2cc(O)cs2)s1 743738508 JONYIWSEGNNUDH-UHFFFAOYSA-N 282.390 2.445 10 10 CECE CCN([C@H]1CCOC1)[C@@H](C)c1c(O)cccc1O 386433146 OQHIPVUFXMCOGY-QWRGUYRKSA-N 251.326 2.270 10 10 CECE CC(C)(CNCc1c(O)cccc1Cl)[C@@]1(O)CCOC1 842758601 MUIQZAOMSWYQHC-OAHLLOKOSA-N 299.798 2.313 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)CN(C)C3)CCCN1 689404777 GVOHGACBBDJPJP-ZDUSSCGKSA-N 259.397 2.210 10 10 CECE COc1ccc(N2CC[C@H](NCc3ccn(C)c3)C2)cc1 850347045 MOMGKMXOGGOEBA-HNNXBMFYSA-N 285.391 2.402 10 10 CECE CCC[C@@H]1COC[C@@H]1NCc1ccc(O)cc1O 699549945 GKAMMGFNZAXJEY-YPMHNXCESA-N 251.326 2.003 10 10 CECE C[C@@H](NCC[C@@H](C)N(C)C)c1cc(O)ccc1O 697880830 UEEJQHCWESBAGU-GHMZBOCLSA-N 252.358 2.089 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 866072870 VXZJWHQRRQWEFO-TYNCELHUSA-N 291.395 2.118 10 10 CECE C[C@H]1CC[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CN1 863484979 QYBXZOCMPDWUHV-KWQFWETISA-N 299.758 2.184 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 866756987 FRZVSLUNIWCBEL-MBJXGIAVSA-N 287.359 2.049 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)/C=C/c2cnccn2)c1 761984026 VCHPMRXWBIDDPN-GQOHGMTASA-N 299.330 2.081 10 10 CECE CCNCc1cc(F)c(N(CC)C[C@H](C)O)c(F)c1 691348278 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10 CECE CCOc1cccc(CN(C)[C@@H]2CCCN(C)C2)c1O 133805299 ZEZPJTPVGVKABR-CQSZACIVSA-N 278.396 2.317 10 10 CECE CC[C@](C)(NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1885563128 PMFMTGMAPJXWHC-ZDUSSCGKSA-N 299.375 2.449 10 10 CECE COC(=O)CCCN[C@@H](C)c1cc(C)ccc1O 37417176 CZSGIQBYPYMPMQ-NSHDSACASA-N 251.326 2.304 10 10 CECE C[C@H]1CNC(C)(C)CN1c1ccc2c(c1)OCCO2 58457898 NPQBHFIMJJQGMQ-NSHDSACASA-N 262.353 2.035 10 10 CECE C[C@@H]1OCC[C@@H]1CC(=O)N(C)Cc1ccccc1O 1885773310 KLSHFMAGXOEUKG-NWDGAFQWSA-N 263.337 2.166 10 10 CECE CC(C)CCN1CCOc2cc(N3CCNCC3)ccc21 77017186 RNQVAARLCWSSGY-UHFFFAOYSA-N 289.423 2.341 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])[C@H]1CC=CCC1 90259544 FEDPXBHCYIPXPB-QWRGUYRKSA-N 252.318 2.174 10 10 CECE Cn1c(CCOc2ccc(N)cc2)nc2cccnc21 82574290 KNZZCIBPGGWOQY-UHFFFAOYSA-N 268.320 2.172 10 10 CECE C[C@H]1CC[C@@H](CN(C)c2ccc(CN)c(F)c2F)O1 1885285438 UPBZEBVNWQCKNI-ONGXEEELSA-N 270.323 2.427 10 10 CECE CCC[C@@H](C)CNC(=O)[C@H](N)c1cccc(C)c1O 83479279 AGPLBXXNMNCXED-ZWNOBZJWSA-N 264.369 2.253 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3CN(C)C[C@@]3(C)C2)cc1 702253735 ODHOYWZCEPWWKO-NOLJZWGESA-N 260.381 2.128 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C 1887718534 YXEMCVQVWPIPSX-ZJUUUORDSA-N 297.359 2.058 10 10 CECE CCCN(CC)CCNCc1ccc(F)c(F)c1O 703215979 WANODIAQPLLHJB-UHFFFAOYSA-N 272.339 2.492 10 10 CECE C[C@H](NC(=O)c1cccc(NC(N)=O)c1)c1ccccc1O 1171730551 NXNNSUHGJOUKKE-JTQLQIEISA-N 299.330 2.374 10 10 CECE O=C(O)C1(CNCc2cc(Cl)ccc2O)CCOCC1 1326502586 YDMAJBXMRQWXSL-UHFFFAOYSA-N 299.754 2.017 10 10 CECE COc1ccc(CNC[C@@H]2CN3CCC2CC3)cc1C 1963438455 JROMEVUOOJPRPW-MRXNPFEDSA-N 274.408 2.435 10 10 CECE CCN(Cc1cc(F)cc(F)c1O)[C@H](C)CC(=O)O 708216441 SVKDJDOFTHDGTH-MRVPVSSYSA-N 273.279 2.356 10 10 CECE C[C@@H]1CCNC[C@H]1C(=O)N(C)[C@H](C)c1ccccc1O 710674402 HSQOEEVZIFAFJW-YRGRVCCFSA-N 276.380 2.157 10 10 CECE CNCc1cc(F)c(N2CCC[C@H]2CCCO)c(F)c1 62719075 GLYNOEQGLIIMCN-LBPRGKRZSA-N 284.350 2.426 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@@H]1CCC(=O)N1 79929018 FAPRQPICLPUSND-GRYCIOLGSA-N 274.364 2.117 10 10 CECE C[C@H]1CN(c2ccc(CO)c(Cl)c2)C[C@H](C)C1O 688088650 XNNRAZJXAMCRLO-UWVGGRQHSA-N 269.772 2.285 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(F)c2)C[C@H](C)O1 689111465 UHSVWGIETVHWRJ-GWCFXTLKSA-N 252.333 2.288 10 10 CECE CN(C)c1ccc([C@]2(C)CN=C(N)N2CC2CC2)cc1 93393487 YHVKHBPONFGHNI-INIZCTEOSA-N 272.396 2.008 10 10 CECE C[C@@H]1C[C@H](CO)CCN1c1c(F)cc(CO)cc1F 2115832017 LEQQULFFINBHML-NXEZZACHSA-N 271.307 2.054 10 10 CECE COC(=O)c1ccc(CC(=O)NCc2ccccc2O)cc1 1465990870 VKBVZBFCNKFOAC-UHFFFAOYSA-N 299.326 2.038 10 10 CECE CC1(C)CO[C@H](CC(=O)NCC2(CN=[N+]=[N-])CC2)C1 2117726510 AVFWDAGYGWOTKW-SNVBAGLBSA-N 266.345 2.398 10 10 CECE C[C@H](NC[C@H]1[C@H]2OCCC[C@H]12)c1c(O)cccc1O 2119923363 HDRIOFJWIOXLRT-SQYUCLKFSA-N 263.337 2.173 10 10 CECE Cc1cnc(SCC(=O)c2ccc(O)c(O)c2)n1C 2120383580 RDGSHAULTPNNHO-UHFFFAOYSA-N 278.333 2.115 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1cc(C)ncn1 2120876736 HEAPWMDWBFIORE-OAHLLOKOSA-N 256.353 2.160 10 10 CECE CC(C)c1nnc(C(=O)NCc2cc(O)ccc2O)s1 1558175656 ZPIXKTWJIPSZPL-UHFFFAOYSA-N 293.348 2.003 10 10 CECE CC1(C)CN(C(=O)Cc2ccc(O)c(O)c2)CC(C)(C)O1 1625332198 RWFMCZPUYKCBQX-UHFFFAOYSA-N 293.363 2.056 10 10 CECE CCC[C@](C)(CO)NC(=O)c1ccc(N=NC(N)=O)cc1 1631715008 FHVPGZPAGLDBOG-CQSZACIVSA-N 292.339 2.130 10 10 CECE CN(Cc1ccc(F)c(F)c1O)C[C@H]1OCC[C@@H]1F 2122538072 NLSLZWSYYTXWMR-GXSJLCMTSA-N 275.270 2.229 10 10 CECE CCNc1cccnc1C(=O)NCc1ccccc1O 1631540590 XQNFYSDDRCLXFX-UHFFFAOYSA-N 271.320 2.149 10 10 CECE CN(C)C1(C(=O)NCc2c(O)cccc2F)CCCC1 1635366633 FPIVBFZAKNTMKV-UHFFFAOYSA-N 280.343 2.022 10 10 CECE CCN(Cc1cc(OC)ccc1O)[C@H]1CCC[C@H]1CN 249712020 OFOMYEDUZQPUHH-WFASDCNBSA-N 278.396 2.350 10 10 CECE COc1ccc(CN[C@@H](C)CNC(=O)C(C)C)cc1C 1690553185 RCIBAQKMCJGRRC-ZDUSSCGKSA-N 278.396 2.254 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])c1nc(C)cs1 162666219 VIVXSZZVFFFFCL-SECBINFHSA-N 283.357 2.346 10 10 CECE COCCNCc1ccc(N2CCC(C)(O)CC2)cc1C 160568373 GRPCVAYDVKHEIW-UHFFFAOYSA-N 292.423 2.082 10 10 CECE CC(C)CNCc1ccc(N(C)C2(CO)CC2)cc1 2128184184 NNZVRWLAGNOIOE-UHFFFAOYSA-N 262.397 2.393 10 10 CECE C[C@H]1C[C@@H](C)CN(c2cc3c(cc2N)OCC(=O)N3)[C@H]1C 166201663 OKQJDFAXROYFTK-VWYCJHECSA-N 289.379 2.471 10 10 CECE CCCCC[C@@H]1C[C@](C)(C2=N[C@@H](N)[SH]=C2)OC1=O 252619612 LRAAPSPLINXXNS-OASPWFOLSA-N 270.398 1.853 10 10 CECE COCCN=NNc1cc(OC)c(OC)c(OC)c1 1860494023 MXOAJDYBBBZDTM-UHFFFAOYSA-N 269.301 2.138 10 10 CECE COc1ccc(N(C)C[C@H]2CCCCN2)cc1F 258856988 ILMDKBLZMGSWDK-LLVKDONJSA-N 252.333 2.413 10 10 CECE C[C@H](O)[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128274105 ZRYQEUMWZKCGCN-GHJWDPDVSA-N 261.365 2.263 10 10 CECE O[C@@H]1CCc2cc(N3CCC[C@@H]4COC[C@@H]43)ccc21 2128324074 ZMSIWRVOUJZWRO-UHOFOFEASA-N 259.349 2.281 10 10 CECE CN(C[C@@H]1OCC[C@@H]1F)c1ccc2c(c1)CC[C@@H]2O 2128318065 JEZCJUAZDAZOCU-KKUMJFAQSA-N 265.328 2.229 10 10 CECE CO[C@@H]1CC[C@@H](N2CCCc3cc(CN)ccc32)C1 2130623804 RDODNAIURYQPOF-HUUCEWRRSA-N 260.381 2.465 10 10 CECE COc1ccc(N(C)C[C@H]2CCCCN2C)c(N)c1 2129627802 USTQDMDAYBHGRO-GFCCVEGCSA-N 263.385 2.198 10 10 CECE CC(C)N(C)CCCOc1cc(N(C)C)ccc1N 2129774179 QKBIBNSXDOLTCL-UHFFFAOYSA-N 265.401 2.444 10 10 CECE C[C@@H]1C[C@H](C(=O)N[C@H](C)c2ccccc2O)[C@@H](C)O1 827957693 XOXZRQJIBFEUGV-UZWSLXQKSA-N 263.337 2.383 10 10 CECE CC1(C)C[C@H](CN)CN1Cc1cc(F)cc(F)c1O 2132469890 YFAZMBGUMIOIMP-SECBINFHSA-N 270.323 2.230 10 10 CECE COC[C@H]1C[C@@H]1CN(C)c1c(F)cc(CN)cc1F 2133436567 IAXPTVCRZUKVCE-GHMZBOCLSA-N 270.323 2.142 10 10 CECE CC[C@@H](CCOC)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912189109 UKDOUWTUBNIWBW-WDEREUQCSA-N 254.334 2.350 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cc([N+](=O)[O-])cn1C1CC1 1912160588 YFMGTCIBRICPIC-UHFFFAOYSA-N 278.272 2.114 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)Nc1cc(F)ccc1F 1912200169 CVNDBVAKMGOGDY-UHFFFAOYSA-N 269.255 2.145 10 10 CECE C[C@]1(CCO)CCN1c1ccc2c(c1)CCC[C@H]2N 2140578854 LQOKYXCUXAENJW-HZPDHXFCSA-N 260.381 2.374 10 10 CECE CO[C@H]1CCN(c2c(F)cc(CO)cc2F)C1(C)C 1914252783 ZVVKXODRDBQKOO-LBPRGKRZSA-N 271.307 2.461 10 10 CECE Oc1ccc(CN[C@H]2CCOC[C@@H]2C(F)(F)F)c(O)c1 1916568243 IEHDEWVYRYXPTB-QWRGUYRKSA-N 291.269 2.155 10 10 CECE CCCOc1cc(N2CCCN(C)CC2)ccc1N 111046261 WVSKKPJNUXSWGO-UHFFFAOYSA-N 263.385 2.200 10 10 CECE COc1cc(N)c(N(C)C[C@]2(F)C[C@H]2C)cc1OC 2141409711 NMEWNZUXDIOTTJ-YMTOWFKASA-N 268.332 2.470 10 10 CECE COC[C@@]1(CNCc2ccc(OC)c(C)c2)CCCO1 1965996645 QNBLBKYFDSQUJN-INIZCTEOSA-N 279.380 2.289 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCN2CCC[C@H]2C1 251498050 FEBSLHSKMMAGGW-AAEUAGOBSA-N 264.344 2.372 10 10 CECE C[C@@]1(C(=O)O)CCCN(Cc2ccc(F)cc2O)C1 1968128246 JGLCJZPGJRWRBY-CQSZACIVSA-N 267.300 2.218 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@@H](C)S[C@H](C)C3)ccc21 251547662 BWRGLOULUKGJEM-RULNRJAQSA-N 291.420 2.229 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@]12CC[C@H]1CNC2 2136067163 PJWOYVTUEVKNDU-DVOMOZLQSA-N 260.381 2.385 10 10 CECE Nc1ccc(CNC[C@@H]2CCC3(CCC3)[C@@H]2O)cc1 1924749972 NZXWBQWJBYOQRL-DZGCQCFKSA-N 260.381 2.300 10 10 CECE CC(C)[C@](C)(CC(=O)NCc1ccccc1O)C(=O)O 228402458 PWBVTHDBALRNGL-HNNXBMFYSA-N 279.336 2.145 10 10 CECE CC1(F)CN(c2ccc(CN)c(Br)c2)C1 1930299019 ICHJFHPPIAYAHA-UHFFFAOYSA-N 273.149 2.456 10 10 CECE Cc1cccc(CN[C@@H]2CN[C@@H]3CCCC[C@H]23)c1O 2139760777 UQMJIVUDMBBWDB-RRFJBIMHSA-N 260.381 2.321 10 10 CECE CCC[C@@H](COC)C(=O)NCc1cccc(C)c1O 2139759843 ZUWIZICCSDZEIA-ZDUSSCGKSA-N 265.353 2.380 10 10 CECE COc1cc(N(CC(C)C)C2COC2)ccc1CN 2139700150 GHANLPIYJYTSTH-UHFFFAOYSA-N 264.369 2.015 10 10 CECE Cc1cccc(CNC[C@@H]2CC[C@@H](C(=O)O)C2)c1O 2139756892 AWDFLOYZYUTGOL-VXGBXAGGSA-N 263.337 2.291 10 10 CECE CN1CC(CCNCc2ccc(Br)cc2O)C1 1941444066 WXQHEZUXDALSCP-UHFFFAOYSA-N 299.212 2.196 10 10 CECE C[C@]12C[C@](C(=O)N3CCC[C@H](N=[N+]=[N-])CC3)(CO1)C2 2137873040 CZQAZEFQELXQHE-DRZSPHRISA-N 264.329 2.247 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@@H]1CCCCN1 235141045 RZAWSOHTPSFTML-NEPJUHHUSA-N 264.369 2.233 10 10 CECE CCN1CC[C@@H](NCc2ccc(Cl)cc2O)C1 1942494419 NRGCYAULYDHOKH-GFCCVEGCSA-N 254.761 2.229 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)C1CCC(N)CC1 235495716 VFJWGNSMUOUBGH-UNXYVOJBSA-N 264.369 2.361 10 10 CECE C[C@H](c1cc(O)ccc1O)N1C[C@H]2[C@@H](N)CCC[C@H]2C1 130507794 MDKGBYXJEBNZRN-BVIHXZOGSA-N 276.380 2.218 10 10 CECE CC(C)(C)OC(=O)[C@@H](N)c1cc(F)cc(F)c1O 1951519407 XUMIXOBYVFZOJV-VIFPVBQESA-N 259.252 2.012 10 10 CECE Oc1cc(C(F)(F)F)ccc1[C@@H]1NCCC[C@@H]1O 1952609492 WBEKZUQZGKEKHK-ONGXEEELSA-N 261.243 2.196 10 10 CECE Oc1c(F)cccc1CN[C@@H]1C[C@@H]2CCCCN2C1 1969663713 WRLJVCGOMMATKX-OLZOCXBDSA-N 264.344 2.248 10 10 CECE CCNCc1ccc(N2CC[C@H]([C@H](C)O)C2)c(C)c1 252783048 WJOKPCRHIMOSEI-ZFWWWQNUSA-N 262.397 2.312 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2OCCO[C@@H]2C)c(F)c1 2143686672 MEEAAHVKYUCICI-RWSFTLGLSA-N 282.359 2.086 10 10 CECE CC(C)c1nccn1CCNCc1ccc(O)c(O)c1 2144053690 HEMLYDCJWTUOQA-UHFFFAOYSA-N 275.352 2.208 10 10 CECE COc1ccc(N2C[C@@H](C)[C@@H](CN)C2)cc1Cl 2003534133 INCLZPDYFCRWCE-ZJUUUORDSA-N 254.761 2.380 10 10 CECE C[C@H](O)c1ccc(N2CCC23COC3)c(Br)c1 2004447045 DAYABVZQRFMOCG-VIFPVBQESA-N 298.180 2.482 10 10 CECE COCc1ccc([C@H](O)[C@H](N)c2ccccc2O)cc1 2148158074 XXXWGUXYSODDLE-CVEARBPZSA-N 273.332 2.272 10 10 CECE CCOC(=O)Cc1ccc(C(F)(F)F)c(O)c1O 260344683 LMWTVSPWUZJRLQ-UHFFFAOYSA-N 264.199 2.222 10 10 CECE Cc1cc(CN(C)CCCOc2ccc(N)cc2)no1 36198515 ICFBTBXIRISVBO-UHFFFAOYSA-N 275.352 2.466 10 10 CECE COC(=O)[C@@H](CC(C)C)NCc1ccc(N(C)C)cc1 36980251 IUAHIYBASKQEGL-OAHLLOKOSA-N 278.396 2.430 10 10 CECE CCCOC1CN(c2ccc(CO)cc2Cl)C1 1996711340 BHBBTGNKCNNRLV-UHFFFAOYSA-N 255.745 2.448 10 10 CECE CCCN[C@@H](c1cc(OC)n(C)n1)c1ccccc1O 2146242461 UPJLHUSOBQSWNY-OAHLLOKOSA-N 275.352 2.223 10 10 CECE CCCOCCCO[C@H](C)C(=O)Nc1ccc(N)cc1 2149068716 YXFQPRYVKYVWCW-GFCCVEGCSA-N 280.368 2.429 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@@H](O)C2)c(Br)c1 2000823415 JDISCURJOMJSJN-MWLCHTKSSA-N 298.180 2.240 10 10 CECE C[C@@H](CC(N)=O)N(C)c1ccc(CNC(C)(C)C)cc1 2151337962 GRGYMWONKNKHBL-LBPRGKRZSA-N 277.412 2.275 10 10 CECE Nc1ccc(OCCC(=O)OCc2ccncc2)cc1 41100727 PBKSHTFVBSXKRS-UHFFFAOYSA-N 272.304 2.176 10 10 CECE 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2.398 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)CC2CCC2)cc1 61455252 JHOOIPQSWMUSAP-MRXNPFEDSA-N 261.413 2.484 10 10 CECE C[C@H]1C[C@H](N(C)c2ccc(CN)cc2Cl)CO1 401365123 DKQNJPSENHYZGT-ONGXEEELSA-N 254.761 2.412 10 10 CECE CCN(c1ccc([C@@H](C)N)c(O)c1)[C@H]1CCCOC1 402651366 JSXBFWYFQIWQFR-YPMHNXCESA-N 264.369 2.417 10 10 CECE Nc1ccc(NC(=O)CCN2CCC=C(Cl)C2)cc1 404460080 SOKBVXFNLYEYJQ-UHFFFAOYSA-N 279.771 2.426 10 10 CECE C[C@H](O)C[C@@H]1CCCN1c1c(F)cc(CN)cc1F 311489594 MUMXYTWAYVALLG-ONGXEEELSA-N 270.323 2.163 10 10 CECE COC(=O)C(C)(C)CN[C@@H]1CCc2cccc(O)c21 311844604 IBOMJNIQBJZWFF-LLVKDONJSA-N 263.337 2.168 10 10 CECE Cc1nc(-c2noc(CCc3ccc(N)cc3)n2)co1 312324312 CLCSNWRIHAYSHE-UHFFFAOYSA-N 270.292 2.400 10 10 CECE Cc1ncccc1COC(=O)COc1ccc(N)cc1 312579512 NMYDDGIODJWEQT-UHFFFAOYSA-N 272.304 2.094 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1CCCOC12CCC2 2158562578 XFINBYJMNXXBAV-LBPRGKRZSA-N 276.336 2.481 10 10 CECE CN[C@H](c1cc(C(F)(F)F)n(C)n1)c1ccccc1O 2158703745 YVNJIAPYVKTKHI-LBPRGKRZSA-N 285.269 2.453 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CCCc1nc(CNCc2cccc(O)c2O)co1 2104287743 USSNMMWYXFYXCN-UHFFFAOYSA-N 262.309 2.328 10 10 CECE CN(Cc1cc(N)ccc1O)[C@H]1CC[C@]12CCCO2 2104362854 YJEPLLYQNAIQIL-LSDHHAIUSA-N 262.353 2.118 10 10 CECE CCc1cnc(CNCc2c(O)cccc2OC)o1 2104439010 PHZRIRBAKDISOJ-UHFFFAOYSA-N 262.309 2.241 10 10 CECE C[C@@H](O)c1ccc(N2CCC23CC(CO)C3)c(F)c1 2104555132 HXBPCHOTICAQOM-RWWNRMGGSA-N 265.328 2.230 10 10 CECE CC1(C)C[C@H](N)CN(c2ccc3c(c2)COCC3)C1 2106389659 SQGLOVHLYIHRGC-AWEZNQCLSA-N 260.381 2.323 10 10 CECE COc1ccc(N2CC[C@H](C)C[C@H]2CN)cc1OC 2106332022 PVXFCCXTIDCWMB-AAEUAGOBSA-N 264.369 2.267 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@@H]1CCCN1C 2106790564 JHLJSSJDTZDZSK-JKSUJKDBSA-N 261.413 2.497 10 10 CECE CN(C)c1ccc([C@@H](O)C2CC3(CCNC3)C2)cc1 2106790035 DSJFRJNUOLTEBC-OGVSOVDVSA-N 260.381 2.176 10 10 CECE CN1CCc2cc([C@@H](N)[C@H](O)CC(C)(C)C)ccc21 2106847876 AKUKUQBLCHEDDI-HUUCEWRRSA-N 262.397 2.476 10 10 CECE Cc1nc([C@H](N)c2ccc3c(c2)CCCN3C)co1 2106834568 VTWYKEYFENBDOW-OAHLLOKOSA-N 257.337 2.414 10 10 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277.364 2.444 10 10 CECE COc1ccc(N(C)CCCO)c(CNC(C)(C)C)c1 2235968350 QQONGEXAJHNJNJ-UHFFFAOYSA-N 280.412 2.402 10 10 CECE COc1ccc(N2CCCC(C)(C)[C@H]2CO)c(C=O)c1 2235992265 LOCWQHISVHHVFF-OAHLLOKOSA-N 277.364 2.495 10 10 CECE CCCNCc1cc(OC)ccc1N(CC)C1COC1 2235964543 TVDIQVFKVPGTIE-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(N(C)CCOC2CC2)c(C[C@H](C)N)c1 2235965594 GQPSCNPIMNBLFB-LBPRGKRZSA-N 278.396 2.200 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@@]3(CO)C2)c(C=O)c1 2235979247 NJSMFOKYKCSSBD-BBRMVZONSA-N 275.348 2.107 10 10 CECE CCO[C@H]1CCCN(c2ccc(OC)cc2C(=O)O)C1 2235947858 LBSADJCJJWPFMX-LBPRGKRZSA-N 279.336 2.399 10 10 CECE COc1ccc(N2CC[C@@H](CCO)[C@H](C)C2)c(C=O)c1 2235981063 ZZBLSRFUDHGJBM-OLZOCXBDSA-N 277.364 2.353 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@H]2C[C@H]3CC[C@H]2O3)cc1O 2236352661 JMBVPCXLYRPMRO-NYDIPFLSSA-N 276.380 2.429 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4C(CO)[C@H]4C3)cc21 2226670533 DWIHFGQNQYELKM-RYUDHWBXSA-N 259.349 2.031 10 10 CECE CCOc1ccc(N2CCC(O)(COC)CC2)cc1 2226753356 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10 10 CECE Oc1ccc(OC(F)(F)F)cc1CNC[C@@H]1CCO1 2335919174 OZUPMSMRPICTBV-JTQLQIEISA-N 277.242 2.169 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1n[nH]c2c1CCCC2 2337775590 BZMIDFWOYSRELD-UHFFFAOYSA-N 262.317 2.061 10 10 CECE COc1ccc(N2C[C@H]3CC(O)C[C@@H](C3)C2)cc1F 2338916480 UTJIPSXFRCURME-GHMZBOCLSA-N 265.328 2.432 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2CCCc1ccc(N)cc1 2340774144 HFLLKMFTIMPBGD-CWRNSKLLSA-N 260.381 2.311 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC[C@@H]2CN(C)C)c1C 2340857093 UQWYAGYJMVIBTO-ZIAGYGMSSA-N 262.397 2.497 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]2C[C@H]3N(C)C)ccc1CO 2340992727 QWECBTJZRAFMIZ-CWRNSKLLSA-N 260.381 2.016 10 10 CECE COc1cc(Cl)c(N2CC3(CC(O)C3)C2)c(OC)c1 2342435964 FWNCBVYEZBPKFC-UHFFFAOYSA-N 283.755 2.318 10 10 CECE Oc1c(CNC[C@]2(O)CCCSC2)ccc(F)c1F 2343689682 CAMMWGASUSCGLR-CYBMUJFWSA-N 289.347 2.018 10 10 CECE CNCc1ccc(N2C[C@H]3CC[C@H]2[C@H](O)C3)cc1C 2349957453 PTZUBLNHONKDMS-VBNZEHGJSA-N 260.381 2.064 10 10 CECE CSc1cc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)ccc1CN 2353848371 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CN1CCCc2cc([C@@H]3[C@H](CN)CCN3C)ccc21 70277513 OPLLPRPHICOKAQ-GOEBONIOSA-N 259.397 2.021 10 10 CECE CCN1CC[C@H]1CNCc1ccc2c(c1)CCCO2 922336030 YOOMJJNGTHYKFT-HNNXBMFYSA-N 260.381 2.195 10 10 CECE C[C@H]1CCCCN(C(=O)c2cc(O)c(O)c(O)c2)C1 1148582862 OBMIAGCBLLPPAT-VIFPVBQESA-N 265.309 2.066 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@@H](N(C)C)C1 217866407 QEOVOCWGNDKNKV-CMPLNLGQSA-N 252.333 2.228 10 10 CECE COCCCCN[C@H](C)c1ccc(OC)cc1O 44656677 MBOGJYDXQYARPC-LLVKDONJSA-N 253.342 2.478 10 10 CECE CCOC1CCN([C@H](CN)c2ccc(N(C)C)cc2)CC1 40678625 KSUAFHJZWJZMEL-QGZVFWFLSA-N 291.439 2.253 10 10 CECE CC[C@@H](N[C@H](C)C(=O)NC1CC1)c1ccccc1O 135733200 KXSJMBWUAIWYTL-ZWNOBZJWSA-N 262.353 2.100 10 10 CECE COc1ccc(CN(C)CC[C@@H](N)C(C)C)c(O)c1 133425909 WTCVIMZNGOXSMA-CQSZACIVSA-N 266.385 2.206 10 10 CECE C[C@@H]1CN(Cc2ccc3c(c2)CCCN3C)C[C@@H]1C(=O)O 86774502 VNHCGYARLYVERD-DOMZBBRYSA-N 288.391 2.222 10 10 CECE N[C@@H](C(=O)O)c1cc(Cl)c(F)c(Br)c1O 220865116 FBDFRZOXGFKMAY-ZCFIWIBFSA-N 298.495 2.032 10 10 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C[C@@H]1CSCCN1[C@@H](CN)c1ccc(N(C)C)cc1 70219530 XLEVYNZUKWFHCR-DOMZBBRYSA-N 279.453 2.190 10 10 CECE C[C@H]1CC[C@@H](N(C)C(=O)CCc2ccc(N)cc2)CO1 402339282 VWJYOAKDVLHWOR-SWLSCSKDSA-N 276.380 2.227 10 10 CECE CCN[C@]1(C(N)=O)CCC[C@H](CSc2nccs2)C1 404017687 DOZPEIKMWAKUQH-GXFFZTMASA-N 299.465 2.259 10 10 CECE COC[C@@H](C)Cc1noc(CCc2ccc(N)cc2)n1 404151872 MOHNZCLNGFZURS-NSHDSACASA-N 275.352 2.262 10 10 CECE OC[C@@H]1CCC[C@H](NCc2cc(F)ccc2O)C1 310711648 CTSJFYXOSZBHFK-MFKMUULPSA-N 253.317 2.172 10 10 CECE Nc1ccc(NC(=O)CN2CC3CCC2CC3)cc1 311893864 BDFBPJVULAJWGV-UHFFFAOYSA-N 259.353 2.082 10 10 CECE Cc1cnn(CCN(c2ccc(CN)cc2)C2CC2)c1 312417049 XXDJFQKIHODHML-UHFFFAOYSA-N 270.380 2.319 10 10 CECE CCCSC[C@@H](N)C(=O)N(C)[C@@H](C)c1ccccc1O 2157830891 CYHZBUUWFIIQCJ-WCQYABFASA-N 296.436 2.382 10 10 CECE CN(Cc1ccccc1O)C(=O)c1cccc(N)c1F 313168489 UHGGOOMQBZPIPR-UHFFFAOYSA-N 274.295 2.386 10 10 CECE CCCOC[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1 2158950474 QXBXNFANNYMAQY-HNNXBMFYSA-N 276.380 2.229 10 10 CECE 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2.412 10 10 CECE C[C@@H]1CCC[C@@H]1N(C)C[C@@H](O)COc1ccc(N)cc1 709145251 BGIFASPYLBJQHX-XPKDYRNWSA-N 278.396 2.129 10 10 CECE COc1ccc([C@H](C)NC[C@]23COC[C@H]2C3)c(O)c1 689213150 ISIRYCGVWADCKX-FIXISWKDSA-N 263.337 2.088 10 10 CECE Nc1ccc(CCC(=O)N2CCC[C@H](F)C2)cc1 689375532 IHAKLSALXYOLJS-LBPRGKRZSA-N 250.317 2.162 10 10 CECE COC1(OC)CC[C@H]1N[C@@H](C)c1cc(F)ccc1O 711406468 UGTLSTXGRAYKBR-TVQRCGJNSA-N 269.316 2.333 10 10 CECE CCNCc1ccc(N2CCN(C3CCC3)CC2)cc1 381152142 SXNVTRHEYVETMW-UHFFFAOYSA-N 273.424 2.471 10 10 CECE CCC[C@H]1COC[C@@H]1NCc1ccc(O)c(O)c1 699558883 UXPVXTSVBCQPRZ-RYUDHWBXSA-N 251.326 2.003 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@](C)(CO)C2)c(F)c1 381827772 XALOJWXMMMCYJA-XHDPSFHLSA-N 266.360 2.315 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CCCC4(CC4)C3)cc21 695073726 LBHQNFUTQLKVLC-AWEZNQCLSA-N 271.364 2.043 10 10 CECE O=C(NCC1C2(CC2)C12CC2)c1cccc(O)c1O 716580999 OJPOZKGLQWFBIQ-UHFFFAOYSA-N 259.305 2.018 10 10 CECE Cc1cc(C=O)c(C)n1-c1ccc(-n2cncn2)cc1 2175619010 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CC(C)NCc1ccc(N(C)CC[S@](C)=O)c(F)c1 398879874 HBZAPIKTAVTCDA-IBGZPJMESA-N 286.416 2.138 10 10 CECE CN(C)c1ccc([C@]2(O)C[C@H](N)c3ccccc32)cc1 2163066147 JBMSGSMCTIRLDK-DLBZAZTESA-N 268.360 2.392 10 10 CECE CC(C)Cn1cc([C@H](N)c2ccc(N(C)C)cc2)nn1 2163140477 JMIMUQVWWCZVKQ-OAHLLOKOSA-N 273.384 2.048 10 10 CECE CCN1CCc2cc([C@H](N)[C@@](C)(O)C3(F)CC3)ccc21 2163131932 WJXHSQTULDWFCD-LSDHHAIUSA-N 278.371 2.322 10 10 CECE COc1cc(N2Cc3ccccc3[C@@H](CN)C2)ccn1 2176217134 WEFQKIDLMVVRGC-ZDUSSCGKSA-N 269.348 2.153 10 10 CECE CCO[C@@H]1C=CCN(C(=O)CCc2ccc(N)cc2)C1 2165066288 ZMFKDXDQLIQNFK-OAHLLOKOSA-N 274.364 2.005 10 10 CECE CCN(CC)c1ccc([C@@H](O)c2cnn(CC)n2)cc1 2172445789 GUPXDOZWNJORJA-OAHLLOKOSA-N 274.368 2.226 10 10 CECE CCNCc1cc(F)c(N2CC[C@H]3[C@@H]2C[C@H]3O)c(F)c1 2178173418 PWAVCIDSLKWASM-LEWSCRJBSA-N 282.334 2.034 10 10 CECE COc1cnn([C@@H](C)c2ccc(F)cc2O)c1O 2070203511 PJCUXSHRNMQZEP-ZETCQYMHSA-N 252.245 2.051 10 10 CECE COc1ccc(Cn2ncc(C3CC3)c2O)c(O)c1 2070288778 ZVZBKKJHJHSPAB-UHFFFAOYSA-N 260.293 2.229 10 10 CECE CCCn1ccc([C@@H](N)c2ccc3c(c2)CCN3C)n1 2173483364 RKQFDXGVMARVRR-INIZCTEOSA-N 270.380 2.334 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@H]4CC=C[C@H]3C4)ccc21 2177146081 HKIQVBFUGWGDHC-PGUXBMHVSA-N 269.348 2.054 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CCCC[C@H]2C(N)=O)c1 2174107272 NBCWUBWAMSVYAP-SCRDCRAPSA-N 276.380 2.395 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1cc(C)ncn1 2177378112 JHFZUUMJWWFCIH-MRXNPFEDSA-N 268.364 2.086 10 10 CECE CCCn1ncnc1CN(C)c1ccc([C@@H](C)O)cc1 2168065851 PFTLWKUSHKZPIW-GFCCVEGCSA-N 274.368 2.378 10 10 CECE CCCNCc1ccc(N2CCN(C)[C@H]3CC[C@H]32)cc1 2168356862 ZTCJYEJWGRJYSC-DLBZAZTESA-N 273.424 2.469 10 10 CECE C[C@H](O)c1ccc(N2CC([N+](=O)[O-])C2)cc1C(F)(F)F 2191525432 LAUNMLLIXWTPJD-ZETCQYMHSA-N 290.241 2.224 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H](C)[C@@](C)(CO)C2)c(F)c1 2194696156 AWYRNTMSEKJKPU-AMJWSMQMSA-N 284.350 2.439 10 10 CECE CN[C@H](C)c1cc(F)c(N2CCC(CO)CC2)c(F)c1 2194716505 ZDFPRYVLZYJPGQ-SNVBAGLBSA-N 284.350 2.454 10 10 CECE 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10 CECE O[C@@H](C[C@@H]1C=CCC1)c1ccc(N2CCNCC2)cc1 2286066415 SVTHTHIDUXLZMI-PBHICJAKSA-N 272.392 2.486 10 10 CECE OC[C@@]12CCO[C@H]1CN(c1ccc3c(c1)CCCC3)C2 2296356468 RYXCCNUMZAELCV-IRXDYDNUSA-N 273.376 2.153 10 10 CECE COc1cc(N2CCc3ncsc3CC2)ccc1CN 2287059422 OIOUKGJEXSQHHH-UHFFFAOYSA-N 289.404 2.216 10 10 CECE CCCN(C[C@H](C)O)c1cc(OC)c(OC)cc1OC 2289449602 ZSASEDNOQXOAOA-NSHDSACASA-N 283.368 2.310 10 10 CECE COc1ccc(N2CCOC[C@H](O)C2)c2ccccc12 1145073732 KRPDFDGNWCQSPO-GFCCVEGCSA-N 273.332 2.046 10 10 CECE NCc1cc(F)c(N2C[C@@H]3C[C@H]2[C@H]2C[C@H]23)c(F)c1 2308723490 YVVGVBRYLKXDLV-YVNDNENWSA-N 250.292 2.268 10 10 CECE OCc1ccc(N2CCC3CC2(CO)C3)c(Cl)c1 2314896923 JULZHEHCKYNYTQ-UHFFFAOYSA-N 267.756 2.184 10 10 CECE Oc1cc2c(cc1O)CN(C[C@H]1C[C@@H]1CF)CC2 2318676135 ZKHDHRMSTFRVFD-GHMZBOCLSA-N 251.301 2.062 10 10 CECE COc1ccc(O)c(CNC[C@H]2C[C@@H]3CC[C@H]2O3)c1 2330009849 UKPUYSNATUMIFY-OSAQELSMSA-N 263.337 2.058 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc2c(c1)CC[C@H]2N 2336757130 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2.478 10 10 CECE Oc1cc(F)c(Cl)cc1CN[C@@]12COC[C@@H]1C2 1353605434 RNFSUYKWQOELDV-UFBFGSQYSA-N 257.692 2.063 10 10 CECE Cc1cc(Br)c(C)c([C@H]2CNCCN2)c1O 309351929 PMWIIZKLCOXMIS-SNVBAGLBSA-N 285.185 2.005 10 10 CECE CC1(C)CN(c2ccc3c(c2)CC[C@H]3O)CC[S@@]1=O 2128319139 ZZPKJAFWBLDYAV-KUHUBIRLSA-N 279.405 2.014 10 10 CECE CCN1C(=O)N=C(O)/C(=C/c2cccs2)C1=O 33326326 WMFGYGRELCXJCB-VURMDHGXSA-N 250.279 2.070 10 10 CECE Cc1cccc(CN[C@H](CN(C)C)C(C)C)c1O 124727849 KCNRSZZJYCNTIP-CQSZACIVSA-N 250.386 2.376 10 10 CECE O=C(/C=C/c1cnccn1)N1CCc2ccc(F)cc21 58746394 WUESFMXHSIDLRP-ONEGZZNKSA-N 269.279 2.218 10 10 CECE Nc1ccc(N2CCN(CCC[C@@H]3CCCO3)C2=O)cc1 87274438 AOWMLLBRELILBD-OAHLLOKOSA-N 289.379 2.470 10 10 CECE CC(C)NCc1ccc(N2C[C@@H](C(N)=O)CC[C@@H]2C)cc1 42438226 MKRADAIXGYTNFD-ZFWWWQNUSA-N 289.423 2.275 10 10 CECE Nc1cccc(/C=C/C(=O)NCc2ccccc2O)c1 228421365 VRPXKYBCEKMEAJ-CMDGGOBGSA-N 268.316 2.304 10 10 CECE CN1CCc2cc([C@H]3[C@@H](CN)CCN3C3CC3)ccc21 226457667 MVAFMUASCQSRMC-PBHICJAKSA-N 271.408 2.163 10 10 CECE CC[C@H]1COCCN1Cc1ccc(OC)cc1O 132350173 FRVQRBYDUGYLAU-LBPRGKRZSA-N 251.326 2.012 10 10 CECE CN(CCc1ccccc1)CC(=O)c1ccc(O)c(O)c1 88199299 DGQWPBREQCNJQX-UHFFFAOYSA-N 285.343 2.455 10 10 CECE COc1cccc(CN2CCC[C@H]2C(=O)OC(C)C)c1O 93536107 BKQWKOUQUGAYCJ-ZDUSSCGKSA-N 293.363 2.317 10 10 CECE COc1ccc(CCNCc2cccc(OC)c2O)cn1 527793570 MHZKISVEQPTZBB-UHFFFAOYSA-N 288.347 2.137 10 10 CECE C[C@@]1(c2cc(O)c(O)c(Br)c2)CCCN1 258377753 BZMRVLLSKNJSIT-NSHDSACASA-N 272.142 2.459 10 10 CECE C[C@@H](N[C@@H]1CCNC12CCC2)c1cc(F)ccc1O 530216495 PSJLDLAYCHXTTN-QMTHXVAHSA-N 264.344 2.467 10 10 CECE Cc1nn(C)c(C)c1NC(=O)N(C)Cc1ccccc1O 271356816 DZWCHPQEERCONR-UHFFFAOYSA-N 288.351 2.406 10 10 CECE C[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)CC1 276508044 ARWCWKJYEKWBEH-SECBINFHSA-N 267.300 2.499 10 10 CECE COc1cc(O)c(CN(C(C)C)[C@@H]2CCOC2)cc1OC 291049328 GWNQJXQTBJFJFS-CYBMUJFWSA-N 295.379 2.409 10 10 CECE CN(C)c1ccc(CN[C@@H]2CC[C@H]3CCN[C@H]2C3)cc1 721723984 AJMMESWYSBABHW-XKQJLSEDSA-N 273.424 2.373 10 10 CECE CCOc1ccc(N2C[C@@H]3CNC[C@@H]3C2)cc1OCC 2162678342 DSTSFZJEACLGRN-BETUJISGSA-N 276.380 2.140 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](C)Cc1cncc2ccccc12 808550417 FQQMBMJWEFWAQK-NSHDSACASA-N 299.326 2.115 10 10 CECE CN(C[C@@H]1CCOC1)c1ccc(/C=C/C(=O)O)cc1 399579328 IQSLGMNIORTBAI-LVDDQXARSA-N 261.321 2.257 10 10 CECE Cc1nccnc1[C@H](N)c1ccc2c(c1)CCCN2C 2163128543 VUNZWRGSYKDGCL-OAHLLOKOSA-N 268.364 2.216 10 10 CECE CC(C)N(C(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCOC1 292665034 CBHFSQWHAMMCSC-BPJJOFIESA-N 291.347 2.137 10 10 CECE CC[C@H]1CCNC[C@@H]1NCc1ccc2c(c1)CCCO2 2163639137 ABIOGWSFJKXAPG-HOCLYGCPSA-N 274.408 2.489 10 10 CECE COCCCCCNC(=O)/C=C\c1ccc(O)c(O)c1 588405557 HSARFMXNCKSUKE-VURMDHGXSA-N 279.336 2.044 10 10 CECE Oc1ccccc1CN1CCCC[C@@]2(CCNC2)C1 903960165 YCWKMMZEKKGISN-INIZCTEOSA-N 260.381 2.358 10 10 CECE CC(C)(C)OC(=O)N1CCN(CCN=[N+]=[N-])[C@@H]2CC[C@@H]21 1954208883 VCNVKRMEJYSREZ-MNOVXSKESA-N 281.360 2.380 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NCCCOCC1CC1 588403827 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CN(C)CC1CCC(NC(=O)c2cc(O)cs2)CC1 750539757 UEAIONXLBUJSTO-UHFFFAOYSA-N 282.409 2.304 10 10 CECE CN(C)C1(C(=O)NCc2ccc3cccnc3c2O)CCC1 862026576 SVSLSBKUMOTUNZ-UHFFFAOYSA-N 299.374 2.041 10 10 CECE CCn1ncc(CNCc2ccc3ccccc3c2O)n1 862433292 IFKGNGLFJOVGEL-UHFFFAOYSA-N 282.347 2.447 10 10 CECE C[C@H](NC(=O)[C@@]1(C)CCCCN1)c1ccccc1O 870988300 MEEMGTTYDNYCGO-XHDPSFHLSA-N 262.353 2.102 10 10 CECE Oc1cc2c(cc1CNC[C@@H](F)C(F)(F)F)OCO2 1876090705 BPEDYPGZAYPDEU-SNVBAGLBSA-N 281.205 2.111 10 10 CECE C[C@H](NCC12CC(C1)[C@H](C)O2)c1ccc(O)cc1O 1878454569 QBXNRRGTRCKZMA-ZNPWSYNXSA-N 263.337 2.316 10 10 CECE COc1ccc(CNC(=O)c2cnc(F)cc2C)c(O)c1 1139033130 YMNKHQYHUVZMCN-UHFFFAOYSA-N 290.294 2.173 10 10 CECE C[C@H]1C(=O)N(C)[C@H](C)[C@H](C)N1Cc1ccc(F)c(F)c1O 895921808 QMSNQVUZRCGEOU-UTLUCORTSA-N 298.333 2.110 10 10 CECE C[C@@H](NC[C@]12C[C@](C)(CO1)C2)c1ccc(O)cc1O 1879820135 WMRISYDLAYMIOJ-KMUNFCNLSA-N 263.337 2.318 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H]2CN(C)C)c(F)c1 1880929371 WKCIXNCLNRAMRE-KOLCDFICSA-N 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10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(C)CCCSC)ccc21 312224053 CUGQUOXFSKEXPE-CQSZACIVSA-N 293.436 2.479 10 10 CECE Oc1c(Cl)cccc1CNCCCc1cn[nH]c1 315619572 SFFNFKUMZBKPOA-UHFFFAOYSA-N 265.744 2.491 10 10 CECE C[C@@]1(CO)CC(F)(F)CN1CCCc1ccc(N)cc1 2159041866 WTBIZCNOWDTNBN-AWEZNQCLSA-N 284.350 2.293 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H]3CC[C@H]2[C@@H](N)C3)c1 700872080 HTHGQHPPLNNQGM-GVARAGBVSA-N 276.380 2.273 10 10 CECE CC(C)[C@H]1CNCCCN1Cc1cc(F)cc(F)c1O 2159177486 XSAJMRNUFCPKNO-CQSZACIVSA-N 284.350 2.490 10 10 CECE C[C@H](NC[C@]12COC[C@@H]1C2(F)F)c1ccc(F)cc1O 2161877744 UOYLOSZFABKXTC-HJIKLVIJSA-N 287.281 2.464 10 10 CECE CCOc1cccc(CN(CC)[C@H](C)CC(=O)O)c1O 86763741 JPWWNSCCBBQCLN-LLVKDONJSA-N 281.352 2.476 10 10 CECE COCc1ccccc1C(=O)NCc1ccc(N)cc1 702067648 GCDUCUZFGLYFJZ-UHFFFAOYSA-N 270.332 2.345 10 10 CECE CCNCc1ccc(N2C[C@H]3CN(C)C[C@]3(C)C2)cc1 702400711 JGYIZQSEYYCBRM-NVXWUHKLSA-N 273.424 2.184 10 10 CECE CCNCc1ccc(N2CC3(CCCO3)C2)c(F)c1 702943416 KFQJZCYBTFKPGT-UHFFFAOYSA-N 264.344 2.304 10 10 CECE CC[C@H]1CN(Cc2ccc(F)c(F)c2O)CCN1C 703519924 WULWVDYFLVKDPD-NSHDSACASA-N 270.323 2.196 10 10 CECE Oc1c(CN2CCC[C@@H]3COC[C@@H]32)ccc(F)c1F 703619578 SVOVVUNCJNBJQT-PWSUYJOCSA-N 269.291 2.281 10 10 CECE O=C(N[C@@H]1CC[C@H]2CCC[C@H]21)c1ccc(O)c(O)c1 707966610 QDWGTQVIGFDNNS-YUSALJHKSA-N 261.321 2.406 10 10 CECE CN1CCCc2cc([C@]3(O)CCC(C)(C)NC3)ccc21 2163108634 YFLAUAWJGWIIJE-KRWDZBQOSA-N 274.408 2.419 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)[C@@](O)(CC)COC 2163132584 DFQJHOOMRYIVIG-JKSUJKDBSA-N 280.412 2.191 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)CCC1CC1 2163139258 WRQUOMFVNSGBBK-IAGOWNOFSA-N 274.408 2.491 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O 708859046 QSAJAURWVTXAIE-XQQFMLRXSA-N 295.404 2.105 10 10 CECE CN1Cc2ccc(N3CCC[C@H](NC4CC4)C3)cc2C1 689442522 LBWHPFUPRASEMH-INIZCTEOSA-N 271.408 2.353 10 10 CECE CCCN1CC(NCc2cc(Br)ccc2O)C1 379150606 FNZCIMNQBAPDCY-UHFFFAOYSA-N 299.212 2.339 10 10 CECE C[C@H](CO)[C@H]1CCCCN1CCOc1ccc(N)cc1 711329710 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CC(C)NCc1ccc(N2CCS[C@H](CO)C2)cc1 719991131 QQPCKPNPDHUCMX-HNNXBMFYSA-N 280.437 2.099 10 10 CECE Oc1cc2c(cc1CN[C@@H]1[C@H]3CCCC[C@H]31)OCO2 389053806 QKLSIJYETCBQPL-HBYGRHMLSA-N 261.321 2.399 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC[C@H]3NCC[C@@H]3C2)c1 389251858 DILGROTUYYUNPK-GZBFAFLISA-N 260.381 2.445 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H]2CN(C)CC[C@H]2C1 389218339 VTMVGCITAYBYJZ-RDBSUJKOSA-N 260.381 2.337 10 10 CECE CC(C)n1ccc(COc2cc(F)cnc2N)n1 723409159 KWXRLOSXOBBYPF-UHFFFAOYSA-N 250.277 2.159 10 10 CECE CN1[C@H]2CC[C@@H]1CN(Cc1cc(Cl)ccc1O)C2 723686691 RUBACKXXWHDVDV-BETUJISGSA-N 266.772 2.324 10 10 CECE COc1ccc(N(C)C[C@H](C(=N)N)C2CCC2)cc1 397143466 YWFVZIWIOMGYBW-AWEZNQCLSA-N 261.369 2.484 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@H]1CCOC1 398860334 XLNNWRRCHUMVBK-GHMZBOCLSA-N 251.326 2.127 10 10 CECE C[C@@H](N[C@@H](C(=O)O)C1CCC1)c1ccc(O)cc1O 399243526 DFTMMJFLUOMVOR-AMIZOPFISA-N 265.309 2.002 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@@H](C3)[C@H]2CO)cc1O 2178689262 OWFCURLPXDHFAL-OXJKWZBOSA-N 276.380 2.022 10 10 CECE Cc1ccc([C@@H](C)NCc2ccc(O)c(O)c2O)cn1 2174221843 IQABWFVBNORHHW-SNVBAGLBSA-N 274.320 2.358 10 10 CECE Cc1ccnc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 2062668713 GRJZOBAHSKQUGA-NSHDSACASA-N 286.331 2.162 10 10 CECE CCc1ncncc1CNCc1cc(OC)ccc1O 2178832924 QORJBQSTCAOZRQ-UHFFFAOYSA-N 273.336 2.043 10 10 CECE CC[C@@H]1CC[C@H](C)N1C(=O)c1cnn2c(O)cc(C)nc12 2063426448 ZQPPARHMGSXEFV-WDEREUQCSA-N 288.351 2.146 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@H]1CCCC[C@@H]1F 2175601895 JLHJFLKGHAACBT-RYUDHWBXSA-N 281.327 2.493 10 10 CECE C[C@H](c1c(O)cccc1F)n1ncnc1Br 2070032772 OPYSDUOBXCZALL-ZCFIWIBFSA-N 286.104 2.495 10 10 CECE Cc1cc(CO)n([C@H](C)c2c(O)cccc2F)n1 2070080336 DXMMXDMSGYQPQX-SECBINFHSA-N 250.273 2.138 10 10 CECE Cc1nccn1C[C@H](C)CN(C)c1ccc(CN)cc1 2169674751 QSDXCVQFEAANBV-CYBMUJFWSA-N 272.396 2.423 10 10 CECE CC[C@H]1CN(c2ccc(CNC)cc2F)C[C@H]1N(C)C 2170457875 PMYKOEDXWFOKJN-XJKSGUPXSA-N 279.403 2.322 10 10 CECE CCN[C@@H](C)c1ccc(N2CC=C(CO)CC2)cc1O 2171003412 ZXGCCGOJQJJRDF-LBPRGKRZSA-N 276.380 2.192 10 10 CECE Oc1cccc(F)c1CN1CC[C@H]2OCC[C@@H]2C1 1137838675 HBMTXADZEASEIH-QMTHXVAHSA-N 251.301 2.142 10 10 CECE CCC[C@@H](NC(=O)c1cc(O)c(O)c(O)c1)C(F)(F)F 2188911867 GGTRYZDZAAFYDK-SECBINFHSA-N 293.241 2.264 10 10 CECE O=C(NC1(C2CCCC2)CC1)c1cc(O)c(O)c(O)c1 2188913316 QVCFUTTZYOWLEL-UHFFFAOYSA-N 277.320 2.256 10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2C[C@@]23CCCOC3)cc1 2198125441 VFFXGRYAJXWFTG-OWCLPIDISA-N 275.396 2.074 10 10 CECE COC[C@H]1CCC=C[C@]1(O)c1ccc2c(c1)CCN2C 2183591018 SLVRKVILNVUOOQ-WBVHZDCISA-N 273.376 2.479 10 10 CECE CN(Cc1cc(N)ccc1O)Cc1ccnn1C1CC1 2194130395 PHDQTWPAYFIRBS-UHFFFAOYSA-N 272.352 2.138 10 10 CECE COC1(CNC(=O)Nc2ccc(N)cc2)CCSCC1 2194215640 KVLWZULBMZENQO-UHFFFAOYSA-N 295.408 2.303 10 10 CECE CNCc1cc(F)c(N2C[C@@H](OC)C[C@H]2CF)c(F)c1 2190240507 XXSGBPKCBFTIPT-QWRGUYRKSA-N 288.313 2.247 10 10 CECE C[C@@H](O)c1ccc(N2[C@H]3CC[C@@H]2[C@H]2CC[C@H]3O2)cc1O 2198646341 OEVBXEGQUBEFHK-CBMNGVKYSA-N 275.348 2.344 10 10 CECE N[C@@H]1CCCc2cc(N3CC(N4CCCC4)C3)ccc21 2184681729 HATHTHZMNGXWHZ-QGZVFWFLSA-N 271.408 2.307 10 10 CECE COC[C@@H](CN(C)c1ccc2c(c1)CCC[C@H]2O)OC 2184689496 PLYMZPWEIJPQQB-GDBMZVCRSA-N 279.380 2.154 10 10 CECE O[C@H]1CCc2cc(N3CCN4CCCC[C@H]3C4)ccc21 2184737612 JSRJYCYDEQMDLW-RDJZCZTQSA-N 272.392 2.341 10 10 CECE O[C@@H]1CCc2cc(N3[C@H]4CC[C@H]3[C@H](F)[C@H](O)C4)ccc21 2190692746 OBKMBYOOJCNSRG-GZFHQYITSA-N 277.339 2.106 10 10 CECE CN[C@H](C)c1cc(F)c(N2CC[C@](F)(CO)C2)c(F)c1 2194715651 UUKOYMRZNRDHIV-YMTOWFKASA-N 288.313 2.156 10 10 CECE C[C@H](N)c1cc(F)c(N2CC(F)(F)C[C@H]2CO)c(F)c1 2194706054 AGWKSWDWMFEXIP-CBAPKCEASA-N 292.276 2.191 10 10 CECE COc1cccc(CN2C[C@@H](OC)CC(F)(F)C2)c1O 2185148377 YNNIBZUIEFEAHL-NSHDSACASA-N 287.306 2.257 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@@H](O)[C@H]2CC3)cc1F 2097814405 RTUVOOOELMVHAN-NILFDRSVSA-N 264.344 2.167 10 10 CECE COc1cc(N)c(N2CC(CSC)C2)cc1OC 2042962345 WZABINLDPNKCHL-UHFFFAOYSA-N 268.382 2.085 10 10 CECE CN(C)c1ccc([C@H](O)CNCC(C)(C)C)cc1 2044707603 FNYGROBEKGIKPK-CQSZACIVSA-N 250.386 2.422 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H](N)CC(F)(F)F)cc1 2044710407 IJSBMTSJAYUFLF-QWRGUYRKSA-N 262.275 2.066 10 10 CECE CC(F)(F)[C@@H]1C[C@H]1CNCc1cccc(O)c1O 2045946680 JDPIRNYFSXAUIU-VHSXEESVSA-N 257.280 2.479 10 10 CECE Oc1cccc(CNC[C@H]2C(F)(F)C23CC3)c1O 2047218581 YOXXZSPTDVBERV-SNVBAGLBSA-N 255.264 2.233 10 10 CECE COc1ccc(N(C)[C@@H]2CCCCNC2)c(F)c1 2050023027 FMGCHJWSAUWINQ-LLVKDONJSA-N 252.333 2.413 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@@H]2CCCC(F)(F)[C@@H]21 2051250720 FXZKGGNIWOGUME-YIZRAAEISA-N 258.272 2.437 10 10 CECE COC[C@@H]1CN(c2ccc(CN)c(F)c2)C[C@@H]1C 2054831600 JACQDIQYBHTHJP-JQWIXIFHSA-N 252.333 2.003 10 10 CECE C[C@]1(CO)CCCN1c1cc(Cl)c(CN)cc1F 2057256754 SQERIYKDBSREPX-CYBMUJFWSA-N 272.751 2.289 10 10 CECE C[C@H](C(=O)NC(C)(C)C)N1CCC[C@@H]1CN=[N+]=[N-] 2059060301 VIZLLCIEVHVDNR-NXEZZACHSA-N 253.350 2.064 10 10 CECE O=C1C[C@@H]2CCC[C@@]2(CNCc2ccc(Cl)cc2O)N1 2187253749 VYOLEAWXBQLXCM-NHYWBVRUSA-N 294.782 2.194 10 10 CECE C[C@@H]1OCC[C@H]1CC[C@H](NN)c1ccc(N(C)C)cc1 2196485925 OIQDBLXNQVTLNH-ZENOOKHLSA-N 277.412 2.462 10 10 CECE Cc1ccnc(N[C@H](C)c2ccccc2O)c1C(N)=O 2192624530 VMUHTJCWPJDZQE-SNVBAGLBSA-N 271.320 2.368 10 10 CECE C[C@H](NC(=O)[C@H]1CC(C)(C)CCN1)c1ccccc1O 2192630985 CSWXUHWHDWYSOE-WCQYABFASA-N 276.380 2.348 10 10 CECE C[C@@H](C(=O)O)C1CCN(Cc2ccc(O)c(O)c2)CC1 2187894766 LAEXGWZOHJMCGC-SNVBAGLBSA-N 279.336 2.031 10 10 CECE O=C(O)C[C@H]1C[C@H](NCc2cc(Cl)ccc2O)CCO1 2187963557 ZVOOWASCDDIOGE-VXGBXAGGSA-N 299.754 2.158 10 10 CECE CC1(C)Cc2ccccc2N(CC2=C[C@@H](O)[C@H](N)C2)C1 2188031341 NSEQOXSPQMGWFI-GDBMZVCRSA-N 272.392 2.094 10 10 CECE COc1cccc(CN2CC[C@H]3CCC[C@@]32CN)c1O 2197339428 JCVSZOBVJAKZAU-CZUORRHYSA-N 276.380 2.104 10 10 CECE COc1ccc(CNC[C@H](C)OC(F)F)c(O)c1 2076281164 OVBWRARFESQHSF-QMMMGPOBSA-N 261.268 2.118 10 10 CECE Oc1ccc(CCN[C@H]2C[C@H]3C[C@H]2C[C@@H]3F)cc1O 2101411155 LZXWPZSVLWQLLV-VOAKCMCISA-N 265.328 2.367 10 10 CECE CC[C@@H]1CC[C@@H](NCc2ccc(N(C)C)cc2)CN1 2102237616 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10 10 CECE COc1cccc(O)c1CN[C@@H](C)[C@H]1CCCCO1 2104434050 PITFEAOKEAEUGZ-SMDDNHRTSA-N 265.353 2.448 10 10 CECE COc1cccc(O)c1CN(C)[C@@H]1CCC[C@H](N)C1 2104442058 GHMNSKZTFNRWSA-NWDGAFQWSA-N 264.369 2.103 10 10 CECE C[C@H]1CC[C@H](CCNC(=O)Nc2ccc(N)cc2)O1 2104835587 AULNFORAXVWSLA-GXFFZTMASA-N 263.341 2.348 10 10 CECE COCCNCc1ccc(N2CC(CSC)C2)cc1 2104873696 GEZONDZUHULBMD-UHFFFAOYSA-N 280.437 2.222 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)OCCO3)[C@H](C)[C@H]1N 2106372437 UYQLKQABECKQBZ-HFAKWTLXSA-N 262.353 2.020 10 10 CECE CN1CCCc2cc([C@H](O)C[C@H]3CCCN3)ccc21 2106824797 COXKJGNYPVUZIW-GDBMZVCRSA-N 260.381 2.245 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H](F)[C@H](C)CN)cc1 2106827957 IIIAEXPCJXYFAA-DFBGVHRSSA-N 268.376 2.499 10 10 CECE Cc1ccc([C@H](C)N(C)C[C@H]2COCCO2)c(O)c1 2087387015 SSQFHIHIEUFOOA-STQMWFEESA-N 265.353 2.109 10 10 CECE CN[C@@H](CNC(C)(C)C)c1ccc2c(c1)CCN2C 2107843523 LTTXHFGJEGQDLY-AWEZNQCLSA-N 261.413 2.328 10 10 CECE CCC[C@H]1CCN1c1ccc2c(c1)N(C)C(=O)[C@H]2N 2088653778 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CC1(C)CCC[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)O1 2219730663 UMWWLKMADBKHRH-ZJUUUORDSA-N 252.318 2.245 10 10 CECE CO[C@]12CC[C@H]1CN(c1c(F)cc(CN)cc1F)C2 2230468217 LFGDJJILBKTCGE-HZMBPMFUSA-N 268.307 2.039 10 10 CECE Cc1cccc(O)c1CN[C@H]1CCCN(C2CC2)C1 2273144022 JYLSGILTTUSHCT-ZDUSSCGKSA-N 260.381 2.417 10 10 CECE CNCc1ccc(OC)c(CSCCCCO)c1 2221066702 FAPJNZOXEQKANF-UHFFFAOYSA-N 269.410 2.420 10 10 CECE CN[C@@H](C)c1ccc(N2CCC23CN(C)C3)c(C)c1 2232102514 MHZGUGQPOQZGPW-ZDUSSCGKSA-N 259.397 2.170 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@@H](F)C[C@@H](O)C3)ccc21 2234668264 WGJPNSHFWWHSJD-JGGQBBKZSA-N 278.371 2.193 10 10 CECE CC1(C)CCCN(c2ccc3c(c2)OCCO3)[C@@H]1CO 2235110246 WLBBWWLNYDRASF-OAHLLOKOSA-N 277.364 2.445 10 10 CECE COc1ccc(N2[C@H]3CCC[C@H](O)[C@H]2CC3)c(C=O)c1 2235992658 PTKWFDKEBFLLII-MAZHCROVSA-N 275.348 2.390 10 10 CECE CCCN(CC)C1CN(c2ccc(OC)cc2CO)C1 2235965573 GFZPMZMIUYLDJQ-UHFFFAOYSA-N 278.396 2.108 10 10 CECE COc1ccc(N2CCC[C@H](C(C)(C)O)C2)c(C=O)c1 2235995975 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CN(C)C[C@@H]1CCN1c1ccc(CNC2CCC2)cc1 2240015087 UHDSRWKFMQSODH-KRWDZBQOSA-N 273.424 2.469 10 10 CECE Nc1ccc(CCNC[C@@H](F)C2CCOCC2)cc1 2230023569 JAERMWYUOZAPPJ-OAHLLOKOSA-N 266.360 2.166 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@H]1CS(=O)(=O)C1(C)C 2240756946 GLIIMCDZDFGXEK-FZMZJTMJSA-N 296.436 2.027 10 10 CECE CCc1nn(C)c(CNCc2ccc(O)cc2O)c1Cl 2240963511 HYNIJDNAYABTSL-UHFFFAOYSA-N 295.770 2.337 10 10 CECE CCC(=O)N1CCN(c2ccc([C@H](C)O)c(C)c2)CC1 2285173602 FCOAWSNDFMNJIK-ZDUSSCGKSA-N 276.380 2.107 10 10 CECE CN(Cc1ccc(N)cc1)c1cn(C(F)F)cn1 2257258195 RKCOODIBRCGYFP-UHFFFAOYSA-N 252.268 2.497 10 10 CECE CCO[C@@]1(COCCc2ccc(N)cc2)CCOC1 2271488489 NIVBUOXRQZLXPF-OAHLLOKOSA-N 265.353 2.024 10 10 CECE Oc1cccc(CNCc2nc(C3CC3)ns2)c1O 2272279106 YORMLURUNBEMSK-UHFFFAOYSA-N 277.349 2.117 10 10 CECE CC[C@@H](C)[C@H](NCc1cc(Cl)ccc1O)C(N)=O 2264150997 VSRFNAGFVJVMFC-PELKAZGASA-N 270.760 2.035 10 10 CECE COC1(CN2CCC(CN=[N+]=[N-])CC2)CCOCC1 2265564313 MMVVKMUKXSMNEU-UHFFFAOYSA-N 268.361 2.204 10 10 CECE FC(F)Oc1ccc(N2CC[C@H]3CCN[C@H]3C2)cc1 2278478341 KXWJHPQYADLIEK-MFKMUULPSA-N 268.307 2.476 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)c2c[nH]nc2C2CC2)C1 2269191202 RIWDCKKGOHRISB-MRVPVSSYSA-N 260.301 2.060 10 10 CECE COc1ccc(N2C[C@H](F)C[C@@H]2CN)c2c1CCC2 2269111056 RNLKRPLNDBOXKQ-GHMZBOCLSA-N 264.344 2.059 10 10 CECE CC(C)[C@H]1[C@H](C(=O)O)CCN1Cc1ccc(O)c(O)c1 2279365758 DIRDWPVIHMSOHX-RISCZKNCSA-N 279.336 2.029 10 10 CECE Cc1cc(N2C[C@@H]3CC(O)C[C@H]3C2)ccc1[C@H](C)O 2269674910 RTPREBGEGVIVLR-AVGNSLFASA-N 261.365 2.255 10 10 CECE Cc1cc(N2CCN(CCCF)CC2)ccc1[C@H](C)N 2285123277 CWLDBGDRGOXAJR-AWEZNQCLSA-N 279.403 2.496 10 10 CECE COc1ncc(F)cc1[C@H](O)CCc1ccc(N)cc1 2295377963 KPKAHCKKSRIUHZ-CQSZACIVSA-N 276.311 2.478 10 10 CECE COc1ccc(O)c(CN[C@H]2C[C@H]3[C@@H]4CC[C@@H](O4)[C@@H]23)c1 2296951494 XELOBCOKWRNFKC-RHMLRGBNSA-N 275.348 2.056 10 10 CECE CC[C@@](C)(CNCc1cnc(SC)s1)C(=O)O 2303431196 ISIUAGLOSRRCAL-NSHDSACASA-N 274.411 2.456 10 10 CECE Oc1cccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@H]3F)c1O 2308602746 MFRJUULKKUIWKZ-BJDJZHNGSA-N 251.301 2.324 10 10 CECE COc1ccc(N(C)Cc2snnc2C)c(N)c1 2314152003 AXADTVRLJLCKFO-UHFFFAOYSA-N 264.354 2.074 10 10 CECE C[C@H](O)c1ccc(N(C)CCC[C@@H](C)O)cc1O 2314572824 BAOVCJLYAWFIRA-MNOVXSKESA-N 253.342 2.043 10 10 CECE COc1cc(Cl)c(N2CC=C[C@H]2CO)c(OC)c1 2319634255 BZXRFFVXEBUNEC-VIFPVBQESA-N 269.728 2.094 10 10 CECE C[C@H](N[C@H](C)c1cc(F)ccc1O)[C@@H]1C[C@H]1C(=O)O 2330598016 PUUCWDFACQZANE-RBPQBLHMSA-N 267.300 2.291 10 10 CECE C[C@@H]1CN(c2ccc(CO)c(C3CC3)c2)CC[S@@]1=O 2339161315 RVOAEGWJTNVIQN-WYRIXSBYSA-N 279.405 2.014 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c1C 2340850931 MNTXXJSCKZPDJE-FOCJUVANSA-N 261.365 2.174 10 10 CECE Cc1cnc(CN2CCc3cc(O)c(O)cc3C2)s1 2341214232 JXKXVCOUMOGIEY-UHFFFAOYSA-N 276.361 2.421 10 10 CECE CSc1cc(N2C[C@@H]3CC[C@]3(CO)C2)ccc1CN 2353848633 MNKYXYLGTCFKIU-SWLSCSKDSA-N 278.421 2.076 10 10 CECE N[C@H]1C[C@@]2(C[C@@H]2[C@@H](O)c2ccc(N3CCCC3)cc2)C1 2354608529 BPCWMKCBGBXTFM-MXASKKJJSA-N 272.392 2.448 10 10 CECE CN(C)c1ccc([C@@H](NN)[C@@H]2CC[C@H]3C[C@@H]2CO3)cc1 2354609183 XDFMETRSYNCKQQ-SLBVQIDZSA-N 275.396 2.072 10 10 CECE CN(C[C@H]1C[C@@H]2OCC[C@@H]2O1)c1ccc(CO)c(Cl)c1 2354621311 NDSGIGDGVCIQAZ-SNPRPXQTSA-N 297.782 2.215 10 10 CECE CN(C[C@@H]1C[C@@H]2CC[C@H]1O2)c1c(F)cc(CO)cc1F 2355014405 AZBGHFLNZHGXBM-COPLHBTASA-N 283.318 2.461 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H]3[C@@H]4CCCO[C@@H]43)ccc21 2355553665 IXHIURPGOHMFNB-SVGFKBNWSA-N 272.392 2.494 10 10 CECE CNCc1ccc(OC)c(CN(C)C[C@@H]2CCCCO2)c1 50125140 XKYGWDGXCDREOA-INIZCTEOSA-N 292.423 2.416 10 10 CECE CO[C@]1(C)CCCN(c2ccc(CN)cc2F)C1 230248322 DKNZJQMZOJWLOF-CQSZACIVSA-N 252.333 2.290 10 10 CECE Oc1nc(O)c(OC(F)(F)F)cc1Br 306549846 DSHCIIZZNGPKTG-UHFFFAOYSA-N 273.992 2.154 10 10 CECE CO[C@H]1CCCN(c2ccc([C@H](C)N)c(O)c2)C1 300026898 XQDBQQOIZBDERO-JQWIXIFHSA-N 250.342 2.027 10 10 CECE Cc1ccccc1/C=C1/SC(=S)N(CCO)C1=O 210386112 GSKONTKLIOBDPL-DHZHZOJOSA-N 279.386 2.189 10 10 CECE CCN1CCN(Cc2cccc(F)c2O)C(C)(C)C1 1138130519 BQYZSXAVAADGOW-UHFFFAOYSA-N 266.360 2.447 10 10 CECE COc1cc(O)c([C@H](C)N)c(OC)c1Br 218701680 CTBHVSLORAGMSX-YFKPBYRVSA-N 276.130 2.192 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CCC[C@@H](O)C1 127875470 HOLXHBFDZHNINE-GHMZBOCLSA-N 255.745 2.439 10 10 CECE COc1ccc([C@H](C)NCC(=O)N2CCCCC2)c(O)c1 228801828 JIGBIGAVETTWIM-LBPRGKRZSA-N 292.379 2.064 10 10 CECE C[C@H](O)[C@@H]1CCN(c2ccc([C@@H](C)N)cc2F)C1 226456485 HOOKDTWYBRIVGO-JFGNBEQYSA-N 252.333 2.053 10 10 CECE Cc1cc(O)c([C@H](N)CCO)c(C)c1Br 95717465 DAOGMKQGEJITRS-MRVPVSSYSA-N 274.158 2.154 10 10 CECE CCn1nc(C)cc1C[C@H](NN)c1ccc(N(C)C)cc1 97754452 IFGLKLXCIVHZBL-INIZCTEOSA-N 287.411 2.025 10 10 CECE O=C(O)/C=C\c1ccc(N2CCCN3CCC[C@H]3C2)cc1 252451309 GHCHPYMLFWXSLF-HWYHOQROSA-N 286.375 2.459 10 10 CECE COc1c([N+](=O)[O-])ccc(CNC[C@H]2C[C@@H]2C)c1O 278837868 JJIMWWAERPOJHH-WCBMZHEXSA-N 266.297 2.055 10 10 CECE C[C@H](N[C@@H](CO)C[C@@H](O)C(C)(C)C)c1ccccc1O 284404826 PYWXULUBIKXCAW-YWPYICTPSA-N 281.396 2.201 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CCC[C@H]2O)c(F)c1 709477651 XSYRWYGMAYIAPS-WKPIXPDZSA-N 266.360 2.456 10 10 CECE CN1CCCc2cc([C@](C)(O)[C@H]3CCCNC3)ccc21 2163092117 OCMMCHKBFDCCPH-RDJZCZTQSA-N 274.408 2.276 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@]23CCC[C@@H]2OCC3)cc1 2163097026 KOGUKLMRSGVUMD-HRCADAONSA-N 275.396 2.216 10 10 CECE Cc1nc([C@H](O)c2ccc3c(c2)CCCN3C)[nH]c1C 2163106059 LWALLUCWMOABAN-OAHLLOKOSA-N 271.364 2.491 10 10 CECE CCN(CC)c1ccc([C@H](NC)[C@H](O)[C@@H](C)OC)cc1 2163147202 KTBSOHPIQRBQJG-UHOFOFEASA-N 280.412 2.189 10 10 CECE Cc1cc(O)nc(CCNCc2ccc(Cl)cc2O)n1 2163206691 BEKHCFLSWFBZNL-UHFFFAOYSA-N 293.754 2.182 10 10 CECE CSC1([C@H](O)[C@H](N)c2ccc3c(c2)CCCN3C)CC1 2163244070 RZTSBNHRPDYCNO-HUUCEWRRSA-N 292.448 2.325 10 10 CECE C[C@]12CN(c3ccc(CNC4CC4)cc3)C[C@@]1(CO)C2 2165463850 LXCOBJQPLUXCHO-DLBZAZTESA-N 272.392 2.147 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCCC[C@H]2O)cc1O 705985629 UZHUYTYOMJBWQS-LERXQTSPSA-N 264.369 2.152 10 10 CECE CCO[C@@H]1CCCC[C@@]1(NCCCN=[N+]=[N-])C(=O)OC 2162120914 HTTJUUXROUFJRM-YPMHNXCESA-N 284.360 2.167 10 10 CECE NC[C@@]1(C(F)(F)F)CCCN1c1ccc2c(c1)CCO2 2162856932 OOUCUBDHEULLEW-CYBMUJFWSA-N 286.297 2.482 10 10 CECE CNCc1ccc(N2C[C@H]3[C@@H]4CC[C@@H](O4)[C@H]3C2)cc1 718154726 JPMNADMHGXJQKK-SYMSYNOKSA-N 258.365 2.020 10 10 CECE C[C@H](CCNCc1cc(Cl)c(F)cc1O)[S@](C)=O 816563505 AHGFXELOWQTGDZ-CVJBHZAOSA-N 293.791 2.431 10 10 CECE C[C@@H](OC[C@H](O)COc1ccc(N)cc1)C1CCC1 719738924 FNHRDNAEJNANMR-RISCZKNCSA-N 265.353 2.214 10 10 CECE CC[C@H](NC)c1ccc(N(C)[C@H]2CCN(C)C2=O)cc1 723198506 KSBMXCULMDIFLA-GJZGRUSLSA-N 275.396 2.024 10 10 CECE C[C@@]1(CCO)CCN(c2ccc3c(c2)CC[C@H]3N)C1 2131893077 BDIUVBFPYBPHSJ-CVEARBPZSA-N 260.381 2.231 10 10 CECE CN(C)c1ccc(/C=C/CN2C[C@@H]3C[C@@]3(CO)C2)cc1 835046115 SSGKMRDBHLRIDM-PKOQZONYSA-N 272.392 2.080 10 10 CECE COc1ccc(O)c(CNc2ccc([N+](=O)[O-])nc2)c1 735487271 GMEFRLAHUWWGDF-UHFFFAOYSA-N 275.264 2.316 10 10 CECE CC(C)(C)OC(=O)NC1CC2(C1)CN(CCN=[N+]=[N-])C2 1954208719 RSDSEASQENSEMS-UHFFFAOYSA-N 281.360 2.286 10 10 CECE CCOCc1cc(CN[C@@H]2CNCC[C@H]2C)ccc1OC 841059000 IXQVBXQAHALBCQ-CZUORRHYSA-N 292.423 2.319 10 10 CECE CNC1CCN(Cc2cccc(Cl)c2O)CC1 843048920 AHIHWNKQDLSJLT-UHFFFAOYSA-N 254.761 2.229 10 10 CECE C[C@H]1CNC[C@@H](C)N1C/C=C/c1ccc(N(C)C)cc1 843063713 AEKATMBXACLLPH-FKZIUMHTSA-N 273.424 2.448 10 10 CECE Cc1cc(O)c(CN[C@H](CN)C(F)(F)F)c(Cl)c1 848714534 QKGRIKYDXXZXNZ-SNVBAGLBSA-N 282.693 2.333 10 10 CECE COc1cc(O)c(CN[C@@H]2CCC[C@H](CO)C2)cc1OC 840976030 BBYSODOTUKAMKP-WCQYABFASA-N 295.379 2.050 10 10 CECE Oc1c(F)cc(Cl)cc1CN[C@H]1CNCCC1(F)F 841075928 ZRCPYADUTVLJOB-JTQLQIEISA-N 294.704 2.272 10 10 CECE COc1ccc(N2CC[C@@H](N[C@H]3CCNC3(C)C)C2)cc1 925714902 YTYQXILFIKCALA-CJNGLKHVSA-N 289.423 2.004 10 10 CECE C[C@@]1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CC1(F)F 855795267 AEEVXWSRWAZMER-LQPUYASZSA-N 283.274 2.273 10 10 CECE CC[C@](C)(NC(=O)c1cc(O)c(O)c(O)c1)C1CC1 2132349344 BWGGLRRYXDAUCD-AWEZNQCLSA-N 265.309 2.112 10 10 CECE COC(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2O)C1 775348200 UIFIKCXKQLQCCG-OCCSQVGLSA-N 292.379 2.349 10 10 CECE Cc1nc(Cl)nc(N(C)Cc2ccc(N)cc2)c1N 1876367363 VDCJXSPMFYIBRE-UHFFFAOYSA-N 277.759 2.239 10 10 CECE C[C@H](NC(=O)/C=C/c1ccncn1)c1ccc(N(C)C)cc1 775408708 BFQBASQMEWWVFI-PPGNKHEKSA-N 296.374 2.433 10 10 CECE CN(C)c1ccc([C@H](N)[C@@]2(O)CC[C@@H]2C2CC2)cc1 1876607353 ANVBUCMPRUKION-OWCLPIDISA-N 260.381 2.304 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@](C)(COC)OC 1895246771 MKUGPBZLCANNRZ-GJZGRUSLSA-N 266.385 2.065 10 10 CECE CC(C)CN(C)C1CN(c2ccc(CN)c(F)c2)C1 1877448083 ISEUJPZREMCJBF-UHFFFAOYSA-N 265.376 2.061 10 10 CECE CC(C)NC(=O)c1cc2cc(O)c(O)cc2s1 895424440 XPHYPTNAZFEHJW-UHFFFAOYSA-N 251.307 2.451 10 10 CECE CCOc1cccc(CN[C@@H]2C[C@]23CCOC3)c1O 1896292909 NRUPFSPNLBAUCD-HIFRSBDPSA-N 263.337 2.060 10 10 CECE COCCCN(C)c1ccc(C=CC(=O)O)cc1F 1898083801 GKESHYKDUFMMGA-UHFFFAOYSA-N 267.300 2.396 10 10 CECE CCN1C=CC(=C2SC(=S)N(CC)C2=O)C=C1 5851534 URVNGLXEYBEJIN-UHFFFAOYSA-N 266.391 2.484 10 10 CECE CC1(C)CC(CNC(=O)Cc2ccc(O)c(O)c2)C1 1154490806 JSLQBUDAYPHIDU-UHFFFAOYSA-N 263.337 2.193 10 10 CECE FC(F)(F)CN1CCNc2cc3c(cc21)OCCO3 76936679 RZWSZRHTMKKJPU-UHFFFAOYSA-N 274.242 2.252 10 10 CECE CN(C)c1ccc(C=CC(=O)N2CCSCC2)cc1 1963325263 NBWAHKIFXVWMCD-UHFFFAOYSA-N 276.405 2.341 10 10 CECE C[C@H]1OCC[C@@H]1NCc1ccc(Br)cc1O 691427707 FSHCGEKAABOHCT-KCJUWKMLSA-N 286.169 2.422 10 10 CECE COc1ccc(N2C[C@@H](C)NC[C@H]2C(C)C)cc1O 83479501 HJQCGXDIOZYEAR-YPMHNXCESA-N 264.369 2.224 10 10 CECE CCC[C@H](C)CNC(=O)[C@H](N)c1cc(C)ccc1O 83479290 QVPUBEZMTSOEDA-SMDDNHRTSA-N 264.369 2.253 10 10 CECE Oc1cccc(Cl)c1CN[C@@H]1CCCC[C@H]1O 83599845 CUFIQJSEGLBEST-DGCLKSJQSA-N 255.745 2.439 10 10 CECE C[C@@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](C)O1 1171401600 CPIXENHWRJXNGQ-LNLATYFQSA-N 290.323 2.145 10 10 CECE Cc1cc(CN)ccc1N(C)[C@@H](C)c1cn(C)cn1 710489241 QJUHZCFTJFYUSX-LBPRGKRZSA-N 258.369 2.385 10 10 CECE CCCC[C@@](C)(CO)NC(=O)c1cc(O)cs1 1328354732 AKEYJYJYUCGZEQ-LBPRGKRZSA-N 257.355 2.125 10 10 CECE Oc1ccc(CNC[C@H]2CCC3(CCC3)O2)c(O)c1 711515677 MLPZMGCGWFXMBK-CYBMUJFWSA-N 263.337 2.289 10 10 CECE NCCc1ccc2ccn(CC34CC(CO3)C4)c2c1 716085255 OJXIPNZMRWIULC-UHFFFAOYSA-N 256.349 2.322 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCC[C@H]2OC)cc1 687372166 YFKOLCIJYZHPMW-HUUCEWRRSA-N 264.369 2.028 10 10 CECE Nc1ccc(CN2CCO[C@H](C(F)(F)F)CC2)cc1 687571965 AZGNWQGRKGVPHU-LBPRGKRZSA-N 274.286 2.422 10 10 CECE CC[C@@H]1CN[C@H](C2CC2)CN1c1ccc2c(c1)OCO2 86216673 VWDJAECTKNPECK-OCCSQVGLSA-N 274.364 2.382 10 10 CECE c1nc(CCNCc2ccc(N3CCCC3)cc2)c[nH]1 87543044 DLDYPPQDEKMRNZ-UHFFFAOYSA-N 270.380 2.342 10 10 CECE CC[C@@H](C)CN(CC)c1cc2c(cc1N)OCC(=O)N2 93250484 LCAWLWRMBIDKBE-SNVBAGLBSA-N 277.368 2.472 10 10 CECE CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCN=[N+]=[N-] 1963808729 DQFQJUKTLKAROQ-JTQLQIEISA-N 297.359 2.203 10 10 CECE Oc1cccc2c1CN(C(=S)NC[C@H]1CCCCO1)C2 1351769284 GRWRAYLAPNZYQM-GFCCVEGCSA-N 292.404 2.151 10 10 CECE CN(C)c1ccc2c(c1)OCCN2CCOC(F)(F)F 193481814 YYYWSWPRQJFVOQ-UHFFFAOYSA-N 290.285 2.488 10 10 CECE C[C@H]1Cc2cc(C(=O)NCc3ccc(O)cc3O)ccc2O1 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382699050 BWEFGBLPKGJNLP-JKSUJKDBSA-N 298.386 2.272 10 10 CECE CNCc1cc(F)c(N(C)[C@@H]2CC[C@@H]2OC)c(F)c1 724192575 RMVHDFQKDVDOMG-OLZOCXBDSA-N 270.323 2.298 10 10 CECE CN(CCCC(F)F)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2166598726 YYPAXTSJQQJBNQ-GFCCVEGCSA-N 288.269 2.293 10 10 CECE COc1cccc(O)c1CNC1C[C@H](C)N(C)[C@@H](C)C1 2166890388 RGVGHAOGJVEEDF-RYUDHWBXSA-N 278.396 2.362 10 10 CECE CO[C@@H](C1CCOCC1)[C@@H](O)c1ccc(N(C)C)cc1 2163066774 PBWLJSLIMUGWQT-HOTGVXAUSA-N 279.380 2.228 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H](O)c3cscn3)ccc21 2163229754 LRKSUEUYIVNTBR-HUUCEWRRSA-N 289.404 2.259 10 10 CECE CC[C@H](N[C@H]1CNCCC1(F)F)c1ccccc1O 817979572 CATUTYKTUNFHNL-AAEUAGOBSA-N 270.323 2.430 10 10 CECE CC[C@@H]1C[C@@H](NC(=O)NCCc2ccc(N)cc2)CCO1 817878198 RGTJNMFNLDGWBG-LSDHHAIUSA-N 291.395 2.068 10 10 CECE CC(C)CC1(O)CN(c2c(F)cc(CN)cc2F)C1 2131836655 DBERFWMNRUPIOU-UHFFFAOYSA-N 270.323 2.021 10 10 CECE N[C@H]1CCC[C@H]1NCc1ccc(N2CCSCC2)cc1 817887739 DIRASLLKDDEQEU-JKSUJKDBSA-N 291.464 2.209 10 10 CECE Nc1ccc(CCNC[C@@H]2CC[C@@H](C3CC3)O2)cc1 722326059 SBRZAWZMFLGTFX-HOTGVXAUSA-N 260.381 2.359 10 10 CECE OC[C@]12C[C@@H]1CC[C@H]2N[C@@H]1CCc2cccc(O)c21 2132153570 XGZKNBCGSYGLNM-KLZCAUPSSA-N 259.349 2.130 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@@H](C)CC2)cc1O 720431681 LVIHZGIKNUXJTM-RYUDHWBXSA-N 264.369 2.288 10 10 CECE COC(=O)/C=C\c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1 828443151 QXMQHACOVSZXSF-MZBZXASESA-N 294.282 2.329 10 10 CECE CC(=O)c1cc(F)cc(CN2CCC[C@@]23CCNC3)c1O 903864453 VCJRNQADCHAGNN-INIZCTEOSA-N 292.354 2.062 10 10 CECE CN[C@H](C)c1cnc(SC[C@H]2CCCN2)s1 2242786543 ODKWRYDEUFQVHQ-RKDXNWHRSA-N 257.428 2.268 10 10 CECE Cc1cc(CN2CC[C@](O)(C(F)F)C2)ccc1N(C)C 831181533 OLHKVMTWBAZERE-OAHLLOKOSA-N 284.350 2.263 10 10 CECE CC(C)NC(=O)CN(C)C/C=C/c1ccc(N(C)C)cc1 835025070 GFHKRJXZIXKGBR-VOTSOKGWSA-N 289.423 2.222 10 10 CECE CCc1nc(CNCc2c(O)cc(C)cc2Cl)n[nH]1 840948205 BTYWZDQBVUDKBZ-UHFFFAOYSA-N 280.759 2.324 10 10 CECE COc1ccc(N2CC[C@H](NCC3(F)CC3)C2)cc1 850347879 ZNXQXMHYXFHKDX-LBPRGKRZSA-N 264.344 2.366 10 10 CECE CC1(C)CC(NC(=O)/C=C\c2ccc(O)c(O)c2)C1 856337157 HPSAHFAPNPRGGA-XQRVVYSFSA-N 261.321 2.416 10 10 CECE Oc1ccc2ccncc2c1CN1CC[C@@H]2COC[C@@H]2C1 853586982 CJVYXJKYQWTKRY-KGLIPLIRSA-N 284.359 2.409 10 10 CECE O=C(OCc1cn2ccsc2n1)c1cccc(O)c1O 758549091 XYDLVGGGNIYJIS-UHFFFAOYSA-N 290.300 2.164 10 10 CECE CCC1(C(=O)OCC(=O)C(C)=O)CCC(F)(F)CC1 850086954 HKBPVEJUPRWNQN-UHFFFAOYSA-N 276.279 2.293 10 10 CECE CN[C@H](Cc1cnn(C)c1C)c1ccc(N(C)C)cc1 690709536 ZZZXOOIBDNUZMC-MRXNPFEDSA-N 272.396 2.298 10 10 CECE C[C@@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)[C@@H](C)O1 866072868 VXZJWHQRRQWEFO-JMSVASOKSA-N 291.395 2.118 10 10 CECE C[C@@H](CC(=O)NCCc1ccc(O)c(O)c1)n1cccc1 762274490 IMIHZKZOVAPMBC-LBPRGKRZSA-N 288.347 2.209 10 10 CECE COc1ccc(CNC(=O)[C@H](C)c2ccncc2)c(O)c1 867956813 YUIQPJMSRAGSLJ-LLVKDONJSA-N 286.331 2.216 10 10 CECE CCN(C)c1ccc(CN2CCO[C@@](C)(COC)C2)cc1 860203218 ZHNFFTHNQMGXBL-QGZVFWFLSA-N 292.423 2.380 10 10 CECE CCc1cc(C(=O)N2Cc3cccc(O)c3C2)c(C)nn1 871204501 LWHDRSHJZPBLPZ-UHFFFAOYSA-N 283.331 2.209 10 10 CECE CO[C@H](C(=O)N1Cc2cccc(O)c2C1)C1CCC1 871206182 VMHTZWCEFDHHCC-AWEZNQCLSA-N 261.321 2.050 10 10 CECE CC(=O)c1ccc(O)c(CN(C)[C@@H]2CCCC[C@@H]2O)c1 132022090 IDJHHJCQGBRKRU-ZBFHGGJFSA-N 277.364 2.330 10 10 CECE Cc1ccncc1CC(=O)N1Cc2cccc(O)c2C1 871206187 VTBCCOPWXSGEFB-UHFFFAOYSA-N 268.316 2.181 10 10 CECE N[C@H](c1ccc(F)c([N+](=O)[O-])c1O)C(F)(F)F 72195438 JPLLQOALYNKROA-SSDOTTSWSA-N 254.139 2.002 10 10 CECE C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 881431549 UEXIGOHBDHSRAH-MFKMUULPSA-N 297.358 2.324 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)NCc1cccc(O)c1O 1123890427 YPYVBYHWPICJMP-KLHWPWHYSA-N 261.321 2.006 10 10 CECE CN(Cc1cccc(O)c1)Cc1cc(N)ccc1O 1877546692 VXPYFMGHJNZLJQ-UHFFFAOYSA-N 258.321 2.312 10 10 CECE CCNCc1ccc(N2C[C@H]3COCC[C@H]32)c(F)c1 1878819895 UFRUCSRFUUAHPV-GXTWGEPZSA-N 264.344 2.160 10 10 CECE C[C@H]1C[C@@H](O)CN(c2c(F)cc([C@@H](C)N)cc2F)C1 1880928664 QGAHDRPKKCUKCV-IQJOONFLSA-N 270.323 2.192 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H]2CN(CCN=[N+]=[N-])C[C@H]2C1 1957245358 XBWGSFFKHGIOOT-NEPJUHHUSA-N 295.387 2.486 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC[C@H]1c1ncon1 893986784 CPYAJDBLPWADOT-NSHDSACASA-N 281.262 2.391 10 10 CECE COc1nc(N(C)C)sc1CNCc1ccccc1O 134294493 DPNHQISALBSZNO-UHFFFAOYSA-N 293.392 2.213 10 10 CECE C[C@H]1OCC[C@H]1CCN1CCc2cc(CN)ccc21 1885649534 RLWVOKTWRZSJHR-TZMCWYRMSA-N 260.381 2.323 10 10 CECE O=C(NCc1cc(O)ccc1O)c1ccoc1C1CC1 1303225292 FNRCBQNPXSNFMW-UHFFFAOYSA-N 273.288 2.498 10 10 CECE CCN(CC)c1ccc(CN[C@@H](C)COC)c(O)c1 83493315 CDQSYFFTJUALHR-LBPRGKRZSA-N 266.385 2.363 10 10 CECE O=[N+]([O-])c1cc(CNC2CCCCC2)cc(O)c1O 83483619 HAEBYJNWTLIORP-UHFFFAOYSA-N 266.297 2.428 10 10 CECE Oc1ccc(F)cc1[C@@H]1NCCc2c1ccc(O)c2O 83656171 UAHSCQGAGTUMBJ-CQSZACIVSA-N 275.279 2.178 10 10 CECE OCc1ccc([C@H]2NCCc3cccc(O)c32)cc1 83659514 WFOORONQWWEQGL-MRXNPFEDSA-N 255.317 2.120 10 10 CECE C[C@@H](O)c1nc2cc(N)ccc2n1-c1ccc(N)cc1 76080317 JPZSVDXHUFZAFJ-SECBINFHSA-N 268.320 2.243 10 10 CECE COc1cccc(CN(C)C[C@@H]2CC[C@@H](C)O2)c1O 1885290909 BKRYFVJFCZSOLC-YPMHNXCESA-N 265.353 2.400 10 10 CECE COc1cccc(CN(C)[C@H]2CCN(C)[C@@H](C)C2)c1O 93644616 OMZBXQHDPSCQRE-JSGCOSHPSA-N 278.396 2.315 10 10 CECE COC(=O)[C@H]1CCC[C@H]1NCc1cc(Cl)ccc1O 1321866578 GYBVVYLCPDLZPU-NWDGAFQWSA-N 283.755 2.477 10 10 CECE CNCc1ccc(N2CCCN3CCC[C@@H]3C2)c(F)c1 62941324 CRUKHWXRWZFHGU-CQSZACIVSA-N 277.387 2.220 10 10 CECE CCN(C(=O)c1cccnc1OC)c1ccc(N)cc1 63114304 VTJUCXKQEWLPPJ-UHFFFAOYSA-N 271.320 2.339 10 10 CECE CN(C)C1CCC(NCc2cccc(O)c2O)CC1 715534328 RICFSDQMTYFTKD-UHFFFAOYSA-N 264.369 2.060 10 10 CECE C[C@@H](NCC[C@@H](O)C(F)(F)F)c1cc(O)ccc1O 717345081 DQSCKOMXVHVPGL-RDDDGLTNSA-N 279.258 2.062 10 10 CECE C[C@@H](NCC[C@@H](O)C(F)(F)F)c1c(O)cccc1O 717414204 YGTWXIUEBYJPQH-GMSGAONNSA-N 279.258 2.062 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1 718158873 HEFCFQWAHQEOMZ-NVAJDRRBSA-N 258.365 2.320 10 10 CECE CN(C[C@@H]1CCCSC1)c1ccc2c(c1)NC(=O)[C@H]2O 718360322 VFQDFZORONMBBN-HZMBPMFUSA-N 292.404 2.252 10 10 CECE Cc1cc(N2CC[C@H](CN(C)C)C2)ccc1C[C@H](C)N 688525988 DVHGSPPQSFWUMC-LSDHHAIUSA-N 275.440 2.273 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)Cc1ccccc1 692826368 WEGXEIQTNWVIFW-GFCCVEGCSA-N 280.353 2.291 10 10 CECE CO[C@]1(C)C[C@H]1NCc1cccc(Br)c1O 694391139 YYCQFAGDVBJTJU-ZYHUDNBSSA-N 286.169 2.422 10 10 CECE COC(=O)[C@@](C)(NCCCN=[N+]=[N-])c1ccc(Cl)cn1 695214591 VUVLSHNLTIYIKA-LBPRGKRZSA-N 297.746 2.413 10 10 CECE COc1cccc(O)c1CN1CCC[C@@H]2COCC[C@H]21 770285920 LSNBGXOZXUEVOH-TZMCWYRMSA-N 277.364 2.402 10 10 CECE COC(=O)[C@H](CCc1ccccc1)NCCCN=[N+]=[N-] 90259538 WZDDYISALNAJLX-ZDUSSCGKSA-N 276.340 2.451 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1cc(F)ccc1F 90257485 UIFGGTBLTNCCOC-NSHDSACASA-N 284.266 2.469 10 10 CECE Nc1ccc(Cc2nc(-c3ccc(F)cn3)no2)cc1 94043585 QCAGYWGMVFSFIS-UHFFFAOYSA-N 270.267 2.444 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@](C)(N)CC 94234797 UYMXEIQJEUZFLI-MRXNPFEDSA-N 277.412 2.229 10 10 CECE [N-]=[N+]=NCCNC(=O)[C@H]1CCCN(Cc2ccccc2)C1 1963809856 WIGZXAJORWVASP-AWEZNQCLSA-N 287.367 2.325 10 10 CECE CCn1cncc1[C@@H](O)c1ccc2c(c1)CCCN2C 1918712533 WODUVPCIPRNBCJ-INIZCTEOSA-N 271.364 2.367 10 10 CECE CN(c1cc2c(cc1F)[C@@H](O)C(=O)N2)[C@H]1CC1(C)C 2115258558 ILKNOZVXLRCEPO-NWDGAFQWSA-N 264.300 2.046 10 10 CECE CCn1cnc(C(=O)NCc2ccc3cccnc3c2O)c1 1299725142 INDOVZJOBOZOLA-UHFFFAOYSA-N 296.330 2.087 10 10 CECE Cc1ccccc1-c1nnnn1CCOc1ccc(N)cc1 213338450 DDQRZWMGQCUCSL-UHFFFAOYSA-N 295.346 2.310 10 10 CECE CC(C)(C(=O)NCc1cc(O)ccc1O)c1nccs1 1471662080 NGFWSBIHVOVNIJ-UHFFFAOYSA-N 292.360 2.148 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)[C@H]2CCC[C@H]2F)CC1 2118880989 XXXZQEXOSLSZOL-MXWKQRLJSA-N 290.364 2.372 10 10 CECE CN(Cc1cc2c(cc1O)OCO2)[C@@H]1CCC[C@@H]1F 2118944403 BRXMXEZOSOHJFN-WDEREUQCSA-N 267.300 2.443 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)c1ncncc1C 2119030801 KLGFTXUMQDCDKK-HNNXBMFYSA-N 256.353 2.160 10 10 CECE COc1cc(C)c(N(C)C[C@@H]2CCCN2)c(OC)c1 258889747 LGHKLLAVRIBDCL-LBPRGKRZSA-N 264.369 2.200 10 10 CECE Cc1cc(N2CC[C@@](O)(C(C)(C)C)C2)ccc1CO 2120982560 WTISHFWDLQMSBO-INIZCTEOSA-N 263.381 2.475 10 10 CECE C[C@H](NC(=O)c1cc(C=O)cn1C)c1ccccc1O 1557968050 QTDLQIBRPKCHHG-JTQLQIEISA-N 272.304 2.034 10 10 CECE CO[C@@H]1[C@H]2CCN(c3ccc(CN)cc3)[C@H]2C1(C)C 2121830885 JHTPWGHBPZOTBR-RRFJBIMHSA-N 260.381 2.395 10 10 CECE Cc1nc(O)ccc1C(=O)NCc1cccc(Cl)c1O 1637227063 LHVIFUAJDDPUHL-UHFFFAOYSA-N 292.722 2.385 10 10 CECE COc1cc(C)nc(COc2ccc(C)nc2N)c1 214018866 RAOIXQDVYOBVKP-UHFFFAOYSA-N 259.309 2.263 10 10 CECE Cc1ccc(O)c(CNC(=O)c2ccc(CN(C)C)o2)c1 1641732517 DCJKNEXHCXEPJG-UHFFFAOYSA-N 288.347 2.285 10 10 CECE Cc1ccc(C(=O)NCc2cc(O)ccc2O)c(O)c1C 1651222681 MKPOGZAWJYDYHT-UHFFFAOYSA-N 287.315 2.350 10 10 CECE Oc1cccc(F)c1CNCCCN1CCCC1 1964022153 QNALVQBGUVRAPF-UHFFFAOYSA-N 252.333 2.107 10 10 CECE C[C@@H](C1CCOCC1)N(C)Cc1cc(N)ccc1O 2126227362 GQEHYTJGDIWTAA-NSHDSACASA-N 264.369 2.221 10 10 CECE N[C@@H](c1ccccc1O)C(O)(C(F)(F)F)C(F)(F)F 2127483729 JCSQRJKIIVFWAV-ZETCQYMHSA-N 289.175 2.248 10 10 CECE Fc1ccc(/N=N/N2CCN(c3ncccn3)CC2)cc1 1860481686 NRTYNZDYVJOQKD-VHEBQXMUSA-N 286.314 2.437 10 10 CECE COc1ccc(N(C)C[C@@H](C)CCN)cc1OC 258818220 DZPNWJZAGJDNJV-NSHDSACASA-N 252.358 2.125 10 10 CECE Cc1cc(N2C(=O)CCc3cc(N)ccc32)ncc1N 258885142 SJLCFNPQBXMWEP-UHFFFAOYSA-N 268.320 2.165 10 10 CECE COc1ccc(N2CC[C@@H](C)N[C@H](C)C2)cc1OC 251788553 WWLXQVFPIUMHBC-VXGBXAGGSA-N 264.369 2.281 10 10 CECE CC[C@H](CN)CN(C)c1cc(OC)c(OC)cc1C 259106305 XIFXZRURIGSLTF-GFCCVEGCSA-N 266.385 2.433 10 10 CECE C[C@@H]1C[C@H](CO)CN1c1ccc2c(c1)CCC[C@@H]2N 2128274161 NNZAJJQPSKIKLX-WQGACYEGSA-N 260.381 2.230 10 10 CECE N[C@@H]1CCCc2cc(N3CCC(CO)CC3)ccc21 2128276992 IEECFXPPDKWWIB-MRXNPFEDSA-N 260.381 2.231 10 10 CECE CN(Cc1ncccn1)c1ccc2c(c1)CC[C@@H]2N 2128328275 LVYABGMCNGSOCP-AWEZNQCLSA-N 254.337 2.059 10 10 CECE N[C@H]1CCc2cc(N3C[C@@H](O)CC34CCC4)ccc21 2128327288 FOZJTKHUDSAUAZ-ZFWWWQNUSA-N 258.365 2.126 10 10 CECE C[C@@H](O)[C@@H]1CCCCN1c1ccc2c(c1)CC[C@H]2O 2128322185 PPTFZSQUGTYULW-XFBWCDHKSA-N 261.365 2.406 10 10 CECE CO[C@H](CN[C@H](C)c1cc(C)ccc1O)[C@H]1CCOC1 850484236 FPTVYNTYLXHXLD-DVOMOZLQSA-N 279.380 2.403 10 10 CECE COc1ccc(CN[C@H](C)c2ccc(O)cc2O)nc1 1913977299 YDRUTYYDRSTALK-SNVBAGLBSA-N 274.320 2.352 10 10 CECE CCNCc1ccc(N(C)[C@H](CC)CO)cc1OC 2139697988 CJUWSADBADXBRQ-CYBMUJFWSA-N 266.385 2.012 10 10 CECE COc1cc(N2CCO[C@@H](C(C)C)C2)ccc1CN 2139699516 WWIZZLSTPLZRAW-OAHLLOKOSA-N 264.369 2.015 10 10 CECE COc1cc(N2CC[C@H](C)O[C@@H](C)C2)ccc1CN 2139688789 KPAIPRGEWJNXRN-RYUDHWBXSA-N 264.369 2.158 10 10 CECE CCC[C@H](CC(=O)N1CC(N=[N+]=[N-])C1)n1ccnc1 1912193427 OBRQWHZLWHLUAU-LLVKDONJSA-N 262.317 2.136 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 1912159896 OADCUXKYBPHQCO-SNVBAGLBSA-N 275.268 2.049 10 10 CECE CN(CCN=[N+]=[N-])S(=O)(=O)c1cc(F)ccc1Cl 1912188771 QZHSPFLMMJYMTI-UHFFFAOYSA-N 292.723 2.410 10 10 CECE CN[C@H](CCCF)[C@H](O)c1ccc(N(C)C)cc1 1913289994 XGAQJXVCOOBNLR-ZIAGYGMSSA-N 254.349 2.124 10 10 CECE COc1ccccc1C=CC(=O)N(C)CCN=[N+]=[N-] 1912205822 QGOHHPNGCAPGAU-UHFFFAOYSA-N 260.297 2.477 10 10 CECE Nc1ccc(CCN2[C@H]3CC[C@H]2[C@H]2CC[C@@H]3O2)cc1 1901204407 MUTJNQGOEOVQMC-YHUYYLMFSA-N 258.365 2.206 10 10 CECE CCN[C@@H](C)c1ccc(N(C)C(C)(C)C(N)=O)c(F)c1 1915544956 QFDYDCCRNYQGCQ-JTQLQIEISA-N 281.375 2.196 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CC[C@@H](CC(F)F)C3)ccc21 1916725823 YDYJTJKTGPJFJQ-SDBXPKJASA-N 281.306 2.120 10 10 CECE Nc1ccc(NC(=O)CCN2CCC[C@@H]3C[C@H]32)cc1 1916855612 GYRRHWAOYLHKQB-BXUZGUMPSA-N 259.353 2.082 10 10 CECE COCC1CN(c2ccc(CN)cc2C(F)(F)F)C1 1916850145 RJNDRURDHNRPLU-UHFFFAOYSA-N 274.286 2.247 10 10 CECE C[C@@H](N[C@@H](CO)CC1CCOCC1)c1ccccc1O 1967483943 XXEPAKIURWHSEA-TZMCWYRMSA-N 279.380 2.220 10 10 CECE CC[C@H](NCc1cc2c(cc1O)OCO2)c1ncc[nH]1 138880805 GBEPSIHSFVLLGW-JTQLQIEISA-N 275.308 2.085 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@@H](O)C2)c(F)c1 226988791 IHMLDQLYWAZWCG-WCQYABFASA-N 266.360 2.457 10 10 CECE Oc1c(F)cccc1CN[C@@H]1C[C@H]1C1CCOCC1 2135454589 RUOYROJRERIQBO-GXTWGEPZSA-N 265.328 2.436 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2CC3(CCCC3)CO2)cc1 1968570311 NKEVZIYZCXUTQQ-AWEZNQCLSA-N 274.364 2.234 10 10 CECE C[C@H](N)c1ccc(N2CCN(CC(F)F)CC2)cc1 1923133209 QTDWCIAQYCONFG-NSHDSACASA-N 269.339 2.093 10 10 CECE Nc1snnc1-c1nc(-c2ccc(F)c(F)c2)no1 1923202741 SVUDALYLXPOOFJ-UHFFFAOYSA-N 281.247 2.116 10 10 CECE CO[C@@H](CNCc1cccc(F)c1O)[C@H]1CCCOC1 1967744777 BGYKMAUYVWIHOT-JSGCOSHPSA-N 283.343 2.063 10 10 CECE CC1(C)CCCO[C@H]1CNCc1ccc(O)c(O)c1O 1923763869 JVPQKDYOUCWITF-LBPRGKRZSA-N 281.352 2.098 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H](N)CC2(C)C)c1 1925260498 BDGZFXYHPAMMDB-WDEREUQCSA-N 264.369 2.273 10 10 CECE CN(C)c1ccc(CNC[C@H]2CC(F)(F)CO2)cc1 1967823449 YIMPMOIYCOSAPK-CYBMUJFWSA-N 270.323 2.266 10 10 CECE Cc1cccc(CN[C@@H]2CCC[C@H]3CNC[C@H]32)c1O 1967985066 CHTZRORTUDXYQE-NWANDNLSSA-N 260.381 2.178 10 10 CECE C[C@H](NCCc1ncon1)c1ccc(N(C)C)cc1 231796440 CEWNPXJSXLCFDH-NSHDSACASA-N 260.341 2.029 10 10 CECE CN1CCCc2cc(CNCc3ccno3)ccc21 231882179 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CECE COc1ccc(N(C)[C@H](C)CNC[C@H]2CCCO2)cc1 2279038988 OSILJIKLIBTBSZ-CZUORRHYSA-N 278.396 2.289 10 10 CECE O=C(O)[C@H]1CC[C@H](CNCc2cc(Cl)ccc2O)OC1 2279414101 JNBOPTCROHJLRP-JOYOIKCWSA-N 299.754 2.015 10 10 CECE Cc1cc(N2CC[C@@H](O)C3(CC3)C2)ccc1[C@@H](C)O 2269672684 PXVKWUSPHBEWIR-IUODEOHRSA-N 261.365 2.400 10 10 CECE CSc1ncc(CNC[C@@H]2C[C@@H]3CC[C@H]2N3)s1 2298469739 NSVXXRBCEQMQRB-ATZCPNFKSA-N 269.439 2.095 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1c[nH]nc1C1CC1 2284636427 ZQIQGVICCYUDDJ-UHFFFAOYSA-N 270.336 2.142 10 10 CECE Cc1cc(N2C[C@@H]3CN(C)C[C@]3(C)C2)ccc1[C@@H](C)O 2285161956 DYSMFQROABMFCA-JKIFEVAISA-N 274.408 2.436 10 10 CECE CCNC(=O)[C@@H]1CCCN1c1ccc([C@H](C)O)c(C)c1 2285157042 GESZGDIPGOBNOX-WFASDCNBSA-N 276.380 2.153 10 10 CECE COc1cccc(CN2C[C@@H](CC(=O)O)C[C@@H]2C)c1O 2285693623 HPSOHJYXKQYLNL-WDEREUQCSA-N 279.336 2.086 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCCO2)[C@@H]1C[C@H]1C(=O)O 2296549620 AWTBMTXWDLZIDX-DDTOSNHZSA-N 275.348 2.210 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2c(N)cc(F)cc2F)CC1 2286942365 DKOREAUTIALSKK-UHFFFAOYSA-N 281.266 2.367 10 10 CECE C[C@@]12CC[C@@](C)(CN1c1ccc3c(c1)NC(=O)[C@@H]3N)C2 2287584526 GXDUCHAJPWUQSM-BMFZPTHFSA-N 271.364 2.407 10 10 CECE COCCN(C[C@H](C)O)c1ccc(CNC(C)C)cc1 2288061579 SMSUAPORFHQECN-AWEZNQCLSA-N 280.412 2.018 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C12COCC(C1)C2 2288792398 NUGFJNIECNZPIN-FZWSLVFFSA-N 275.348 2.338 10 10 CECE C[C@H]1CC[C@@H](C(=O)N(C)[C@H](C)c2ccccc2O)O1 2296763721 MGDRLPAMRPDDRM-WDMOLILDSA-N 263.337 2.479 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c(Cl)c1 2309943423 ZELZTQKTKJRVEX-QYAIJTBZSA-N 267.756 2.353 10 10 CECE CCN(CCN=[N+]=[N-])C[C@H](O)c1ccccc1F 2315993256 ZCHNGEUIXQXEFF-LBPRGKRZSA-N 252.293 2.491 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2Cc1cc(F)ccc1O 2318331833 HXXKWIQIMCJJSF-VHRBIJSZSA-N 251.301 2.141 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@@H]3C[C@H]2CO3)cc1Cl 2328572524 ZGLZNLVKBSQEHX-RYUDHWBXSA-N 279.723 2.415 10 10 CECE OC[C@]12CC[C@H](C[C@@H]1NCc1c(O)cccc1F)C2 2329386183 AHDIKAVTLGBMNV-WKPIXPDZSA-N 265.328 2.172 10 10 CECE CN1CCc2cc([C@H](N)[C@H]3C[C@@H]4C[C@@H]4CO3)ccc21 2331063073 SNPYNRSPESWIIN-XNISGKROSA-N 258.365 2.104 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@H]2OC[C@@H]3CCC[C@H]23)C1 2333520505 MTOOBUWPURGUOI-BJDJZHNGSA-N 264.329 2.103 10 10 CECE Oc1cccc(CNC[C@@H]2CC[C@H]3C[C@@H]2CO3)c1O 2334119538 IDRUUUAAAGFOQA-UHTWSYAYSA-N 263.337 2.003 10 10 CECE CC[C@@]1(C)NCC[C@@H]1NCc1ccc2c(c1)CCO2 2336805549 LNZZQTNEHKBTPQ-JKSUJKDBSA-N 260.381 2.242 10 10 CECE C[C@]12C[C@H](C1)[C@H](NCc1ccc(F)c(F)c1O)CO2 2337754190 AUOMSAXKEVLWGT-UDZFHETQSA-N 269.291 2.328 10 10 CECE Cc1cc(CN)ccc1N1C[C@H]2CC(O)C[C@@H](C2)C1 2338879186 LHOZKWNXPBDZBP-ZIAGYGMSSA-N 260.381 2.051 10 10 CECE CCOC(=O)[C@H](CCCCOC)NCCCN=[N+]=[N-] 2340996523 FBQYQTZSRYNALQ-NSHDSACASA-N 272.349 2.025 10 10 CECE Oc1cccc(N2CCc3cc(O)c(O)cc3C2)c1 2341204731 KLVSTQBWMRNMJT-UHFFFAOYSA-N 257.289 2.366 10 10 CECE C[C@@H]1C[C@H]1[C@](CSc1nccs1)(NC1CC1)C(=O)O 2353008101 SHQDVTNCDLUNBL-JQEORGNBSA-N 298.433 2.467 10 10 CECE CSc1cc(N2CC[C@@H](O)C23CCC3)ccc1CN 2353861197 QLHOPOURDSMUMM-CQSZACIVSA-N 278.421 2.361 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H](OC)[C@@H]2COC[C@@H]21 2354362739 MONFCFLMCVWMMW-HGTKMLMNSA-N 277.364 2.189 10 10 CECE Cc1ccc(O)c([C@@H](C)N2C[C@@H]3C[C@H](C(=O)O)[C@@H]3C2)c1 2355438196 PXGJULHGTKNQDS-UVLXDEKHSA-N 275.348 2.414 10 10 CECE CC(C)CCNC(=O)[C@@H](C)Cc1ccc(O)c(O)c1 170245476 RVORHZYZDNTCKP-NSHDSACASA-N 265.353 2.439 10 10 CECE COc1ccc(N2CCOCC2)cc1NC(=O)C1CCC1 62191322 ZVPDBVXNXNTCAI-UHFFFAOYSA-N 290.363 2.270 10 10 CECE CSCCC(=O)N1CCOc2cc(N(C)C)ccc21 173184985 ZPLLXCRKICVEKN-UHFFFAOYSA-N 280.393 2.231 10 10 CECE C[C@H](NCCc1cn(C)cn1)c1cc(F)ccc1O 313251094 HZMACTUTAASJFA-JTQLQIEISA-N 263.316 2.158 10 10 CECE CC(C)(C)c1cnc(S[C@@H]2CCNC2=O)s1 179093720 IBIVPZVBYHZIRL-SSDOTTSWSA-N 256.396 2.421 10 10 CECE Nc1ccc(CNC(=O)Cc2noc3ccccc23)cc1 37666235 SSWZSYLJDCFFJH-UHFFFAOYSA-N 281.315 2.269 10 10 CECE O=C(O)c1sccc1CNCc1ccccc1O 236481289 MBFPSBRZTCWAFC-UHFFFAOYSA-N 263.318 2.442 10 10 CECE Nc1ccc(CCCSc2nccc(O)n2)cc1 122879872 OGHXQXOFWXFNNB-UHFFFAOYSA-N 261.350 2.489 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CCC(C)(C)C1 129730626 VSCMENLEUQBHAM-GFCCVEGCSA-N 254.334 2.398 10 10 CECE CNC[C@@H]1CN([C@@H]2C[C@@H](C)c3c(C)ccc(O)c32)CCO1 125168832 GTQWBYSQOZYMJV-MGPQQGTHSA-N 290.407 2.169 10 10 CECE C[C@@H]1CN(c2ccc(CN)cc2Br)CCN1C 212879837 OFSYTELUMDDPJF-SNVBAGLBSA-N 298.228 2.048 10 10 CECE CCOCCN(CCOCC)CCOc1ccc(N)cc1 124786720 IMLFVYNKSSOHDY-UHFFFAOYSA-N 296.411 2.023 10 10 CECE CC[C@@H]1CN(c2ccc([C@@H](C)N)cc2F)CCO1 36770092 AGBWGLMOAHZQCR-ZYHUDNBSSA-N 252.333 2.461 10 10 CECE COCCN1CCC(CN[C@@H](C)c2ccccc2O)CC1 183484719 IYYFIRZAICKBQG-AWEZNQCLSA-N 292.423 2.401 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H](C)O)cc1Cl 78907876 CSROSMUIGLFCHT-VHSXEESVSA-N 256.777 2.437 10 10 CECE CN1CCc2cc(CN[C@H]3CCC[C@@H](C(=O)O)C3)ccc21 226441762 BZBFGZVFECUHBK-CABCVRRESA-N 288.391 2.412 10 10 CECE CCCCC[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 40461665 BXQQQURABWEJLK-YPMHNXCESA-N 294.395 2.053 10 10 CECE CCO[C@@H]1CCCN(c2ccc(CN)c(F)c2)C1 135224302 SBRHJMWLKIWSFR-CYBMUJFWSA-N 252.333 2.290 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NS(=O)(=O)C1CC2(CCC2)C1 2225799031 JDGZUKCRFUZGAO-WDEREUQCSA-N 284.385 2.470 10 10 CECE Nc1ccc(NC(=O)NCCc2ccncc2)cc1 48262691 ONVRBSKZNSRFIC-UHFFFAOYSA-N 256.309 2.028 10 10 CECE Oc1ccc(CNc2cccnc2Cl)c(O)c1O 83493429 JLSOXPCXSJPMEU-UHFFFAOYSA-N 266.684 2.464 10 10 CECE CCCN(Cc1cc(Br)ccc1O)C1CNC1 233070217 ATAWSPUPNJCYMX-UHFFFAOYSA-N 299.212 2.339 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])c1ccc(C)cc1 90257114 ZROMVABQSTXVOO-ZDUSSCGKSA-N 262.313 2.283 10 10 CECE O=C1CC[C@@H](c2cccc(Br)c2O)N1 238711110 HCGLDOPLUNFXNH-QMMMGPOBSA-N 256.099 2.106 10 10 CECE COC(=O)C[C@@H](C)N[C@@H](C)c1ccc(C)cc1O 385464141 IRSHGJGOHATAMO-MNOVXSKESA-N 251.326 2.303 10 10 CECE Cc1ccc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]23)c(O)c1O 248413928 LYLPIHOEKSFHSY-CYZMBNFOSA-N 291.347 2.094 10 10 CECE CCNCc1cc(F)c(N2CCN3CCC[C@H]3C2)c(F)c1 250171879 JFBPWMJXMKVFPK-ZDUSSCGKSA-N 295.377 2.359 10 10 CECE CC(C)NC[C@H]1CCN(c2ccc3c(c2)OCCO3)C1 53012160 DTKYPUFQEUBPCT-CYBMUJFWSA-N 276.380 2.282 10 10 CECE CCNCc1ccc(N(C)[C@H]2CCCN(C)C2)c(F)c1 53246549 MJVFJRQVTNSFFZ-AWEZNQCLSA-N 279.403 2.466 10 10 CECE CN[C@@H](C)c1ccc(N2CCCO[C@H](C)C2)cc1O 251840872 QLJSFLDQPJECCO-NEPJUHHUSA-N 264.369 2.288 10 10 CECE CSC[C@@](C)(O)CNCc1cc(Cl)c(F)cc1O 293575633 JJASPRKTEKEJKX-LBPRGKRZSA-N 293.791 2.388 10 10 CECE CCCN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)[C@@H](C)OC 2163138876 RQQZRUCEONJCJX-WQVCFCJDSA-N 280.412 2.189 10 10 CECE CC(C)COC[C@@H](NN)c1ccc2c(c1)CCCN2C 2165568709 KUDVXEYPDPLOBG-OAHLLOKOSA-N 277.412 2.246 10 10 CECE Cc1cc(N2CC[C@](CO)(C(F)(F)F)C2)ccc1CO 2167689526 HTHMQBDKMULCFH-ZDUSSCGKSA-N 289.297 2.238 10 10 CECE CCn1ccnc1[C@@H](NC)c1ccc2c(c1)CCN2C 2164137061 FIMYDONKMRBGEU-HNNXBMFYSA-N 270.380 2.204 10 10 CECE Cc1cc(NS(=O)(=O)c2cccc(N)c2)c(C)cc1O 722227081 REVBZORWLYAAMV-UHFFFAOYSA-N 292.360 2.392 10 10 CECE CCC1CC([C@H](N)[C@H](O)c2ccc3c(c2)CCN3C)C1 2167552081 AZGRBHPVNHVALP-DMJNXXHZSA-N 274.408 2.476 10 10 CECE CNC(=O)[C@@H]1CCCN1c1ccc([C@@H](C)NC)cc1Cl 723189840 TVKBKTPHODMINT-YGRLFVJLSA-N 295.814 2.335 10 10 CECE CN[C@@H](COC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 2163075129 ZJCGDOSRDCPVLW-CJNGLKHVSA-N 278.396 2.066 10 10 CECE CC[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 817175294 OSDWUNBHIZZLQN-QWHCGFSZSA-N 278.352 2.149 10 10 CECE CCN(C[C@H]1CCCCNC1=O)c1ccc(N)cc1 721093587 LWFNEUFJOKZEEJ-GFCCVEGCSA-N 261.369 2.011 10 10 CECE CN[C@@H](Cc1nn(C)cc1C)c1ccc(N(C)C)cc1 724001582 CWFPXEXEHGEWRM-INIZCTEOSA-N 272.396 2.298 10 10 CECE COc1ccc(N2CC[C@H](NCC[C@H]3CCOC3)C2)cc1 826845103 FPBNOKHQOLBTOH-GJZGRUSLSA-N 290.407 2.290 10 10 CECE CCCn1cc(NC(=O)CCc2ccc(N)cc2)cn1 722379528 VQTPPFALDCACHF-UHFFFAOYSA-N 272.352 2.447 10 10 CECE CCCN(CC(=O)N(C)C)c1ccc([C@H](N)CC)cc1 723188951 INJPDGUVIWXANM-OAHLLOKOSA-N 277.412 2.401 10 10 CECE COc1cccc(CNC(=O)N[C@@H]2CC[C@H]3C[C@H]3C2)c1O 828502676 OTTQTBNCNZUCOE-WCFLWFBJSA-N 290.363 2.389 10 10 CECE CC(C)N(CCO[C@@H]1CCOC1)Cc1ccc(N)cc1 724959816 OBDFQVRVVUTWMX-MRXNPFEDSA-N 278.396 2.285 10 10 CECE COC[C@](C)(CCO)NCc1cc(Cl)c(C)cc1O 825330775 CPWOUORKYCAHSN-AWEZNQCLSA-N 287.787 2.231 10 10 CECE CC[C@@](C)(CO)C(=O)NCCCSc1nccs1 847487856 MJMLIILLARVHLR-LBPRGKRZSA-N 288.438 2.150 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1(C(F)F)CC1 843851172 JOQUJNMWFANIKL-QMMMGPOBSA-N 285.290 2.190 10 10 CECE CO[C@H](COc1ccc(N(C)C)cc1)[C@@H]1CCOC1 853693606 RSCOYBBWCDORGR-IUODEOHRSA-N 265.353 2.183 10 10 CECE COC[C@H](CNC(=O)NCc1cc(C)ccc1O)C(C)C 927595901 HWQKHTUSPCIHAJ-AWEZNQCLSA-N 294.395 2.418 10 10 CECE Nc1ccc(C[C@H](O)[C@@H]2CCc3cccnc32)cc1 696581608 SIUFBCWVTVICER-GJZGRUSLSA-N 254.333 2.297 10 10 CECE COc1ccc(N2CC[C@H](N[C@H]3CCSC3)C2)cc1 850489941 YMQXUNBGUSJFGN-STQMWFEESA-N 278.421 2.369 10 10 CECE C[C@H](O)c1ccc(N2CC(N3CCCC3)C2)c(F)c1 697792840 NYMHFTHDULROFP-NSHDSACASA-N 264.344 2.163 10 10 CECE CCN(CC1CC1)S(=O)(=O)N[C@@H](C)c1ccccc1O 867836548 XHUGPVDXIHZPIY-NSHDSACASA-N 298.408 2.020 10 10 CECE COc1ccc(N2CC[C@@H](NCc3ccc(O)nc3)C2)cc1 865621988 IDSAVQIIKGNECU-CQSZACIVSA-N 299.374 2.164 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@]12C[C@H]1COC21CCC1 934704935 LIOANDJITIRESN-GUYCJALGSA-N 287.359 2.310 10 10 CECE C[C@H](C(=O)N1Cc2cccc(O)c2C1)C(F)(F)F 871202375 FYMWXIUWVCUQIN-SSDOTTSWSA-N 259.227 2.433 10 10 CECE O=C(NCc1cccc(O)c1O)[C@]12CCCC[C@@H]1C2 1123978590 VFYWLXSAUYFXOS-ABAIWWIYSA-N 261.321 2.294 10 10 CECE C/C(=C\C(=O)N(C)c1cnccc1C)c1cnccn1 1127824340 AUTPTEQFKDRIAO-XYOKQWHBSA-N 268.320 2.246 10 10 CECE Cc1sc(NN)nc1CN(C)Cc1ccccc1O 1877525993 VSLYDVWBZCGVLD-UHFFFAOYSA-N 278.381 2.075 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1CCCC2(CC2)C1 1879775611 JNQPDPUUMPVQPW-GHMZBOCLSA-N 266.345 2.398 10 10 CECE C[C@H](NC[C@]12CCOC[C@@H]1C2)c1ccc(O)cc1O 1880195622 NXELEUKQYWDYSY-ZIBATOQPSA-N 263.337 2.175 10 10 CECE CN(C)c1ccc([C@H](C2CC2)N2CCNCC2)cc1 76818441 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10 10 CECE COCC(CCN[C@H]1CCc2cccc(O)c21)COC 2187538208 HRYFALVBNPDXKL-AWEZNQCLSA-N 279.380 2.268 10 10 CECE CN1[C@H]2CCC[C@H]1CN(c1c(F)cc(CN)cc1F)C2 2187621152 JNMRMUZEYJPOPJ-RYUDHWBXSA-N 281.350 2.096 10 10 CECE CCCCN(c1cc2c(cc1N)OCCO2)C1COC1 2197400560 LDKSOFRULVPJSH-UHFFFAOYSA-N 278.352 2.045 10 10 CECE C[C@H](F)[C@H]1CCCN1c1ccc2c(c1)N(C)C(=O)[C@H]2O 2181088343 CVNFCQOPQIYEKB-BHYNMZESSA-N 278.327 2.023 10 10 CECE Cc1nc(N(C)Cc2ccccc2O)ccc1C(=N)N 2192588943 DESGTBJURLTBGW-UHFFFAOYSA-N 270.336 2.016 10 10 CECE C[C@H](NC(=O)[C@@H](C)C1CCNCC1)c1ccccc1O 2192630531 XNASHUJMFHOQKW-RYUDHWBXSA-N 276.380 2.205 10 10 CECE C[C@@H](Nc1ccc(C(N)=O)cc1N)c1ccccc1O 2192627746 MYVYCGFSYWUWAO-SECBINFHSA-N 271.320 2.246 10 10 CECE Cc1cc(N(C)C2CC3(COC3)C2)ccc1C[C@H](C)N 2182206005 XTIQGWYDTYYSOG-ZDUSSCGKSA-N 274.408 2.500 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H]3[C@@H]2CN)cc1Cl 1911231553 SGFYTXDPRRYOSY-PEXQALLHSA-N 252.745 2.132 10 10 CECE C[C@@H](CCC1CC1)N(C)C(=O)c1cc(O)c(O)c(O)c1 2188874255 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2.279 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)[C@@H]1CNCC1(C)C 2274228714 YPYDVXUTJCOGFM-ZWNOBZJWSA-N 264.369 2.089 10 10 CECE CC(C)[C@]1(C(=O)O)C[C@@H]1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2234171512 MPAXTHPLQXTJML-GIPNMCIBSA-N 280.328 2.035 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1ccc2cncn2c1 2234166543 OBICBTPWFAPKTO-NEPJUHHUSA-N 270.296 2.296 10 10 CECE C[C@H](O)CN(C[C@@H](C)O)c1ccc(OC2CCC2)cc1 2234885174 HLUWXBQQVFWYLA-BETUJISGSA-N 279.380 2.186 10 10 CECE COc1ccc(N2C[C@H](CO)OC3(CCC3)C2)c(C)c1 2235090792 XXSUVHUGEJLXKV-CQSZACIVSA-N 277.364 2.124 10 10 CECE C[C@@H]1Cc2cc(N3[C@H]4CC[C@H]3[C@@H](F)[C@@H](O)C4)ccc2O1 2235060809 FFTGMVYLGZQKMB-SRUFKNRCSA-N 277.339 2.450 10 10 CECE CC(C)Oc1ccc(N2CCC([C@H](O)CO)CC2)cc1 2235113204 NMKJVNYNEPZHAZ-MRXNPFEDSA-N 279.380 2.043 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H]2C[C@]3(C)O)c(C)c1 2225425014 GCFTZRZZURXEOM-BMFZPTHFSA-N 260.381 2.064 10 10 CECE COc1ccc(N2CC[C@@H](OC)C2(C)C)c(CCN)c1 2235968801 WBENAFGATKCRJZ-OAHLLOKOSA-N 278.396 2.200 10 10 CECE 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10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)Cc1ccccc1O 2225800697 RTHPCCFWHCKFLJ-GHMZBOCLSA-N 260.297 2.282 10 10 CECE CN(Cc1ccc(C(=O)O)cc1)Cc1ccc(O)c(O)c1 86725505 ZGYBHOCNVOWNCA-UHFFFAOYSA-N 287.315 2.428 10 10 CECE Cc1ncc(CNC(=O)Nc2ccc(N)cc2)s1 49539213 PCELFETTXRGKRL-UHFFFAOYSA-N 262.338 2.355 10 10 CECE CN1CCc2cc(CNCCC(=O)NC(C)(C)C)ccc21 135426545 PXYHJKKWVVHVBU-UHFFFAOYSA-N 289.423 2.073 10 10 CECE Cc1cc(C[C@H](N)C(=O)O)c(C)n1-c1ccccc1 44283790 MTKSAJPVUFWPBP-AWEZNQCLSA-N 258.321 2.049 10 10 CECE Cc1cc(Br)c(O)c(CN[C@H](C)[C@@H](C)O)c1 381770043 WAXDTESHGJGXCX-RKDXNWHRSA-N 288.185 2.322 10 10 CECE CCNCc1ccc(N(C)CC(C)(C)O)c(C)c1 92970914 QKUGSBFXUINWNE-UHFFFAOYSA-N 250.386 2.312 10 10 CECE CN[C@H](C)c1ccc(N2CCN3CCCC[C@@H]3C2)cc1O 94439671 UNPLFJQLGHCUJO-UKRRQHHQSA-N 289.423 2.347 10 10 CECE COC(=O)C(C)(C)CN(C)c1ccc(OC)cc1 93718313 KZDWKTBYNZCGIA-UHFFFAOYSA-N 251.326 2.331 10 10 CECE COC[C@H](C)N(C)[C@H](C)c1ccc(OC)cc1O 250984186 JNYOTEDBIHXLDL-WDEREUQCSA-N 253.342 2.429 10 10 CECE CC[C@H](c1ccccc1O)N1CC[C@H](CS(C)(=O)=O)C1 368351861 LSFDXTNWCWEPLX-GXTWGEPZSA-N 297.420 2.210 10 10 CECE C[C@H](NCC1(C)OCCCO1)c1cc([N+](=O)[O-])ccc1O 277101389 HBCAINVKUQRSTG-JTQLQIEISA-N 296.323 2.104 10 10 CECE CC/C=C\CNC(=O)c1ccn(-c2ccc(N)cc2)n1 385042200 RJWBNMASYJDJNT-ARJAWSKDSA-N 270.336 2.151 10 10 CECE COC(OC)[C@H](C)N(C)Cc1cc(C(C)=O)ccc1O 2165112225 NAVBVXSDJWFIJM-JTQLQIEISA-N 281.352 2.034 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@]12CCNC[C@H]1C2 2163105996 HQDFXJUQLWXPSD-DJIMGWMZSA-N 272.392 2.320 10 10 CECE CN(C)c1ccc([C@@H](N)C2(O)CC(C(F)(F)F)C2)cc1 2163130995 MXHDHAGZHWUHJC-YXMLORGKSA-N 288.313 2.456 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)C1[C@H]2COC[C@H]12 2163133470 NBANBTAYCWZUMA-GRDNDAEWSA-N 272.392 2.222 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCc2ccc(F)cc21 2163762342 QGUCWDVNHCWBKR-ZDUSSCGKSA-N 278.287 2.342 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CC2(CC2)CO1 2166445774 YUFPKWOHDIVIQX-BXUZGUMPSA-N 275.348 2.481 10 10 CECE CCCN[C@H](C)c1ccc(N(C)CCC(=O)NC)cc1 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Oc1ccc(OC(F)(F)F)cc1CNC[C@H]1CCO1 2336028051 OZUPMSMRPICTBV-SNVBAGLBSA-N 277.242 2.169 10 10 CECE CSc1cc(N(C)[C@@H]2CO[C@H]3C[C@@H]2C3)ccc1CN 2353858689 OWJLFZNQODKTKG-KWCYVHTRSA-N 278.421 2.481 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@@H]2NC(=O)Nc1ccc(N)cc1 2354403169 ZDGBINUFEUZOOH-XYHOJCAOSA-N 275.352 2.204 10 10 CECE CN1CCCc2cc([C@H](O)[C@H]3C[C@H](N)[C@@H]4C[C@H]34)ccc21 2354907248 TZQBGVRXLKRSEB-PFFSRIRZSA-N 272.392 2.086 10 10 CECE CO[C@@]1(C)C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(O)c(O)c1 2356194078 ATOKEIXNANGTQA-QCQGSNGOSA-N 277.364 2.391 10 10 CECE C[C@H](CC(=O)N(C)C)NCc1c(O)cccc1Cl 311196362 GKOJQTKJRRSTEB-SECBINFHSA-N 270.760 2.002 10 10 CECE COC[C@@H](NC(=O)OC(C)(C)C)c1cccc(N)c1O 1952931473 REEPZZZEKBLXLY-LLVKDONJSA-N 282.340 2.187 10 10 CECE COCCN(CCOC)c1ccc(CNC2CC2)cc1C 50561103 GCFRYSVFWLZGCR-UHFFFAOYSA-N 292.423 2.346 10 10 CECE CCN[C@@H](C)CC(=O)N(CC)Cc1ccc(N(C)C)cc1 61272079 YHFIYHTYRGKFCQ-AWEZNQCLSA-N 291.439 2.489 10 10 CECE Cc1cc(N2CCC(N)CC2)ccc1OC[C@H]1CCOC1 63063362 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272.392 2.100 10 10 CECE COc1ccc(OC(C)=O)c2c1C(=O)c1ccccc1C2=O 34743509 JMMWROAXMUIHMT-UHFFFAOYSA-N 296.278 2.396 10 10 CECE COc1ccc(N2CCN(CC[C@H](N)C(C)C)CC2)cc1 136527339 YVCBDPOWUJMBLX-KRWDZBQOSA-N 291.439 2.191 10 10 CECE Cc1cc(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])nnc1C 2225792475 NMVSREVEKBKFAR-UWVGGRQHSA-N 260.301 2.055 10 10 CECE CCN(C[C@@H]1CCCO1)c1ccc(CN)c(F)c1 135223011 AUATVBWOXHFHSB-ZDUSSCGKSA-N 252.333 2.290 10 10 CECE [N-]=[N+]=NCCNC(=O)c1ccc(Br)cc1 42012086 YUISZZWWUPDSPH-UHFFFAOYSA-N 269.102 2.489 10 10 CECE Cc1noc(C)c1[C@H](C)NC(=O)COc1ccc(N)cc1 92324014 NQKXAKPJVKNDKZ-VIFPVBQESA-N 289.335 2.130 10 10 CECE CN(C)[C@H]1CCCN(c2ccc(CN)c(Cl)c2)C1 91395402 MKOGAGJCSQAYFG-ZDUSSCGKSA-N 267.804 2.329 10 10 CECE Cn1nccc1CCC(=O)CCc1ccc(N)cc1 230960354 AYGJITCWTKDGIC-UHFFFAOYSA-N 257.337 2.137 10 10 CECE CCNCc1ccc(N2CCC[C@@H](CO)C2)cc1C 50582450 XPMVIIDEIAABTF-CQSZACIVSA-N 262.397 2.313 10 10 CECE C[C@H](N)[C@H]1CCN([C@H](C)c2cc(F)ccc2O)C1 252789908 RYQNPOFSPFUASN-AXFHLTTASA-N 252.333 2.261 10 10 CECE N[C@H](CCC(=O)O)c1cc(Br)c(F)cc1O 258459648 GYJOIQRMYLRPBH-MRVPVSSYSA-N 292.104 2.158 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@H](C)Cn2cncn2)c1 273359265 ACUFWHADJCXYEG-VXGBXAGGSA-N 260.341 2.031 10 10 CECE C[C@@H](c1ccccc1O)N1CCC(OCCCN)CC1 94070318 GHPYPPVDPZYOPT-ZDUSSCGKSA-N 278.396 2.283 10 10 CECE CC(C)C[C@@H](CO)N(C)Cc1cccc(F)c1O 290492728 OQLLPCQIYRKKFM-LBPRGKRZSA-N 255.333 2.370 10 10 CECE C[C@@H]1CCNC[C@]1(O)c1ccc(N2CCCCC2)cc1 2163640014 FVYRYSOSFOQPSS-RHSMWYFYSA-N 274.408 2.494 10 10 CECE CC(=O)C(=O)COC(=O)c1cnccc1Oc1ccccc1 808548070 HYLBGJQQUXNXNB-UHFFFAOYSA-N 299.282 2.189 10 10 CECE CC[C@@H](NCc1cc(C)ccc1O)[C@H](O)C(F)F 294989579 HIMCAUZCVNQYBX-PWSUYJOCSA-N 259.296 2.195 10 10 CECE COc1ccc(CNC[C@]2(O)CCC[C@@H](C)C2)c(O)c1 96480085 RZBZAEUJTSXPGS-WBMJQRKESA-N 279.380 2.432 10 10 CECE COc1cccc(CN2[C@H](CN)C[C@@H]3CCC[C@@H]32)c1O 2164800886 LGKDKLSBBUWYMS-UBHSHLNASA-N 276.380 2.103 10 10 CECE CN1CC[C@@H](NC(=O)Nc2ccc(N)cc2)C(C)(C)C1 2162870292 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C[C@@H](N)c1ccc(N(C)Cc2ccn(C)n2)c(F)c1 723521870 QRVZPPWYMIQSKW-SNVBAGLBSA-N 262.332 2.215 10 10 CECE CN1CCc2cc([C@]3(O)CCCNC3(C)C)ccc21 2131912857 VTEDDXLWLOLNAT-MRXNPFEDSA-N 260.381 2.029 10 10 CECE C[C@@]1(CCO)CCN(c2c(F)cc(CN)cc2F)C1 2131915202 CFKBHJZXFONWMI-AWEZNQCLSA-N 270.323 2.022 10 10 CECE CNCc1ccc(N2CC[C@H]3OCC[C@@H]3C2)c(F)c1 724836600 SYUGPNGUNZRWCE-IUODEOHRSA-N 264.344 2.160 10 10 CECE Cc1cc(O)c(CN[C@@H]2CNC[C@H]2C)c(Cl)c1 903964528 KPZVVYSUCUFBTK-BXKDBHETSA-N 254.761 2.052 10 10 CECE Cc1cc(O)c(CN[C@H](C)[C@@H](C)CO)cc1Cl 825297702 LHFZXYACTHRGIC-VHSXEESVSA-N 257.761 2.461 10 10 CECE CC(C)[C@@H](O)CNC/C=C\c1ccc(N(C)C)cc1 835039787 LMCXQXREDIOFEL-KJPDOMRESA-N 262.397 2.372 10 10 CECE C[C@H](N)CCC(=O)NCc1c(O)ccc2c1CCCC2 830597661 SHMWCWGAGGDBMB-NSHDSACASA-N 276.380 2.015 10 10 CECE Oc1ccc(Br)cc1CNCC[C@H]1CCNC1 841034440 BDRMUMCZDDEKBB-SNVBAGLBSA-N 299.212 2.244 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCC[C@H](CO)C2)cc1 387940229 ILAGWDGJSJTDSP-LSDHHAIUSA-N 262.397 2.393 10 10 CECE CCN(CC)c1ccc(CNC(=O)C2(OC)CC2)cc1 843531830 JISQCCGYEYGCOE-UHFFFAOYSA-N 276.380 2.328 10 10 CECE COCc1n[nH]c(CN[C@@H](C)c2c(C)cc(C)cc2O)n1 850513205 FPNUDFQWOMHKSM-NSHDSACASA-N 290.367 2.124 10 10 CECE CN(CCO)c1ccc(CNC(=O)OC(C)(C)C)cc1 1954668893 FCXZZHRVWFKSFH-UHFFFAOYSA-N 280.368 2.140 10 10 CECE Cc1ccc(C(=O)NN2C[C@H]3CCC[C@@H](C3)C2)c(O)c1O 921773429 SSXOUBSSLCOTRH-RYUDHWBXSA-N 290.363 2.173 10 10 CECE CC[C@H](NC[C@@H](O)[C@@H]1CCCO1)c1ccc(N(C)C)cc1 858468184 CNYSOVUMKGMPSJ-BBWFWOEESA-N 292.423 2.333 10 10 CECE O=C(NCc1c(O)cccc1F)[C@]1(Cl)C[C@H]2CC[C@H]1O2 928708310 FKNMURAPFDCOEH-RGZBUGHASA-N 299.729 2.076 10 10 CECE Nc1ccc(OC[C@]23C[C@](C(F)F)(CO2)C3)cc1 2255008376 IPNRGJWEZQOKCB-JOCQHMNTSA-N 255.264 2.462 10 10 CECE COC[C@@H](CCN[C@@H](C)c1cc(F)cc(F)c1O)OC 850485167 CAYHKRJGDKFMHK-GXSJLCMTSA-N 289.322 2.373 10 10 CECE C[C@@]1(C(=O)NCc2ccc3cccnc3c2O)CCCO1 862026907 COUJOAWFFMJXBC-INIZCTEOSA-N 286.331 2.126 10 10 CECE C[C@H](NC(=O)c1nnc(C2CC2)o1)c1ccccc1O 866160738 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C[C@@H](c1ccccc1O)N(C)C(=O)C1(C)CCNCC1 62840839 VEZUWYUMCCTIQV-LBPRGKRZSA-N 276.380 2.301 10 10 CECE C[C@H](N[C@@H](CO)c1ccccc1)c1cc(O)ccc1O 62999259 UMEIRLQEYWCTME-NHYWBVRUSA-N 273.332 2.482 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)c1scnc1Cl 713481071 QNMGFFCFQYHMSK-RXMQYKEDSA-N 275.721 2.212 10 10 CECE Nc1ccc(NC(=O)N2CCCCC23COC3)cc1 1892836144 SBIXZFDHEZEOMZ-UHFFFAOYSA-N 261.325 2.056 10 10 CECE CN(CC1CCSCC1)c1ccc2c(c1)NC(=O)[C@@H]2N 718306530 CYVADYIAUWMSLS-CQSZACIVSA-N 291.420 2.218 10 10 CECE CNCc1cc(F)c(N(C)Cc2ncccn2)c(F)c1 718948006 GDEUHWKNKKUUCG-UHFFFAOYSA-N 278.306 2.111 10 10 CECE c1cnc(CNCc2ccc(N3CCCC3)cc2)cn1 698152769 ZURNOAGXTJWZFV-UHFFFAOYSA-N 268.364 2.367 10 10 CECE CN(C[C@@H]1C[C@H]1C1CC1)c1ccc2c(c1)NC(=O)[C@H]2N 698292920 SWQXAFFDWDCZRR-XEGUGMAKSA-N 271.364 2.121 10 10 CECE COc1ccc(CN(C)C[C@@H]2CCCN(C)C2)c(O)c1 92253926 FDKNNTNAZUBLSR-CYBMUJFWSA-N 278.396 2.174 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC(C)(C)OC1(C)C 94425608 SVTKUEPZIDKICU-CYBMUJFWSA-N 284.360 2.166 10 10 CECE O=C(CCCc1nccs1)NCc1cccc(O)c1O 1349079847 UDSIIRDFJLMMMR-UHFFFAOYSA-N 292.360 2.193 10 10 CECE CCN1C(=O)N/C(=C\c2ccc(N3CCCC3)cc2)C1=O 571847 ZFILDIFGNWEYJR-KAMYIIQDSA-N 285.347 2.199 10 10 CECE OCc1ccc(N2CCO[C@H](c3nccs3)C2)cc1 2115211275 ZFXIBQYIJRICJJ-ZDUSSCGKSA-N 276.361 2.213 10 10 CECE Cc1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)nc1C 1299133242 UNNMKBCJVWRDDF-YVMONPNESA-N 298.342 2.439 10 10 CECE Cc1ncccc1/C=C\C(=O)N(C)c1ccc(C(N)=O)cc1 1534588062 ISVVWXALUPUSHY-YFHOEESVSA-N 295.342 2.165 10 10 CECE NC[C@@H]1[C@@H]2C[C@H]2CN1c1ccc(OC(F)(F)F)cc1 1905536853 MQFKZDYUOWRRMA-XXILOJSOSA-N 272.270 2.369 10 10 CECE COc1cccc(CNC[C@H]2CC[C@H](C)CO2)c1O 2117406276 JSLDEKZMKXISAD-WCQYABFASA-N 265.353 2.306 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(S(=O)(=O)[C@@H]2CCC[C@H]2F)C1 2118877382 BPOQHXMPLSMQJS-HBNTYKKESA-N 290.364 2.229 10 10 CECE COc1cc(CNCc2ccncc2)ccc1N(C)C 212689298 AECMHILUZOBFIA-UHFFFAOYSA-N 271.364 2.446 10 10 CECE CCC[C@@H]1C[C@@H](C(=O)NCc2cc(O)ccc2O)CCO1 1471661318 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CECE Nc1ccc(CNCc2ccc3cncn3c2)cc1 2131244500 BLUIIHHHPMAERO-UHFFFAOYSA-N 252.321 2.206 10 10 CECE CN[C@@H](C)c1ccc(N2CC3(OC)CC2C3)cc1O 2129022157 RUNNWDFLPOIILX-VLRKGOCCSA-N 262.353 2.040 10 10 CECE COc1cccc(CN2CCC[C@H](C)[C@@H]2C(=O)O)c1O 818631794 QMDDGLBWVSTKLF-GXFFZTMASA-N 279.336 2.086 10 10 CECE c1nc(Sc2ncc(CNC3CCC3)s2)n[nH]1 2217119627 IXXHTHONPMJSQF-UHFFFAOYSA-N 267.383 2.055 10 10 CECE CCc1cccc(CNC[C@@H](OC)[C@@H]2CCOC2)c1O 826822177 MLFYJXGZYMEYJF-HUUCEWRRSA-N 279.380 2.096 10 10 CECE CCc1cccc(CNCc2ncccc2O)c1O 848908492 VYGIBZXJIPTJEH-UHFFFAOYSA-N 258.321 2.345 10 10 CECE O=S1(=NCCN[C@@H]2CCc3cccc(O)c32)CCCC1 1913876497 QINSHRCWFAOVEN-CYBMUJFWSA-N 294.420 2.231 10 10 CECE C[C@H]1CN(c2ccc(C=CC(=O)O)cc2F)CCO1 1911897003 IULLDAADLKRLCP-JTQLQIEISA-N 265.284 2.149 10 10 CECE Cc1ccc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)cc1O 1912152240 QGWQIRIYEOEHTB-JTQLQIEISA-N 260.297 2.473 10 10 CECE Cc1scnc1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912146782 DURDJWSRYKCEJA-QMMMGPOBSA-N 251.315 2.366 10 10 CECE 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2.158 10 10 CECE CCN(CCCCO)c1ccc(CNCCOC)cc1 2159110255 WPLSCJSZPDWQGI-UHFFFAOYSA-N 280.412 2.021 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)[C@]1(C)CCCS1 2031160189 NQVAFENLHPQHNA-RDBSUJKOSA-N 267.394 2.299 10 10 CECE CO[C@@H]1CN(c2ccc(CN)cc2Cl)CC12CC2 2032394411 JOJUSBJUUVBPPP-CYBMUJFWSA-N 266.772 2.414 10 10 CECE C[C@@H]1OC2(C)CC1(NCc1ccc3c(c1)CCN3C)C2 2156682483 NMZJTNWBQBAPQI-CDEQTRAXSA-N 272.392 2.479 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)c1ccco1 2036562239 OHCFEJGYONOQOX-UHFFFAOYSA-N 266.322 2.077 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCC[C@]1(C)C(=O)O 300442072 OYGOCYCVPODQNI-ZUZCIYMTSA-N 279.336 2.488 10 10 CECE CC(C)Cn1cnc([C@H](O)c2ccc(N(C)C)cc2)n1 2159404901 MFEDRUXDXMKNOI-CQSZACIVSA-N 274.368 2.082 10 10 CECE CC[C@@H]1CN(c2ccc([C@H](C)N)c(O)c2)[C@@H](C)CO1 403772283 RTYDOPGYXVSGKU-GMXVVIOVSA-N 264.369 2.416 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ccc3c[nH]nc3c2)C1 403811070 DDUUERZHDIOIFW-NSHDSACASA-N 270.296 2.478 10 10 CECE CC1(C)CN(c2ccc(CN)c(F)c2F)CC[C@H]1O 311369799 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COc1ccc(N(C)Cc2nccc(NN)c2F)cc1 2154335842 JLPDXZFULSGYCV-UHFFFAOYSA-N 276.315 2.151 10 10 CECE COc1cccc(O)c1CN1CCC[C@@H](C)[C@@H]1CCN 2160724065 MZGGJNNWNVUSBE-OCCSQVGLSA-N 278.396 2.350 10 10 CECE C[C@]1(O)CC[C@@H](NCc2c(O)cccc2Cl)C1 2013794511 XMGYVXFZNWKKMS-RNCFNFMXSA-N 255.745 2.439 10 10 CECE CC[C@]1(C)OCCC[C@@H]1NC(=O)c1cccc(O)c1O 2155103489 VBBKDAKHGGDGIF-WFASDCNBSA-N 279.336 2.175 10 10 CECE Cc1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)c(C)nn1 2155556316 QQIZNFHXPKKYIT-NSHDSACASA-N 274.328 2.398 10 10 CECE CN(CP(C)(C)=O)c1c(F)cc(CO)cc1F 2021442105 HQMNEJKHVHGAQF-UHFFFAOYSA-N 263.224 2.474 10 10 CECE CC1(C)CC[C@@H](O)CN1CCCOc1ccc(N)cc1 2156080781 OXVQYHLMVCNHMM-CQSZACIVSA-N 278.396 2.273 10 10 CECE CCn1cnc(NCc2cc(F)cc(F)c2O)c1 2028673511 SNMPQAFUKASPFP-UHFFFAOYSA-N 253.252 2.499 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@](C)(O)C(F)(F)F 2031152015 BEVSDNKPSKAGBB-WDEREUQCSA-N 263.259 2.356 10 10 CECE C[C@H]1CCS[C@H]1CNCc1ccc(O)c(O)c1O 2033425674 ZCYZPTOSLDOFAN-KWQFWETISA-N 269.366 2.035 10 10 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CCN(Cc1ccc(N)cc1)Cc1snnc1C 2314334523 ALORNLJEBNVJOQ-UHFFFAOYSA-N 262.382 2.451 10 10 CECE COC(=O)[C@](N)(CSc1nccs1)[C@H]1CC1(C)C 2318439624 HPIYPOPMFKHSBF-UFBFGSQYSA-N 286.422 2.152 10 10 CECE COc1cc(N(C)[C@@H]2CC[C@H]2SC)ccc1CN 2327903818 VBULMSXVJTUVOS-TZMCWYRMSA-N 266.410 2.484 10 10 CECE CSc1cc(N2CCC[C@@](C)(O)C2)ccc1CN 2328549003 OWUCYHUFVFHVJW-CQSZACIVSA-N 266.410 2.218 10 10 CECE O=C(O)[C@@H]1[C@@H]2CC[C@H]1N(Cc1ccc(Cl)cc1O)C2 2329532893 RNSZEAAZZAZUSV-IRUJWGPZSA-N 281.739 2.341 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H]2C[C@H]3CO)ccc1[C@H](C)O 2334469438 QOCVIIVMPWMAGS-GMZLATJGSA-N 261.365 2.398 10 10 CECE CNCc1ccc(N2CCC3CC2(CO)C3)c(Cl)c1 2336544723 YOHBEIWIRSFHSV-UHFFFAOYSA-N 280.799 2.411 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC3CC2(CO)C3)c1C 2340847316 DZKLBWFOMMTRGH-FUJMWEONSA-N 260.381 2.284 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC[S@](=O)[C@@H](C)C2)c1C 2341064676 NIVVPAGXBMSREE-VARDARPISA-N 280.437 2.280 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCN(C)[C@@H]3C[C@H]32)c1C 2341066224 ZLUGSNXDTJONAU-DAXOMENPSA-N 260.381 2.249 10 10 CECE CC1(C)C[C@H](CN2CCc3cc(O)c(O)cc3C2)O1 2341215178 VBXWECSKKIIVPM-GFCCVEGCSA-N 263.337 2.023 10 10 CECE CSc1cc(N2CC[C@@H]3[C@H]2C[C@@]3(C)O)ccc1CN 2353851842 OPXOSEIXMRVWNV-UMVBOHGHSA-N 278.421 2.217 10 10 CECE CSc1cc(N(C)C2CC3(COC3)C2)ccc1CN 2353858416 KBXDKGNZEJURPZ-UHFFFAOYSA-N 278.421 2.482 10 10 CECE Cc1ccc(/N=N/N2CCC(C(N)=O)CC2)cc1C 1860490387 FWFKWAPXOKPWQN-WUKNDPDISA-N 260.341 2.499 10 10 CECE CNC[C@@H](C(C)C)N1CCN(c2ccc(OC)cc2)CC1 52418111 YLVHEJZKCFTJTO-KRWDZBQOSA-N 291.439 2.061 10 10 CECE COc1cccc(CN2CC[C@](C)(OC)C2)c1O 311157270 OPUWJLQDBLSGKL-AWEZNQCLSA-N 251.326 2.012 10 10 CECE CN1CC[C@@H](CN(C)c2ccc(CN)c(Cl)c2)C1 71187581 GHJALFGFCNIBFH-LLVKDONJSA-N 267.804 2.187 10 10 CECE COc1c(Cl)c(O)c(CN)c(OC)c1Cl 26008668 FAKGFIHKGBMCPD-UHFFFAOYSA-N 252.097 2.175 10 10 CECE Cc1ccc(O)c(CN2Cc3ccccc3C[C@@H]2C(N)=O)c1 119841956 SSHSFXNWUGOUPZ-MRXNPFEDSA-N 296.370 2.113 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@@H]3[C@H]4CC[C@H](O4)[C@H]32)c(N)c1 2356960448 FSPCOQCOLUKLCP-NPODOCJWSA-N 274.364 2.280 10 10 CECE COCCNCc1ccc(N2C[C@H](C)OC(C)(C)C2)cc1 62738005 PXVDXOZPTJZMPI-AWEZNQCLSA-N 292.423 2.426 10 10 CECE Nc1ccc(CN2[C@H]3CC[C@@H]2C[C@@]2(C(=O)O)C[C@H]32)cc1 2357516851 ARNBGYLGLGNOTB-HGTKMLMNSA-N 272.348 2.096 10 10 CECE C[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)CN1C1CC1 151064027 RYNHFROIQHTANZ-WFASDCNBSA-N 272.392 2.336 10 10 CECE CCN1CCC[C@H]1CN(C)c1cc(OC)c(OC)cc1N 213776437 BEGPYAOYOJOZRE-LBPRGKRZSA-N 293.411 2.207 10 10 CECE Cc1cc(Cl)cc(CNC[C@@]2(O)CCSC2)c1O 182558224 FPHRIKGDAIMGPM-ZDUSSCGKSA-N 287.812 2.312 10 10 CECE CCNc1nc(Sc2nccs2)c2cn[nH]c2n1 214333232 OWRNXBLZJVEBDO-UHFFFAOYSA-N 278.366 2.392 10 10 CECE Cn1c(Br)cc2ccc(CCN)cc21 212566602 LBRZSJFCORLTAW-UHFFFAOYSA-N 253.143 2.442 10 10 CECE CCCO[C@@H]1CCCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 42422852 QMFHACSEAKFCDY-IUODEOHRSA-N 289.379 2.034 10 10 CECE O=C(Nc1ccc(O)cc1C(=O)O)c1cc(Cl)c[nH]1 48847042 LSWOXPCQHPLOIJ-UHFFFAOYSA-N 280.667 2.324 10 10 CECE COC(=O)C[C@H](C)NCc1cccc(Cl)c1O 380141285 GHKIKGYQUPSSGP-QMMMGPOBSA-N 257.717 2.087 10 10 CECE Oc1cccc(CNCC[C@H]2CCCCO2)c1O 223833719 FOXPJRZPORFRGV-GFCCVEGCSA-N 251.326 2.147 10 10 CECE CCCNCc1ccc(N(C)CC(=O)NCCC)cc1 49030807 XNDLEXWLVNFIEQ-UHFFFAOYSA-N 277.412 2.149 10 10 CECE CN[C@]1(C(=O)OC)CCC[C@H](Sc2nccs2)C1 93778704 IROCYXONNARGFN-JOYOIKCWSA-N 286.422 2.309 10 10 CECE CC[C@H](NC[C@@H](O)[C@H]1CCCO1)c1ccc(C)cc1O 527959929 ZUBKGTSUPATPFG-NUEKZKHPSA-N 279.380 2.281 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@H](N(C)C)C2)cc1 251779991 MXADKIFAUMMYRL-WOSRLPQWSA-N 261.413 2.353 10 10 CECE C[C@H](N)C1(c2cc(Br)c(F)c(O)c2O)CC1 258466262 HNFIWAXOBWNVGM-YFKPBYRVSA-N 290.132 2.378 10 10 CECE CC(=O)C(=O)COC(=O)c1sccc1SC(F)F 808515070 ABRUXFOQQYYCCV-UHFFFAOYSA-N 294.300 2.378 10 10 CECE CCOc1cnc([C@@H](O)CCc2ccc(N)cc2)nc1 2165664268 ACGMSQKUOCVNDL-AWEZNQCLSA-N 273.336 2.124 10 10 CECE CN(C)c1ccc([C@H](CN)N2CC(C)(C3CC3)C2)cc1 2163417098 AWVYJGMWLTXADG-INIZCTEOSA-N 273.424 2.484 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@H]1O2)c1c(F)cc(CO)cc1F 2168070432 AZBGHFLNZHGXBM-MISXGVKJSA-N 283.318 2.461 10 10 CECE C[C@H](CN(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N)C1CC1 2164466289 ZXCSIYKVUYJRPK-BMIGLBTASA-N 273.380 2.145 10 10 CECE C[C@@H]1CC(NCCc2ccc(O)c(O)c2)C[C@@H](C)N1C 2166895295 KOXHPABNUPHKDH-VXGBXAGGSA-N 278.396 2.101 10 10 CECE C[C@H](N)c1ccc(N2[C@H](CO)C[C@@H]3CCC[C@@H]32)cc1O 2164836142 MSEHLNOHMHDKKU-UHXUCMFUSA-N 276.380 2.152 10 10 CECE Nc1ccc(CNC[C@@H]2CC[C@H](C(F)(F)F)O2)cc1 722385398 IEJJXPZYMLUEAC-NWDGAFQWSA-N 274.286 2.468 10 10 CECE COC1(CF)CN(c2ccc(C=CC(=O)O)cc2F)C1 2168733854 WDXPPMQHWJQADO-UHFFFAOYSA-N 283.274 2.098 10 10 CECE C[C@@H]1[C@@H](NC[C@H](N)c2ccc(N(C)C)cc2)C[C@H]1C 817943279 TYDOUMUGTXORHW-KNPMLCFXSA-N 261.413 2.387 10 10 CECE Cc1cc(CN2C[C@@H](O)CC[C@H]2C)ccc1N(C)C 817287111 CEEHTWQIBCSSEX-HIFRSBDPSA-N 262.397 2.406 10 10 CECE C[C@@H](CF)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 814321217 HICCVLOKSAHHFR-WDEREUQCSA-N 267.348 2.471 10 10 CECE Nc1ccc(CCCN2CC[C@@H]3OCC[C@@H]3C2)cc1 724811804 RRVZVMHTWHYEFK-ZBFHGGJFSA-N 260.381 2.312 10 10 CECE COc1ccccc1[C@H](O)CNCc1cc(F)ccc1O 827951087 WFUCQPPEJHVELV-OAHLLOKOSA-N 291.322 2.363 10 10 CECE Cc1cc(N(C)C)ccc1CNCc1cc(N)ccn1 903953205 CHJNCZZVYRNMTM-UHFFFAOYSA-N 270.380 2.328 10 10 CECE O=C(C[C@@H]1CCC2(CCC2)O1)NCc1ccc(O)c(O)c1 901131022 GGQFUMDGGKHQRS-LBPRGKRZSA-N 291.347 2.206 10 10 CECE COCCOC1CN(C/C=C/c2ccc(N(C)C)cc2)C1 838986937 LWKWXLSOUINVSB-SNAWJCMRSA-N 290.407 2.113 10 10 CECE COC[C@](C)(O)CCN[C@@H](C)c1c(C)cc(C)cc1O 834842990 FLWSKDJUTBOGER-XJKSGUPXSA-N 281.396 2.447 10 10 CECE CC(C)N(CCCO)c1ccc(CN)cc1Cl 62793075 VHUBVZBTTPLXIM-UHFFFAOYSA-N 256.777 2.396 10 10 CECE CCOc1ccc(O)c(CN[C@H]2CC23CCNCC3)c1 841078684 IEUDDIJIPXKSAI-HNNXBMFYSA-N 276.380 2.023 10 10 CECE Cc1ccc([C@@H](C)NCCCc2ncn(C)n2)c(O)c1 842902149 MBIJBMPAUIEUSH-GFCCVEGCSA-N 274.368 2.113 10 10 CECE COC[C@@H](N[C@@H](C)c1ccccc1O)C1CCOCC1 850493367 VWGUZDVSHZWVCV-SWLSCSKDSA-N 279.380 2.484 10 10 CECE CCOc1ccc(CNCCc2cncc(C)n2)c(O)c1 850390447 HQZOHIHFOLZYMU-UHFFFAOYSA-N 287.363 2.222 10 10 CECE Cc1cc(C)c([C@@H](C)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)c(O)c1 926944779 QXOXXVJRJPYGRQ-NYTXWWLZSA-N 291.391 2.464 10 10 CECE CCC[C@@H]1COC[C@H]1NCc1cc(F)ccc1O 699549015 DMCDZKXDLYQYHN-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE CCOC(=O)C1=CC[C@@H](NCc2cccc(C)c2O)C1 862488625 NDKAPQSYKFRHQW-CQSZACIVSA-N 275.348 2.442 10 10 CECE CCCOc1cc(N(C)CCC(=O)OC)ccc1N 1875966624 HNPCLMAXSBZXHK-UHFFFAOYSA-N 266.341 2.057 10 10 CECE C[C@H](c1ccccc1O)N(C)CCc1cccnn1 1877525282 VXDYAUJEODCQQV-GFCCVEGCSA-N 257.337 2.418 10 10 CECE Cc1ccc([C@H](C)N(CC(N)=O)C2CCCC2)c(O)c1 132982279 NXHXCHULUMDNOU-LBPRGKRZSA-N 276.380 2.492 10 10 CECE C[C@]1(CNC(=O)c2ccc(O)c(O)c2)CCCSC1 1879826254 HESDRFKXUSGTNM-CQSZACIVSA-N 281.377 2.361 10 10 CECE CCN(C)C1CN(c2c(F)cc([C@@H](C)N)cc2F)C1 1880923622 JMQWEZVUZKLDEL-SECBINFHSA-N 269.339 2.125 10 10 CECE O=C(NCc1c(O)cccc1O)c1csc(C2CC2)n1 1156881212 UUDZHZNSIAHTFA-UHFFFAOYSA-N 290.344 2.362 10 10 CECE COc1cccc(CNCc2c(O)cccc2F)n1 1183918991 DTADGQWRDJHWKU-UHFFFAOYSA-N 262.284 2.225 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2c1cnccc1Cl 75793680 VCIJRCLKFIHECB-ZDUSSCGKSA-N 276.723 2.381 10 10 CECE CC(C)(C)c1n[nH]c(=NCc2ccc(N)cc2)s1 1962812496 RWLDXOHPIXXOSK-UHFFFAOYSA-N 262.382 2.452 10 10 CECE Nc1ccc(CNc2c(O)cccc2[N+](=O)[O-])cc1 83431480 PLEOSLUNVLSRQI-UHFFFAOYSA-N 259.265 2.495 10 10 CECE CCCCCCNC(=O)[C@H](N)c1cc(C)ccc1O 83479287 SMKIPXUXUGPDGQ-CQSZACIVSA-N 264.369 2.397 10 10 CECE CCN(CC)c1ccc([C@@H]2CNCCN2C)c(OC)c1 83583608 DAUBCDYDJXARRZ-HNNXBMFYSA-N 277.412 2.118 10 10 CECE N#Cc1cccc([C@@H]2NCCc3c2ccc(O)c3O)c1 83656106 NSZKROVRLXAPDD-HNNXBMFYSA-N 266.300 2.205 10 10 CECE Cc1cc(N(C)CC[C@H]2CCOC2)ccc1CCN 1885677606 FTGRUCVKKPNHKR-AWEZNQCLSA-N 262.397 2.359 10 10 CECE CCCN(C)CCN[C@@H](C)c1ccc(O)cc1O 701485254 DKTSNBHQYYJCFF-NSHDSACASA-N 252.358 2.090 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCCS(=O)(=O)CC2)cc1 694170599 AXMZXGTWYGHGRT-TZMCWYRMSA-N 296.436 2.110 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1Cl 78901527 FUNWOZUGXJTDOI-MNOVXSKESA-N 295.814 2.322 10 10 CECE CN1C[C@@H]2[C@H](CCN2Cc2ccc(N3CCCC3)cc2)C1 1324820966 BMIAZVSZDQYIFD-SJLPKXTDSA-N 285.435 2.423 10 10 CECE C[C@H](CNCc1ccc(O)cc1O)c1ccccn1 692759157 CFKZCPSMXJUXBA-LLVKDONJSA-N 258.321 2.386 10 10 CECE c1cc(COc2ccc(N3CCNCC3)cc2)sn1 694521677 DEBYRDVHIZCYFE-UHFFFAOYSA-N 275.377 2.132 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2CCC[C@H]2OC)c1 687463896 RVZMPFAYSMXSMN-UKRRQHHQSA-N 265.353 2.400 10 10 CECE CN(Cc1cccc(F)c1O)C[C@@]1(C)CCOC1 687523330 WUXBFJUUNUXEHV-CQSZACIVSA-N 253.317 2.390 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@H](CF)C3)c(Cl)cc21 711405270 CDYNQRDLADYBFT-AMIZOPFISA-N 297.761 2.348 10 10 CECE O=C(NCc1ccccc1O)N[C@@H]1C[C@H]2[C@@H](C1)C2(F)F 1328508631 ZDNZCECOXVTCTN-JGPRNRPPSA-N 282.290 2.235 10 10 CECE CC1(C)CO[C@@H](CC(=O)NCc2ccccc2O)C1 717107085 CHBTWIGTRUAQSN-LBPRGKRZSA-N 263.337 2.214 10 10 CECE C[C@@H](N[C@H](CO)C1CCC1)c1ccc(F)cc1O 717626882 TXCBHMWCXNUZPY-NOZJJQNGSA-N 253.317 2.343 10 10 CECE CN(CCCc1ccc(N)cc1)Cc1ccnn1C 689568740 GHTCIZYOXLIGAM-UHFFFAOYSA-N 258.369 2.067 10 10 CECE CN1CCCc2cc([C@@H]3NCCc4nc[nH]c43)ccc21 690882845 ZVHYHYCPGYIQQO-HNNXBMFYSA-N 268.364 2.027 10 10 CECE CCn1cc(CN(C)C(=O)Nc2ccc(N)cc2)cn1 693751389 FRKMVWSHPVDKLK-UHFFFAOYSA-N 273.340 2.149 10 10 CECE COc1cccc(CN2CCC(C)(C(=O)O)CC2)c1O 86776713 MADVPALCTSBVQK-UHFFFAOYSA-N 279.336 2.088 10 10 CECE CSc1ccc([C@](C)(NCCCN=[N+]=[N-])C(N)=O)cc1 90260480 VRGHTPDMZOQXIT-ZDUSSCGKSA-N 293.396 2.399 10 10 CECE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCCN=[N+]=[N-] 1963815631 AWDJLDAZZVIXBT-UWVGGRQHSA-N 297.359 2.058 10 10 CECE Cc1ccc(N(C)C(=O)/C=C\c2scnc2C)nn1 1354118581 ISGQRRRTTACNOY-ALCCZGGFSA-N 274.349 2.226 10 10 CECE CC(C)NCc1ccc(N2CC[S@@](=O)C[C@H]2C)cc1 2115325142 HNANSJMANNHYMM-BFUOFWGJSA-N 280.437 2.142 10 10 CECE COC(=O)c1sccc1C(=O)NCc1ccccc1O 1294925626 RMLATMFRHMENQL-UHFFFAOYSA-N 291.328 2.170 10 10 CECE C[C@H](NC(=O)c1cnc2c(cnn2C)c1)c1ccccc1O 1454818644 NLDQGVBUBYAMQR-JTQLQIEISA-N 296.330 2.165 10 10 CECE CN(C)c1ccc([C@]2(O)C[C@@H](CN)C23CCC3)cc1 2116605986 MXIWEJSASPZHIZ-XJKSGUPXSA-N 260.381 2.089 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)[C@@H]2CCCC[C@H]2F)C1 2118936854 GTIFLJXULOGUSA-GMTAPVOTSA-N 290.364 2.372 10 10 CECE C[C@@](O)(c1cncc(Cl)c1)[C@@H](N)c1ccccc1O 2119318603 DIGMSKJTLCMENO-UONOGXRCSA-N 278.739 2.348 10 10 CECE C/C=C/[C@H](O)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623549558 FOOFODAZCYMJPR-GIZXNFQBSA-N 288.391 2.182 10 10 CECE Cc1cc(CCC(=O)NCc2ccc(N(C)C)cc2)n[nH]1 1624401750 ONDWWKUSAHDODV-UHFFFAOYSA-N 286.379 2.033 10 10 CECE CNc1ncc(C(=O)NCc2cc(Cl)ccc2O)s1 1628680494 KRASLVIVUBRGAB-UHFFFAOYSA-N 297.767 2.474 10 10 CECE O=C(CSc1ncc(Cl)s1)Nc1cccnn1 1559446814 OAXZGVHUNARELO-UHFFFAOYSA-N 286.769 2.317 10 10 CECE C[C@]1(O)C[C@H]2C[C@H]1C[C@H]2NCc1c(O)cccc1F 2121710222 UKUSFXDGIONOKA-JLBHGKSJSA-N 265.328 2.170 10 10 CECE CN1[C@H]2CC[C@H]1CC(CNCc1cccc(O)c1O)C2 104420421 MAHZAMNFPKRRSA-KBPBESRZSA-N 276.380 2.060 10 10 CECE O=C(NCc1ccnc(Cl)c1)c1cccc(O)c1O 1642764572 LLBZTEIAKLGLGI-UHFFFAOYSA-N 278.695 2.076 10 10 CECE COCc1cc(CNCc2cc(C)ccc2O)on1 1964614243 JQUOEOUTHALXJW-UHFFFAOYSA-N 262.309 2.125 10 10 CECE CCOc1cc(C2=NN=C3C4CCN(CC4)[C@@H]23)ccc1O 169970100 IMEJPRXYALUODA-MRXNPFEDSA-N 285.347 2.044 10 10 CECE C[C@H]1Cc2cc(N3C[C@@H](N)CC(F)(F)C3)ccc2O1 2127790717 YVZKKNGUTBHWFH-ONGXEEELSA-N 268.307 2.183 10 10 CECE Oc1cc(Cl)ccc1CNC1CC(n2cnnc2)C1 2127665249 BXDAGANIBLGIMI-UHFFFAOYSA-N 278.743 2.130 10 10 CECE CCOc1ncc(/C=C/C(=O)Nc2ccc(N)cc2)cn1 1866257581 UFZRGSZFQOFXSH-FPYGCLRLSA-N 284.319 2.109 10 10 CECE CC1(C)C[C@H](NCc2ccc3c(c2)CCCO3)CN1 258724219 GQZGCDDPRUTROS-AWEZNQCLSA-N 260.381 2.242 10 10 CECE OC[C@@H]1CCCCN1c1ccc2c(c1)CCC[C@H]2O 2128272176 GPGQOKSXBAVLJO-GOEBONIOSA-N 261.365 2.408 10 10 CECE O[C@H]1CCCc2cc(N3C[C@@H](O)C4(CC4)C3)ccc21 2128279821 UKTFTJMDWISZEP-LSDHHAIUSA-N 259.349 2.017 10 10 CECE CN(C)[C@H]1CCCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128316773 JNICTTVRZVXCJO-HOCLYGCPSA-N 259.397 2.163 10 10 CECE CC[C@@H]1COCCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128327166 FHLSNFUTTOTNOX-LRDDRELGSA-N 260.381 2.495 10 10 CECE CO[C@H](CN[C@H]1CCc2cccc(O)c21)[C@H]1CCOC1 850484444 IXJOAZXMADLHDI-KCQAQPDRSA-N 277.364 2.021 10 10 CECE CO[C@H](C(=O)NCCc1ccc(N)cc1)C1CCCC1 851632535 RPKBPVSWVXYUQZ-HNNXBMFYSA-N 276.380 2.133 10 10 CECE CC[C@]1(C)C[C@@](N)(c2ccc3c(c2)CCN3C)CO1 2132899304 SVYAXGMQZWMFDN-CVEARBPZSA-N 260.381 2.422 10 10 CECE COc1ccc(CNCC[C@@H]2CCC[C@@H]2O)c(O)c1 1913750894 GRLJCQIDXKEYMM-FZMZJTMJSA-N 265.353 2.042 10 10 CECE Cc1cccc(CNC(=O)c2ccnc(Cl)n2)c1O 2139744512 YLMDLMNEXCNECA-UHFFFAOYSA-N 277.711 2.074 10 10 CECE CC(C)N1CCC[C@@H](NCc2ccc(F)cc2O)C1 2139882544 UUGYBXUKZPGLOM-CQSZACIVSA-N 266.360 2.494 10 10 CECE CN(C)c1nc(CN2CC[C@@H](CN=[N+]=[N-])C2)cs1 1912149695 JYHBTTJJSQNVOF-VIFPVBQESA-N 266.374 2.341 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 1912143635 IUXBUIFXBSRHQW-SNVBAGLBSA-N 275.268 2.049 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2ccncc2Br)C1 1912177251 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C[C@@H](NCc1cc(F)cc(F)c1O)C12CC(CO1)C2 1966041924 KNAPUJZQDINXAS-NQTXRORDSA-N 269.291 2.328 10 10 CECE C[C@H](c1ccc(O)cc1O)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2 251505136 GVRWZYQSEREWJT-PSJXJDHFSA-N 277.320 2.096 10 10 CECE OC[C@H](CNCc1ccc(Cl)cc1O)C(F)(F)F 1967742619 IIVJMAIIJXASDU-QMMMGPOBSA-N 283.677 2.306 10 10 CECE Oc1ccc(CN[C@@H]2C[C@H]2C2CCOCC2)c(O)c1 2135453627 OUCWDENOOMFRBL-UONOGXRCSA-N 263.337 2.003 10 10 CECE NCc1cc(F)c(N2[C@H]3CCC[C@H]2CC(O)C3)c(F)c1 1922777184 JOTPJCOJKDCTMZ-QWRGUYRKSA-N 282.334 2.306 10 10 CECE CNCc1ccc(N2CC(OC(C)C)C2)cc1OC 2139698309 HEIANPJLVZVMDX-UHFFFAOYSA-N 264.369 2.028 10 10 CECE C[C@@]1(O)CCN(c2c(F)cc(CNC3CC3)cc2F)C1 235427840 DHFPTFZSBGGYKC-OAHLLOKOSA-N 282.334 2.178 10 10 CECE Nc1ccc(CCNC(=O)C2(Br)CCC2)cc1 1969320946 RBVTYHYRTHRFGU-UHFFFAOYSA-N 297.196 2.245 10 10 CECE CC(=O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(O)cc1 1951753179 DWVIRNIAAYDURU-LBPRGKRZSA-N 293.319 2.116 10 10 CECE O=C1CCCN[C@H]1c1ccc(Br)cc1O 1952458739 XSRZATAUTUKBBT-NSHDSACASA-N 270.126 2.148 10 10 CECE COC(=O)[C@H]1CCN[C@@H]1c1ccc(C(F)(F)F)cc1O 1952829188 IPSCFYMFDQLTRF-GXSJLCMTSA-N 289.253 2.235 10 10 CECE Oc1c(C[C@@H]2CCCN2)ccc(C(F)(F)F)c1O 258282886 AGNZVEMWTYASLE-QMMMGPOBSA-N 261.243 2.411 10 10 CECE CCCCN(CC)c1ccc2c(c1)N(C)C(=O)[C@H]2N 155738162 FDOSNUDVBBNVOP-AWEZNQCLSA-N 261.369 2.289 10 10 CECE Cn1nc(-c2cc(O)c(O)cc2C(F)(F)F)cc1N 258423660 HDKDDXCKYVCCQM-UHFFFAOYSA-N 273.214 2.099 10 10 CECE COc1ccc(N2CCP(C)(=O)CC2)c(N)c1 2004545709 WBCULZMRHHSDRK-UHFFFAOYSA-N 254.270 2.090 10 10 CECE CCOC(=O)C[C@@H](N)c1c(O)cccc1SC 260585161 ZWCNYKKJFRWBAX-MRVPVSSYSA-N 255.339 2.067 10 10 CECE CCn1cc(Br)c(CN2CC(N=[N+]=[N-])C2)n1 1985200827 SAFDQCQCOUSNBG-UHFFFAOYSA-N 285.149 2.160 10 10 CECE CN(CC(=O)NC1CCCCC1)Cc1ccc(N)cc1 35360399 BJXCAFOQZWPXGO-UHFFFAOYSA-N 275.396 2.150 10 10 CECE CC(C)(C)NCc1ccc(N2CC[C@@H](O)[C@H](F)C2)cc1 2144564674 SYGRJVDHCKFODZ-HUUCEWRRSA-N 280.387 2.484 10 10 CECE CN(Cc1cc(F)ccc1O)[C@@H](CC(=O)O)C(F)(F)F 2149651161 YXVSYDUUJAOYIQ-JTQLQIEISA-N 295.232 2.369 10 10 CECE COCCCN(CCOC)c1ccc([C@H](C)N)cc1 42422807 FRNQZDFYKACSCL-ZDUSSCGKSA-N 266.385 2.196 10 10 CECE CC(C)SC[C@@H](NN)c1ccc(N(C)C)cc1 1999528201 YFZZZXUJGZLDPH-CYBMUJFWSA-N 253.415 2.399 10 10 CECE C[C@@H](N)Cc1ccc2ccn(Cc3ccnn3C)c2c1 2150677127 QXHIFBOIYVAIKH-GFCCVEGCSA-N 268.364 2.313 10 10 CECE COc1cc(Cl)cc(CN2CC([C@@H](C)C(=O)O)C2)c1O 166082713 DOXUOUBTLCTCNM-MRVPVSSYSA-N 299.754 2.207 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2COC[C@@H]2CC2CC2)cc1 2158059717 DXVGNOFCYIGQFQ-SMDDNHRTSA-N 275.352 2.205 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1[C@H]2CC[C@@H]1C[C@H](CN)C2 2159211707 UNQJRXZGYRJWPZ-RVMXOQNASA-N 276.380 2.361 10 10 CECE Oc1cccc(Br)c1CNCc1cncnc1 2009056980 QGTIKOGDHASJDP-UHFFFAOYSA-N 294.152 2.235 10 10 CECE Cc1ncc(CCNCc2ccc3c(c2)CCN3C)o1 2154217875 VZSXVSYPFOFLEI-UHFFFAOYSA-N 271.364 2.308 10 10 CECE FCCN1CCC(NCc2ccc3c(c2)CCO3)CC1 2154499184 AUGNBIKEIWIFIE-UHFFFAOYSA-N 278.371 2.145 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](O)C3(CC3)C2)c(Cl)c1 2032400253 LPVVZNRMRHSUEW-TVQRCGJNSA-N 266.772 2.321 10 10 CECE CCCc1nc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)n[nH]1 2155554324 SKTVYAZOTHJFKZ-SECBINFHSA-N 277.332 2.062 10 10 CECE C[C@@H]1CCO[C@@H]1CN(C)Cc1cccc(F)c1O 2034982759 BEMXHVJDZJLVRU-ZWNOBZJWSA-N 253.317 2.388 10 10 CECE CN1CCCN(c2ccc(CO)c(Cl)c2)CCC1 2035148982 VFTKSYGYGPIREE-UHFFFAOYSA-N 268.788 2.364 10 10 CECE C[C@H](N[C@H]1CCN2CCCC[C@H]12)c1c(O)cccc1O 300436124 FFFVUDAJRFDXJT-RWMBFGLXSA-N 276.380 2.375 10 10 CECE CC[C@H](NC)c1ccc(N2CC[C@H](NC(C)=O)C2)cc1 300507770 MIQSPHUSDJIOCT-HOCLYGCPSA-N 275.396 2.072 10 10 CECE CC12CC(NCc3ccc(F)c(F)c3O)(CO1)C2 2038990618 BSYLUAORXSXHPF-UHFFFAOYSA-N 255.264 2.082 10 10 CECE CCOc1cccc(CN[C@@H]2CC[C@H](C)OC2)c1O 402035621 JWUIGIYESWYGLH-WCQYABFASA-N 265.353 2.448 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccc(F)cc2O)C1 403823034 LIWQPBSSAQHNJT-SECBINFHSA-N 264.260 2.446 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1ccc(O)cc1F 404047129 HIVRIVUAKDIXTM-NSHDSACASA-N 282.275 2.035 10 10 CECE C[C@@H](NCCC1(O)CCCC1)c1cc(O)ccc1O 404166527 PCRCGJBICVFRJD-LLVKDONJSA-N 265.353 2.444 10 10 CECE C[C@H]1C[C@H](CO)CN1c1ccc(CO)c(C(F)(F)F)c1 2156552659 OLYTZLSDGCNMJB-UWVGGRQHSA-N 289.297 2.405 10 10 CECE CC[C@](C)(NCc1ccc(N2CCCC2)cc1)C(N)=O 312245508 LHYSEPBLQVJXTM-INIZCTEOSA-N 275.396 2.030 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3C[C@H](F)C[C@H]3C)ccc21 2160296033 VTOJRQZZEMQMHU-RULNRJAQSA-N 277.343 2.226 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N(C)[C@H]3CCC[C@H]3F)cc21 2175577441 HJLFENRVDPYWTL-MBNYWOFBSA-N 278.327 2.023 10 10 CECE COc1ccc([C@@H](C)NCC2(O)CCCC2)c(O)c1 87016553 LAZWGVJDABNWFN-LLVKDONJSA-N 265.353 2.357 10 10 CECE C[C@@H](N)c1ccc(N(C)CCOCC2CC2)cc1O 94989832 JPUUTVOQOPNPJK-LLVKDONJSA-N 264.369 2.275 10 10 CECE CN(CCOc1ccc(N)cc1)C1(CO)CCCCC1 2170333462 WZLJKGHVPAWKOV-UHFFFAOYSA-N 278.396 2.275 10 10 CECE OCc1ccc(N2C[C@@H]3CN4CCCC[C@@H]4[C@H]3C2)cc1 2170520361 JCOZDSMSFOYGHD-BHYGNILZSA-N 272.392 2.099 10 10 CECE C[C@@H](O)c1ccc(N2CCC(n3ccnn3)CC2)cc1 2170664188 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C[C@H](c1ccccc1O)N(C)C(=O)C[C@@H]1CC[C@@H](N)C1 380890803 LNEAVSQMCROFQT-JHJVBQTASA-N 276.380 2.429 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cccc(O)c1Cl 380830400 JNOPYHBJFLYBQT-JTQLQIEISA-N 284.703 2.160 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@H]1CCN 2162672596 YPZWBTLNYUAKMN-NXEZZACHSA-N 284.306 2.429 10 10 CECE COC(=O)c1cccc(N)c1N[C@H](C)[C@@H]1CCCCO1 381649013 AODRIFCNSWYLBL-MFKMUULPSA-N 278.352 2.425 10 10 CECE CCN(c1ccc2c(c1)N(C)C(=O)[C@H]2N)C(C)(C)C 382243255 JGIBAYLPJPJARY-ZDUSSCGKSA-N 261.369 2.288 10 10 CECE COC1(C)CN(c2ccc(CNC3CC3)c(C)c2)C1 382618528 YXVUVJGOQKFQMU-UHFFFAOYSA-N 260.381 2.472 10 10 CECE CC1=C(C)CN(c2ccc3c(c2)N(C)C(=O)[C@H]3N)CC1 382939354 UGEOOIGIFOLQJZ-HNNXBMFYSA-N 271.364 2.209 10 10 CECE CN(Cc1ccccc1O)C(=O)c1ccc(O)c(O)c1 384017231 YWBVJQPBXUDGGP-UHFFFAOYSA-N 273.288 2.076 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CC(F)(F)CN3)ccc21 2163060707 CPEVUPUCOHISDP-JSGCOSHPSA-N 282.334 2.100 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CCCC[C@H]3CN)ccc21 2163081008 XIKBRPGVHDKIIO-UXLLHSPISA-N 274.408 2.477 10 10 CECE CN1CCCc2cc([C@](C)(O)c3nccn3C)ccc21 2163095089 AOSCFVSYOFDKAK-INIZCTEOSA-N 271.364 2.058 10 10 CECE Cn1cnc([C@@](C)(N)c2ccc(N3CCCC3)cc2)c1 2163105254 INDUKGZITGOAEB-INIZCTEOSA-N 270.380 2.243 10 10 CECE CCN(CC)c1ccc([C@H](NN)c2ocnc2C)cc1 2163143855 OMEJPAORFRAGDZ-AWEZNQCLSA-N 274.368 2.382 10 10 CECE CN1CCCc2cc([C@@H](N)CCn3ccnc3)ccc21 2163104832 GOIAEGILBLEEHD-HNNXBMFYSA-N 270.380 2.356 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)[C@@H](O)C2)cc1Cl 388313031 XNONVRMAHOQGLU-RVBZMBCESA-N 254.761 2.177 10 10 CECE Nc1ccccc1N[C@H]1CCCN2CCSC[C@H]12 720439428 RQSPQYUFESMXPC-UONOGXRCSA-N 263.410 2.261 10 10 CECE Nc1ccc(OCCNc2cnc(Cl)cn2)cc1 396739472 NQLFLTSEWMQSHC-UHFFFAOYSA-N 264.716 2.203 10 10 CECE CC(C)[C@@H](c1nc(-c2ccc(O)c(O)c2)no1)[C@H](C)N 399512646 NUHQOCOGKJBCPQ-QPUJVOFHSA-N 277.324 2.235 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3[C@H]2C(C)(C)[C@@H]3O)c(F)c1 2178166459 YHHXKJMHOJTJLV-PBUVFVDJSA-N 278.371 2.441 10 10 CECE Nc1ccc(NC(=O)N2C[C@H](O)C3(CCCC3)C2)cc1 2174376765 OFFBBYFAKYEMFF-ZDUSSCGKSA-N 275.352 2.038 10 10 CECE CCc1cc(CO)n([C@H](C)c2c(O)cccc2OC)n1 2070095173 OFMNGHIXLJCLFL-SNVBAGLBSA-N 276.336 2.261 10 10 CECE C[C@H](O)c1ccc(N2CC(C(=O)NC3CC3)C2)cc1Cl 2168050285 BXILKFURNLTABY-VIFPVBQESA-N 294.782 2.108 10 10 CECE Cn1cc(CNCc2cccc(O)c2O)c(C(F)F)n1 2178749970 IILTXSLTEBSMDR-UHFFFAOYSA-N 283.278 2.059 10 10 CECE OC[C@@H](NCc1ccc2c(c1)CCCO2)c1cscn1 2175640353 CJWDSGKLOXJIMQ-CYBMUJFWSA-N 290.388 2.291 10 10 CECE C[C@H](NC1C[C@@H]2C(C(=O)O)[C@H]2C1)c1cc(F)ccc1O 2169246059 XUAZISQXJBMEAK-HRLFPWRHSA-N 279.311 2.291 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CO[C@]3(CCOC3)C2)cc1 2179036332 LHJOGDHRVCGNKL-VBNZEHGJSA-N 276.380 2.091 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(n3cnnc3)C2)cc1 2170189780 VGJPAIPMCUSBRH-LBPRGKRZSA-N 271.368 2.010 10 10 CECE C[C@@H](N)c1ccc(N(C)CCCn2ccnc2)cc1O 2170116081 FQPUXWIANMDAFO-GFCCVEGCSA-N 274.368 2.135 10 10 CECE CC[C@@H]1CN(c2ccc([C@@H](C)N)c(O)c2)C[C@@H]1N(C)C 2170454620 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CCJOMVWZMXRYCW-DVVUODLYSA-N 255.264 2.231 10 10 CECE CCC[C@@H]1C[C@](CN)(N(C)c2ccc(OC)cc2)CO1 2185599794 WLWAJTUIXLRHRV-HZPDHXFCSA-N 278.396 2.418 10 10 CECE CCO[C@@H]1CC[C@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2054441967 XZVMFOQWDIODJP-HBNTYKKESA-N 252.318 2.103 10 10 CECE CO[C@H]1CC[C@@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2059059322 PZXYEDKPKOSINW-VWYCJHECSA-N 252.318 2.103 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@H](C)[C@@H](CO)C2)c(F)c1 2194514675 QOSGPWIPTRIKIP-JFGNBEQYSA-N 285.334 2.473 10 10 CECE CNCc1ccc(N2C[C@@H]3COC[C@@H]32)c(C(F)(F)F)c1 2186369247 CWGVESQZBFZJCL-MFKMUULPSA-N 286.297 2.260 10 10 CECE C[C@H]1C[C@H](CCN)CCN1C(=O)Nc1ccc(N)cc1 2191537749 YHMPCWDJNSREPI-NWDGAFQWSA-N 276.384 2.250 10 10 CECE C[C@@H](Cn1cnnc1)N[C@H](C)c1ccc(N(C)C)cc1 2186704448 PIYNRRYJHYFJOK-QWHCGFSZSA-N 273.384 2.083 10 10 CECE Cc1sc(OCc2ccc(N)cc2)nc1C(=O)O 2064873341 GWSJYZAPZAHHMP-UHFFFAOYSA-N 264.306 2.311 10 10 CECE C[C@H](N[C@H]1CCOC[C@@H]1F)c1ccc(F)cc1O 2066723507 NIHOMOWCLKOIOU-UWJYBYFXSA-N 257.280 2.309 10 10 CECE CO[C@@H]1C[C@@H]1CN(C)[C@H](C)c1ccc(O)cc1O 2067887189 WGZSUOGVZWYKDT-GPCCPHFNSA-N 251.326 2.126 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@@H]2[C@@H]3COC[C@@H]32)C1 2068639668 KVZSLOVHUOPRKL-RVMXOQNASA-N 250.346 2.291 10 10 CECE CCNCc1ccc(N2C[C@H]3CC[C@@]3(CO)C2)cc1C 2198877701 FCGKCPRGWPWASU-WBVHZDCISA-N 274.408 2.313 10 10 CECE COCC(COC)CN(C)CCCc1ccc(N)cc1 2199386346 RDCFXQFCFJRKEF-UHFFFAOYSA-N 280.412 2.042 10 10 CECE CCCOC1CN(c2ccc(C[C@H](C)N)c(C)c2)C1 2102488583 YGZCJAQSTGEYQK-ZDUSSCGKSA-N 262.397 2.500 10 10 CECE COCCO[C@H]1CCN([C@@H](C)c2ccccc2O)C1 2102584268 SDWHHHCGEXBOJZ-STQMWFEESA-N 265.353 2.191 10 10 CECE CN(CCCc1ccc(N)cc1)[C@H]1CC[C@@H](O)CC1 2103874466 LNKRFELMDCPLPM-IYBDPMFKSA-N 262.397 2.437 10 10 CECE Cc1ocnc1CN(C)c1c(F)cc(CO)cc1F 2104096465 OWKXYFUMVWWOJS-UHFFFAOYSA-N 268.263 2.390 10 10 CECE CNCc1ccc(N2CC[C@@](C)(F)C2)cc1OC 2084005263 ODUYLYKGJHDZCS-CQSZACIVSA-N 252.333 2.353 10 10 CECE FC(F)(F)Oc1ccc(N2C[C@@H]3C[C@H](CN3)C2)cc1 2104349112 INSVVPDWQCDYDL-ZJUUUORDSA-N 272.270 2.383 10 10 CECE COc1cccc(O)c1CNCCc1nc(C)cs1 2104439476 PPSQJXZFEFXQQW-UHFFFAOYSA-N 278.377 2.498 10 10 CECE CC[C@@H]1[C@H](C(=O)O)CCN1Cc1c(O)cccc1F 2104512019 FCFLETVEOSJYDK-BXKDBHETSA-N 267.300 2.216 10 10 CECE COC1CC2(C1)CN(c1ccc([C@H](C)N)cc1F)C2 2105950256 CQBUWILPEKBYAN-JTQLQIEISA-N 264.344 2.461 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4CNC[C@@H]4C3)cc21 2106399358 DWODQQZINQEKJO-TXEJJXNPSA-N 258.365 2.012 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H](N)C(F)F)ccc21 2106791077 OUFDTLKAQZAAJK-DGCLKSJQSA-N 270.323 2.085 10 10 CECE CN1CCc2cc([C@H](N)[C@H]3COC(C)(C)C3)ccc21 2106801927 QNTNJZKKVBUFTF-HIFRSBDPSA-N 260.381 2.494 10 10 CECE Nc1ccc(CCNC2(C3CCOCC3)CC2)cc1 2089117677 WOMMOYIXVVYRIF-UHFFFAOYSA-N 260.381 2.360 10 10 CECE Nc1ccc(CN[C@@H](C(=O)O)c2ccccc2)cc1 2092531507 JSKHTSDXRDAIBZ-CQSZACIVSA-N 256.305 2.184 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)C3(CC3)C2)cc1 2093174516 PDLZAELFOMCGCQ-IUODEOHRSA-N 260.381 2.318 10 10 CECE Nc1ccc(CCCNC[C@@H]2[C@@H]3CCOC[C@@H]32)cc1 2093643457 RNTOKFNERKPWJC-XHSDSOJGSA-N 260.381 2.074 10 10 CECE C[C@@H]1C[C@@H]1C(=O)[C@H](O)c1ccc2c(c1)CCCN2C 2094747083 OSQAFJNVXIJBLR-RIEGTJTDSA-N 259.349 2.328 10 10 CECE C[C@@H](N(C)c1ccc2c(c1)NC(=O)[C@H]2O)C(F)(F)F 2095363813 ULWIUEKFZGNCNZ-LDWIPMOCSA-N 274.242 2.059 10 10 CECE Cc1cc(N2CCC[C@H]3OCC[C@@H]3C2)ccc1CO 2095524128 INZKEQQXVMWCDO-CZUORRHYSA-N 261.365 2.493 10 10 CECE CCCN[C@H]1CCN(c2ccc3c(c2)COCC3)C1 2096488636 ULQVKNQNQNMLSV-HNNXBMFYSA-N 260.381 2.338 10 10 CECE CCN(C)[C@H]1CCN(c2ccc(CNC)cc2F)C1 2097709486 IVEAUWFOZKMJNU-ZDUSSCGKSA-N 265.376 2.076 10 10 CECE C[C@@H](C1CNC1)N(C)[C@H](C)c1ccc(N(C)C)cc1 2098264165 VMOQPLKSCCQJRZ-OLZOCXBDSA-N 261.413 2.353 10 10 CECE CCCOc1ccc(N2CC[C@H](OCCN)C2)cc1 2112680134 WIEZUDBMJKROIG-HNNXBMFYSA-N 264.369 2.029 10 10 CECE CN1CC[C@@H]2[C@H](CCN2Cc2c(O)cccc2F)C1 2114504392 CKKHETGMIALICF-BXUZGUMPSA-N 264.344 2.057 10 10 CECE CC(F)(F)Cn1cc(COc2ccc(N)cc2)nn1 2122754276 RDKVRDATDNYUHN-UHFFFAOYSA-N 268.267 2.095 10 10 CECE CCCNCc1ccc(N2CCO[C@H](C)C2)cc1OC 2204552174 YSPCVJJELBUYOT-CYBMUJFWSA-N 278.396 2.420 10 10 CECE N[C@H]1CCCc2cc(N3Cc4cncnc4C3)ccc21 2206190384 SXDRXPVJYQFYJA-HNNXBMFYSA-N 266.348 2.333 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2c[nH]nc2C2CC2)C1 2269190285 IJNQDNSEZKAWHQ-SECBINFHSA-N 260.301 2.202 10 10 CECE CC[C@H](N[C@H]1COC[C@H]1CN(C)C)c1ccccc1O 2206393492 RZKFJLFGQRATEW-SNPRPXQTSA-N 278.396 2.010 10 10 CECE Nc1ccc(CCOc2cncc(F)c2C(=O)O)cc1 2207180192 XTWNXANNBVLRMG-UHFFFAOYSA-N 276.267 2.123 10 10 CECE CSc1ncc(CNCCOC2CCOCC2)s1 2208495949 QRZNAMFITUUOGO-UHFFFAOYSA-N 288.438 2.150 10 10 CECE COCCN(C[C@H](C)O)c1ccc([C@H](C)N)cc1Cl 2272392470 RASKPHOGTVEXIA-QWRGUYRKSA-N 286.803 2.193 10 10 CECE CO[C@@]12CC[C@H]1CN(c1ccc(CCN)c(C)c1)C2 2230542617 CSDOLYUJOQGACV-GOEBONIOSA-N 260.381 2.111 10 10 CECE Cc1cc(CNC2CCC2)ccc1N(C)C[C@@H](C)O 2231463348 OCCIHGSIMYGWMD-CYBMUJFWSA-N 262.397 2.454 10 10 CECE Nc1ccc(NC(=O)CO[C@H]2C[C@H]3CC[C@H]2C3)cc1 2231957009 OFUHIZUNYDLDHK-MJVIPROJSA-N 260.337 2.413 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC[C@@H](C2(O)CC2)C1 2232026471 GZKMKTHVSSWELQ-TZMCWYRMSA-N 260.381 2.366 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C[C@@H]1[C@@H]2CCO[C@@H]21 2232091400 GQEJBZOHEZDNFI-ZIEJDFEHSA-N 260.381 2.486 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@H]2C(N(C)C)[C@@H]2C1 2232033239 LAFMYICKIUFRBA-IACUBPJLSA-N 259.397 2.011 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc([C@@H](C)N)cc1C)C2 2232104587 MESWEVIWWXYXDI-XNRPHZJLSA-N 260.381 2.487 10 10 CECE CCN(CC1CN(C)C1)c1ccc([C@H](C)N)cc1C 2232100537 NQGDCGGYBAWXTQ-ZDUSSCGKSA-N 261.413 2.403 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H]3C[C@H](C[C@H]3N)C2)c1 2234889585 UTMKOHOAIDYYLV-OZTPJHRESA-N 276.380 2.131 10 10 CECE COc1ccc(N(C)[C@@H]2CO[C@@H](C3CC3)C2)c(CN)c1 2235965730 IMIQYDQLCUFPLJ-XJKSGUPXSA-N 276.380 2.158 10 10 CECE COc1ccc(N2[C@@H](CO)CCC23CCC3)c(CN)c1 2235977721 VANSHIRUMATIMU-CYBMUJFWSA-N 276.380 2.038 10 10 CECE CNCc1cc(OC)ccc1N1CCC(CCO)CC1 2235977968 XIZYSVFUESETEP-UHFFFAOYSA-N 278.396 2.013 10 10 CECE COc1ccc(N2CCC[C@H](OC)[C@@H]2C)c(CCN)c1 2235970273 NYKOLYSLSHJZGL-LRDDRELGSA-N 278.396 2.200 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@H](O)C(C)(C)C1 2235969082 ZOLOVZBDSMHHHV-OAHLLOKOSA-N 278.396 2.012 10 10 CECE COc1ccc(N(C)CC23CC(CCO2)C3)c(CO)c1 2236004413 YBJOPHKBEGCWJP-UHFFFAOYSA-N 277.364 2.193 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@H]1CC[C@H]1OC 2236119622 BYDHTJOKTIJSSA-LSDHHAIUSA-N 276.380 2.432 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@H]1CO 2226707031 PMLDOPQIJBZPAR-IUCAKERBSA-N 271.263 2.073 10 10 CECE COc1ccc(N2CCCC[C@@H]2CCO)cc1OC 2226797718 IUNAJDYIWIIOFA-GFCCVEGCSA-N 265.353 2.445 10 10 CECE O[C@H]1C[C@@H](F)CN(c2ccc(OCC(F)F)cc2)C1 2226739570 NNAPTMXSYPFILX-KOLCDFICSA-N 275.270 2.240 10 10 CECE COc1ccc(N2CC[C@H](O)CC23CC3)cc1OC 2226805375 JJNITWSYBCVVPQ-LBPRGKRZSA-N 263.337 2.198 10 10 CECE COc1ccc(N2C[C@@H]3C[C@@H](C)[C@H]3C2)c(CCN)c1 2227686189 PJOXVLZIABJGPZ-OSAQELSMSA-N 260.381 2.289 10 10 CECE CCNCc1cc(OC)ccc1N(C)CCCOC 2227682380 OMIJWXOUWCMKEF-UHFFFAOYSA-N 266.385 2.277 10 10 CECE C[C@H]1C[C@@](Oc2ccc(N(C)C)cc2)(C(=O)O)CCO1 2237704892 PKMJOQYWBSSBEO-XHDPSFHLSA-N 279.336 2.154 10 10 CECE CN(C[C@H](F)[C@H]1CCOC1)c1ccc(CN)c(F)c1F 2238326854 LMSKZEFCDHFWSF-QWRGUYRKSA-N 288.313 2.234 10 10 CECE C[C@@H](Cn1ccc2c(c1=O)CNCC2)CC(F)(F)F 2228426619 YYBXHXALDHPQLA-SECBINFHSA-N 274.286 2.083 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCN(C)C(=O)C1(C)C 2240831745 VUXUJDQFRVXAHA-LBPRGKRZSA-N 276.380 2.105 10 10 CECE CN[C@H](C)c1ccc(N(C)C(COC)COC)cc1C 2285139602 OGXUIZSHRXLVNP-CYBMUJFWSA-N 280.412 2.373 10 10 CECE COC[C@]1(C)C[C@H]1N[C@@H](C)c1cc(O)ccc1O 2257098965 YURHJIVUXNSKNZ-FZZIBODNSA-N 251.326 2.173 10 10 CECE CSc1ncc(CNC[C@H]2C[C@@H]3CNC[C@@H]3C2)s1 2257133841 VZHNUSPKJRBGQA-JGPRNRPPSA-N 283.466 2.200 10 10 CECE CSc1ncc(CN[C@@H]2CCC[C@@]23CCNC3)s1 2257100712 CWFWKQXIVTYGAG-YPMHNXCESA-N 283.466 2.487 10 10 CECE C[C@H](OC(=O)CCOc1ccc(N)cc1)C(F)F 2258208997 ZYFZIUQCHGNISI-QMMMGPOBSA-N 259.252 2.235 10 10 CECE CNC[C@H]1CN(Cc2cnc(SC)s2)C[C@@H]1C 2248737960 BBXWCKAAJWCRNV-UWVGGRQHSA-N 271.455 2.152 10 10 CECE CN[C@@H](c1ccccc1O)C1(O)CCC(F)CC1 2259172473 PHLPVWNHXFNNDY-AWAWDMARSA-N 253.317 2.296 10 10 CECE CC1(C)CN(c2ccc(OC(F)F)cc2)C[C@H]1N 2263917429 ZVNOYARJXCNWBX-LLVKDONJSA-N 256.296 2.462 10 10 CECE Cc1ccc([C@H](C)NCCN2CC[C@@H]3C[C@@H]32)c(O)c1 2274439235 VLBPKXJUSDPIMA-GUTXKFCHSA-N 260.381 2.445 10 10 CECE O=C(O)[C@@]1(CF)CCN(Cc2c(O)cccc2Cl)C1 2266501822 AKZYIGLWCNHTQD-CYBMUJFWSA-N 287.718 2.292 10 10 CECE Cc1cccc(CNCC2(CO)CC(F)(F)C2)c1O 2266922516 ASJBUUSHSPCYHC-UHFFFAOYSA-N 271.307 2.198 10 10 CECE COc1c(F)cc(N2CCN[C@H](C(C)C)C2)cc1F 2268033855 AWNRDQCEUUFXMQ-ZDUSSCGKSA-N 270.323 2.408 10 10 CECE Cc1cc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)ccc1[C@H](C)N 2269661755 PXAPAGDIKDWCLD-QCQGSNGOSA-N 260.381 2.079 10 10 CECE Cc1cc(N2CCC(F)(CO)CC2)ccc1[C@@H](C)O 2269695942 NXKPNRSNOVGKCN-GFCCVEGCSA-N 267.344 2.349 10 10 CECE CC1(C)CCc2c(O)nc(-c3ccc(O)c(O)c3)nc21 2290304883 JZJGICBSRCVCOE-UHFFFAOYSA-N 272.304 2.484 10 10 CECE COc1ccc(N(C)C[C@@]23CC[C@@](CN)(CO2)C3)cc1 2290480857 JBSSKTQDLRGEIS-CVEARBPZSA-N 276.380 2.029 10 10 CECE O=C(O)CCCN1C(=O)C(=Cc2ccco2)SC1=S 2293034809 GVNQGVLYSOUCNH-UHFFFAOYSA-N 297.357 2.346 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1ccc(Cl)cc1OC 2283148882 QMZBPMWFGORISF-LLVKDONJSA-N 298.730 2.463 10 10 CECE CNCc1cc(OC)ccc1N1CC=C[C@@]1(C)COC 2284636621 LBEWHQMAMIDIOV-INIZCTEOSA-N 276.380 2.196 10 10 CECE CN1CCc2cc([C@@]3(O)C[C@H]4CC[C@H]3C[C@@H]4N)ccc21 2284881031 SWTKPWFHJFFBMS-DYWXZXKOSA-N 272.392 2.014 10 10 CECE COC(=O)c1cc(C)cnc1OCc1ccc(N)cc1 2296376401 XLPOOKOOVPOWHB-UHFFFAOYSA-N 272.304 2.338 10 10 CECE COCCCCCS(=O)(=O)CCCc1ccc(N)cc1 2287492912 XERDRGVMEDZHTF-UHFFFAOYSA-N 299.436 2.433 10 10 CECE C[C@@H](O)CN(CCOc1ccc(N)cc1)CC(C)(C)C 2288148640 BUUMYTWAKKRWAW-CYBMUJFWSA-N 280.412 2.377 10 10 CECE CC(C)[C@]1(NC(=O)Nc2ccc(N)cc2)CCCNC1 2289918472 AVEWNOCJOHKOEE-HNNXBMFYSA-N 276.384 2.169 10 10 CECE Oc1ccc(Cl)cc1CN1CCOC[C@@H](F)C1 2299883684 UNACDAVRFIRGNN-NSHDSACASA-N 259.708 2.216 10 10 CECE OC[C@H]1C[C@H](NCc2cc(Cl)ccc2O)[C@@H]2C[C@H]12 2309228354 FNIXRCAKUQENPP-JHEVNIALSA-N 267.756 2.152 10 10 CECE Oc1cccc(F)c1CNC[C@H]1C[C@@H]2C[C@@H]2CO1 2310160138 AZKGNWVXMPAAEI-HBNTYKKESA-N 251.301 2.046 10 10 CECE C[C@@H](N[C@@H]1C[C@@H]2CO[C@H]1C2)c1ccc(F)cc1O 2313120812 NVCWYRQOYJIVMC-UGIUPUBSSA-N 251.301 2.359 10 10 CECE CCN1CCc2cc([C@@H](NN)[C@H](C)SC)ccc21 2314319574 NYLUIURHBFCENY-HZMBPMFUSA-N 265.426 2.325 10 10 CECE Nc1cc(F)c(COc2cccnc2N)cc1F 2319993155 NJCSUJDRWHHYNU-UHFFFAOYSA-N 251.236 2.103 10 10 CECE O=C(O)[C@]1(Sc2nccs2)CCC[C@@]12CCNC2 2326888282 APYUYWJRLQIRDB-NWDGAFQWSA-N 284.406 2.222 10 10 CECE CC(C)NCc1ccc(N(C)CCO)cc1C1CC1 2339163793 OVYZJNGBBVCIJM-UHFFFAOYSA-N 262.397 2.491 10 10 CECE CCC(O)(CC)CN1CCc2cc(O)c(O)cc2C1 2341216409 LAYADOWLZRUQGV-UHFFFAOYSA-N 265.353 2.007 10 10 CECE COc1ccc(N(C)[C@@H]2CNC[C@@H](C(F)F)C2)cc1 2353492563 DKDWMGIJEQDCGS-JQWIXIFHSA-N 270.323 2.375 10 10 CECE CS[C@@H]1CC[C@@H]1N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 2353497408 QVOPUUAJXLNXTJ-YNEHKIRRSA-N 278.377 2.002 10 10 CECE CO[C@H]1CN(c2ccc([C@@H](C)O)c(Cl)c2)[C@@H]2COC[C@@H]21 2354353859 IGLQMBHREAUKNJ-PWFWHMEDSA-N 297.782 2.243 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@H]1NC[C@@H]2C[C@H]12 2354608150 JNKQYVLRLLQKTI-QSPRXWTASA-N 272.392 2.318 10 10 CECE CCOC(=O)C(C)(C)/N=N/C(C)(C)C(=O)OCC 111858007 XNICETZFWREDRJ-BUHFOSPRSA-N 258.318 2.122 10 10 CECE COCCNCc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1C 62734284 CHLBRIILBAGKBI-GASCZTMLSA-N 292.423 2.345 10 10 CECE COCCCN(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 62033162 MKSIWVSPMFOJFM-FNORWQNLSA-N 294.307 2.165 10 10 CECE COCCNCc1ccc(N2CCCO[C@H](C)C2)cc1C 62738359 CWVGJWAFHOOZPY-OAHLLOKOSA-N 292.423 2.346 10 10 CECE CCOc1ccc(O)c(CN[C@@H]2C[C@@H](O)C2(C)C)c1 189341605 GYKLGVOEWGYJOK-ZIAGYGMSSA-N 265.353 2.040 10 10 CECE Nc1ccc(NC(=O)N2CC(=O)Nc3ccccc32)cc1 35408016 SOCGKZZZMQTBJJ-UHFFFAOYSA-N 282.303 2.259 10 10 CECE Cc1cc(O)c(CN2CCO[C@@]3(CCOC3)C2)cc1C 184292005 GWJBZHJRLQRGHX-INIZCTEOSA-N 277.364 2.000 10 10 CECE CC(C)NCc1ccc(N2C[C@H](C(N)=O)CC[C@@H]2C)cc1 42438228 MKRADAIXGYTNFD-DZGCQCFKSA-N 289.423 2.275 10 10 CECE CCC[C@@H](N)CCN1CCN(c2ccc(OC)cc2)CC1 136031328 NEVPZHLITRWWML-OAHLLOKOSA-N 291.439 2.335 10 10 CECE C[C@H]1CCCCN1C(=O)[C@@H]1CNc2ccccc2N1 229876288 VXBXHNPGEDVARC-FZMZJTMJSA-N 259.353 2.294 10 10 CECE CC[C@@H](CC(=O)O)NC(=O)/C=C/c1ccc(N(C)C)cc1 135417856 OPTRNSRKDTXOAS-RSPDNQDQSA-N 290.363 2.135 10 10 CECE N[C@@H](C(=O)O)c1cccc(OCc2ccccc2)c1O 220885973 FFXHYPLSRPEGAB-CYBMUJFWSA-N 273.288 2.056 10 10 CECE O=S(=O)(Nc1ccc(O)cc1Cl)c1cccnc1 85205133 SBUMOXFDEODBDJ-UHFFFAOYSA-N 284.724 2.241 10 10 CECE C[C@@H](N)c1c(F)cc(F)c(Br)c1O 238414130 MLRSTMBHDIIQEP-GSVOUGTGSA-N 252.058 2.453 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)c1ccc(F)cc1F 90258703 WVYBDPNUDBVOFX-SNVBAGLBSA-N 270.239 2.381 10 10 CECE CSc1ccc([C@H](NCCN=[N+]=[N-])C(=O)O)cc1 90256459 BELHSRGCWRGPND-JTQLQIEISA-N 266.326 2.434 10 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2.454 10 10 CECE c1cc2c(cc1N1CC[C@H]3CCN[C@H]3C1)OCCCO2 2162672974 NSQWKZXBGOWGSX-OCCSQVGLSA-N 274.364 2.036 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](C)c1cccc(Cl)c1 808520900 ADYIFHLBPRMBIA-QMMMGPOBSA-N 268.696 2.145 10 10 CECE COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1 293342906 DFLBNWKTGQHRPO-AWEZNQCLSA-N 276.380 2.056 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1cnn(C)c1C 2163137980 IUZOLWASCFYDHZ-MRXNPFEDSA-N 270.380 2.030 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2C[C@H]3OCC[C@@H]3O2)cc1 2163197294 BTVWFFUBBXFGER-VCOSZWKGSA-N 276.380 2.089 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)cc1 2163565087 RHUMXJPLGCBBTE-HLLBOEOZSA-N 274.408 2.393 10 10 CECE CN1CCN(c2ccc(CN[C@@H]3CC34CC4)cc2)CC1 818230187 OAILWZZSEBDNBE-MRXNPFEDSA-N 271.408 2.081 10 10 CECE CCCN(CC(N)=O)c1ccc([C@@H](C)NCC)cc1F 723170073 ZABPFSMJZZBQCS-LLVKDONJSA-N 281.375 2.198 10 10 CECE CCN(C)c1ccc(CN2CC[C@H]3CN(C)C[C@H]32)cc1 815120326 GNJAIENOWRNQEE-DOTOQJQBSA-N 273.424 2.279 10 10 CECE Oc1c(Cl)cccc1CN1CC[C@H](Cn2ccnn2)C1 826845315 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2163141664 WUSQRGZUCOSJKD-HOTGVXAUSA-N 274.408 2.476 10 10 CECE Cc1ccc([C@@H](O)[C@@H](N)c2ccc3c(c2)CCN3C)o1 2163142266 AOYBORKKZMHKID-JKSUJKDBSA-N 272.348 2.314 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@@](C)(O)C1CC1 2163148383 WVUVJNAJPGODNV-IRXDYDNUSA-N 274.408 2.491 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@]3(CNC(=O)C3)C2)cc1Cl 2163342835 QTGDXKKVVRIPGW-ZUZCIYMTSA-N 293.798 2.076 10 10 CECE CCCC(=O)CNC(=O)/C=C/c1ccc(N(C)C)cc1 717163979 FPHROVCQKNHTEW-DHZHZOJOSA-N 274.364 2.251 10 10 CECE COC(=O)c1cccc2sc(C(=O)O)c(O)c12 725308096 GAVJHRKJVZCTCE-UHFFFAOYSA-N 252.247 2.092 10 10 CECE CN(C)c1ccc(/C=C\CNC2(CC(=O)O)CC2)cc1 901478017 RTYCMXXOQFFTJV-ARJAWSKDSA-N 274.364 2.363 10 10 CECE CN(C)C[C@H]1CCN(Cc2cc3c(cc2O)CCC3)C1 738226178 VQIOMWRMZWBPAK-CYBMUJFWSA-N 274.408 2.264 10 10 CECE O=C(NCC(=O)C1CC1)c1cc2cc(O)c(O)cc2s1 901301254 BPOKXCDCJCPKDV-UHFFFAOYSA-N 291.328 2.021 10 10 CECE CN(C)c1ccc(/C=C\CN2CCN(C3CC3)C(=O)C2)cc1 835028969 OLNHPNRBYRFMOH-ARJAWSKDSA-N 299.418 2.072 10 10 CECE CN(C)c1ccc(/C=C/CN2CCC3(C2)OCCO3)cc1 835029347 WTWLOUDTWKBIQP-ONEGZZNKSA-N 288.391 2.215 10 10 CECE CC(C)(C)C(C)(C)NC(=O)c1cc(O)c(O)c(O)c1 2132351673 ZBWQNIUFVVYAAO-UHFFFAOYSA-N 267.325 2.358 10 10 CECE N[C@@H](c1c(Cl)ccc(C(=O)O)c1O)C(F)F 687732923 MSTVPJYVBUCMCM-LURJTMIESA-N 251.616 2.009 10 10 CECE CCCN1CCC[C@@H]1C(=O)NCc1c(O)cccc1F 928712342 RTICSTNQZGVJEM-CYBMUJFWSA-N 280.343 2.022 10 10 CECE COCc1n[nH]c(CN[C@H](C)c2ccc(Cl)cc2O)n1 850517727 ZWGZVOJUCJLJEH-MRVPVSSYSA-N 296.758 2.161 10 10 CECE COc1ccc(N2CC[C@H](N[C@H](C)[C@@H](C)OC)C2)cc1 850488940 PQABYAIENUNRKE-MCIONIFRSA-N 278.396 2.287 10 10 CECE Cc1cc(O)c(CN[C@H]2C[C@@H](O)C23CCC3)cc1C 850387940 DCONVJTWNQYZBJ-LSDHHAIUSA-N 261.365 2.402 10 10 CECE C[C@H](N)c1ccc(N2CCCC[C@@H](CO)C2)cc1O 696686066 LLRCFAXFABDOSS-NWDGAFQWSA-N 264.369 2.011 10 10 CECE CC(=O)C(=O)COC(=O)[C@]1(c2ccccc2)CC1(C)C 850293698 YIENFSUXYUHANF-MRXNPFEDSA-N 274.316 2.056 10 10 CECE Cc1ncc(NCc2ccc(N(C)C)cc2)cc1C(N)=O 865295586 IMFPKHDQANSLHA-UHFFFAOYSA-N 284.363 2.167 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@H]1C[C@@H](C(=O)O)C1 693013589 JTCXYHKNNVBEKB-ATZCPNFKSA-N 267.300 2.387 10 10 CECE C[C@@H](O)[C@@H](C)Nc1c(N)cccc1Br 697482087 XKUZJKBNKJDPLD-RNFRBKRXSA-N 259.147 2.213 10 10 CECE CCOC[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 779075368 YEMXHEWKUSMLGA-VHSXEESVSA-N 268.313 2.376 10 10 CECE CC1(C)CC[C@H](CNC(=O)c2cc(O)cs2)OC1 881513073 FUVMPAKOEFPZRT-SNVBAGLBSA-N 269.366 2.389 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@](C)(O)C2)c(C)c1 1876951978 MVWOSCRBDOJOKO-XJKSGUPXSA-N 262.397 2.312 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@]12C[C@H](CN1)C2 1877340954 QCEPJRAOOMCWTA-WQVCFCJDSA-N 258.365 2.072 10 10 CECE CN(Cc1cc(F)cc(F)c1O)[C@H]1CCN(C2CC2)C1 894003500 LTSKINZNXPDJIB-ZDUSSCGKSA-N 282.334 2.339 10 10 CECE CCOc1ccc(O)c(CN2CCOCC3(CC3)C2)c1 783598871 CLNNEKCOJNWLAE-UHFFFAOYSA-N 277.364 2.403 10 10 CECE CCOc1ccc(O)c(CNCC[C@H]2CCOC2)c1 784664386 QMNGNGIEWUOHFQ-LBPRGKRZSA-N 265.353 2.307 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1CNCc1ccc(N)cc1 1955969923 SYTZFUQEDJDFKK-OCCSQVGLSA-N 291.395 2.272 10 10 CECE Cc1ccc([C@H](C)N(CC(N)=O)CC(C)C)c(O)c1 132894520 NIIQFVBZCZCFTL-LBPRGKRZSA-N 264.369 2.205 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)[C@H]2COC[C@@H]2C)c(F)c1 1880961059 SGXUNEZFLSXNJK-RWEMILLDSA-N 270.323 2.456 10 10 CECE C[C@H](N)c1cc(F)c(N(C)Cc2csnn2)c(F)c1 1880929099 UUNBFMYGQMVANW-ZETCQYMHSA-N 284.335 2.472 10 10 CECE NCCN(CC(F)F)c1ccc(OCC(F)F)cc1 1879912837 PCXUMWIPOXMBEJ-UHFFFAOYSA-N 280.265 2.361 10 10 CECE COC1(CNCc2ccc(O)cc2O)CCSCC1 1879925579 JWBOSHPVCDFSJV-UHFFFAOYSA-N 283.393 2.100 10 10 CECE C[C@H](O)c1cc(F)c(N2CC(CN(C)C)C2)c(F)c1 1880490830 RHOMRLAYWJVEDW-VIFPVBQESA-N 270.323 2.016 10 10 CECE C[C@@H]1CCC(F)(F)CN1C(=O)Cc1ccc(N)cc1 1341685318 HKAXEYABMFUOQQ-SNVBAGLBSA-N 268.307 2.458 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CCCCS1 1152064757 ZCDQWGCDVRNXBA-LLVKDONJSA-N 281.377 2.042 10 10 CECE Oc1cc2c(c(O)c1O)CCN[C@@H]2[C@@H]1C[C@@H]2C=C[C@H]1C2 75819054 XMAMDASSRFKKFD-SZRLZVLASA-N 273.332 2.202 10 10 CECE CN1C[C@@H]2[C@@H](CC[C@H]2NCc2cccc(Cl)c2O)C1 1474756616 JUVFKYMFIRRWJH-OUCADQQQSA-N 280.799 2.475 10 10 CECE NC(=O)c1ccccc1NCc1cc(F)ccc1O 83439258 NQHCOGQRCCHRFB-UHFFFAOYSA-N 260.268 2.242 10 10 CECE O=[N+]([O-])c1cnc(NCc2cccc(O)c2O)s1 83494374 RKRFDRVLTWKGIN-UHFFFAOYSA-N 267.266 2.075 10 10 CECE CNCc1ccc(N2CCC[C@@H]3COC[C@H]32)c(C)c1 702082240 UWNPMUFSNNYEDJ-GDBMZVCRSA-N 260.381 2.330 10 10 CECE CNCc1ccc(N2CCC23CCOCC3)cc1C 707680006 QDYHYPIYGVTLMT-UHFFFAOYSA-N 260.381 2.474 10 10 CECE Oc1cccc(Cl)c1CNCc1nnc2ccccn12 83551454 HWOZOHLXHRYHPQ-UHFFFAOYSA-N 288.738 2.378 10 10 CECE O=C(NCC[C@@H]1CCCS1)c1cccc(O)c1O 715971946 GCYCKKPYYKNZJU-VIFPVBQESA-N 267.350 2.113 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccc(O)c(Cl)c1 42012936 IPMKQRGIHTXDLC-UHFFFAOYSA-N 254.677 2.476 10 10 CECE C[C@H](NC(=O)N(C)Cc1ccccc1O)c1ccn(C)n1 1251789831 XCFOPFHZDMNNQX-NSHDSACASA-N 288.351 2.028 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CCN3CCCC[C@H]23)c1 71407559 XTYNLLBJLYPZIS-HUUCEWRRSA-N 260.381 2.417 10 10 CECE [N-]=[N+]=NCCCCNC(=O)C1C[C@H]2[C@H](C1)C2(F)F 693302258 FXEDCLYGLHSEDV-IUCAKERBSA-N 258.272 2.484 10 10 CECE COC(=O)[C@H](CC(C)C)N(C)Cc1ccc(N)cc1 695046659 COWYINJKUITHQO-AWEZNQCLSA-N 264.369 2.288 10 10 CECE CC(C)C(=O)N1CCN(Cc2c(O)cccc2Cl)CC1 768184425 HLNCHIBYZGDLEZ-UHFFFAOYSA-N 296.798 2.346 10 10 CECE CCOC(=O)[C@](C)(NCCCN=[N+]=[N-])c1cccnc1 90259889 SCKHUFPGZZRIES-CYBMUJFWSA-N 277.328 2.150 10 10 CECE CN(Cc1ccc(N)cc1)[C@H]1CCC[C@H](S(C)(=O)=O)C1 94637553 PZSXAJVRRRXAFI-GJZGRUSLSA-N 296.436 2.056 10 10 CECE COc1ccc(N2CCN[C@H](C)[C@@H]2C(F)(F)F)cc1 2115970592 QPDPDCNUPPUATO-BXKDBHETSA-N 274.286 2.424 10 10 CECE C[C@H](O)c1ccc(N2CC(N(C)C3CC3)C2)c(F)c1 2116381947 PXGXPUVFDFPWHR-JTQLQIEISA-N 264.344 2.162 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@@H]1CCCC[C@@H]1F 2118944818 JGPWDJDJJOLULF-WDEREUQCSA-N 267.300 2.451 10 10 CECE C[C@@H]1N[C@H](c2ccc(N(C)C)cc2)CC[C@@H]1C(=O)O 2120212501 FXSVHDHMTBIDFM-BPNCWPANSA-N 262.353 2.266 10 10 CECE CC1(C)C[C@@]1(C)CNC(=O)c1c(F)ccc(O)c1O 1611636500 MHWSCSSSPDJRKO-AWEZNQCLSA-N 267.300 2.403 10 10 CECE CC=C(C)[C@H](N)[C@H](O)c1ccc2c(c1)CCCN2C 2120356596 BOLVUQZKWOUBFB-JKSUJKDBSA-N 260.381 2.396 10 10 CECE CCCC[C@@H](O)CCC(=O)NCc1c(O)cccc1O 1558536142 UHWAHXNRWYUTTF-LLVKDONJSA-N 281.352 2.045 10 10 CECE CN(c1cc(Cl)c(CN)cc1F)[C@@H](CCO)C(F)F 2121998788 SRBMXRFNLXYDDB-JTQLQIEISA-N 296.720 2.390 10 10 CECE N[C@@H]1COc2cccc(O)c2[C@@H]1N1CCCCCC1 211970870 VRQCLJFNHLBTLV-IAQYHMDHSA-N 262.353 2.029 10 10 CECE O=C(NCc1ccc(O)cc1O)c1cccc(F)c1 1626833721 ILSHIZWDJSXIBZ-UHFFFAOYSA-N 261.252 2.167 10 10 CECE Cc1ccc(F)c(C(=O)NCc2c(O)cccc2O)c1 1558534223 QGLBSQJWYYFVFB-UHFFFAOYSA-N 275.279 2.475 10 10 CECE COc1ccc2c(c1)SC[C@H](C)N2CCCN 215031557 SNQIMLHOEQUPIK-JTQLQIEISA-N 252.383 2.345 10 10 CECE CCO/C=C/C(=O)NCc1ccc2cccnc2c1O 1638573174 LYGBULMHYBTXII-VQHVLOKHSA-N 272.304 2.107 10 10 CECE CCC[C@H](C)NC(=O)[C@H](C)N1CCC[C@H]1CN=[N+]=[N-] 2123016307 WNMNRRNOIUWJJM-SRVKXCTJSA-N 267.377 2.454 10 10 CECE O=C(NCc1c(O)cccc1O)C1C[C@@H]2CC[C@H](C1)S2 1635850422 MGEZDIULFKBDPN-FGWVZKOKSA-N 293.388 2.388 10 10 CECE C/C(=C\C(=O)N1C[C@@H](CO)c2ccccc21)c1cnccn1 1641232834 IJCWBFJZCSATKR-RPHSKFLZSA-N 295.342 2.003 10 10 CECE Cc1cc(C(=O)NCc2c(O)cccc2O)nn1C(C)C 1645363184 PIOKOCYCIFIJCV-UHFFFAOYSA-N 289.335 2.114 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1CCC[C@@H]2C[C@@H]21 1647290197 PCAZDKYGHQYZAN-MXWKQRLJSA-N 261.321 2.150 10 10 CECE CC(C)(C)[C@@H]1C[C@H]1C(=O)NCc1c(O)cccc1O 1652628883 NOMOYPXZSISDSB-MWLCHTKSSA-N 263.337 2.396 10 10 CECE O=C(CCNCc1ccc(Cl)cc1O)N1CCCC1 1964023049 ISQNKAILAVIHIM-UHFFFAOYSA-N 282.771 2.148 10 10 CECE COCCO[C@@H]1CCCN(Cc2ccc(F)cc2O)C1 1964554415 LOYLJFTYAGOBRA-CQSZACIVSA-N 283.343 2.159 10 10 CECE COCCN(CCF)c1ccc2c(c1)CCC[C@H]2O 2128270962 AZAGZQAECWKFNH-OAHLLOKOSA-N 267.344 2.479 10 10 CECE CN[C@H]1CCc2cc(N3CC=CC[C@H]3CO)ccc21 2128298186 OOIXQPWQCUCGPZ-HOCLYGCPSA-N 258.365 2.021 10 10 CECE Cc1cc(C)c(O)c(CN2CCN(C3CC3)CC2)c1 164243137 PLWOPCRIPCDKQA-UHFFFAOYSA-N 260.381 2.289 10 10 CECE OC[C@H]1CCCCN1c1ccc2c(c1)CCC[C@H]2O 2128276850 GPGQOKSXBAVLJO-GDBMZVCRSA-N 261.365 2.408 10 10 CECE C[C@@]1(CO)CCCCN1c1ccc2c(c1)CC[C@@H]2O 2128317856 HQTAVSOVOJGOPP-HOTGVXAUSA-N 261.365 2.408 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)CC[C@@H]3O)CCN1C 2128320251 BUMPJYQFNHBPFB-BBRMVZONSA-N 260.381 2.197 10 10 CECE CCN(CCCN(C)C)c1ccc2c(c1)CC[C@@H]2N 2128318480 LRSXTOURYNRRRE-INIZCTEOSA-N 261.413 2.411 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3N)C[C@@H](C)C1O 2128319246 QSDCDEVMLYNOEW-HFAKWTLXSA-N 260.381 2.086 10 10 CECE CCOc1ccc(CNC[C@@H]2CCCNC2)cc1C 258921899 GGLJGMQRZDFGDU-OAHLLOKOSA-N 262.397 2.483 10 10 CECE CC(C)NC(=O)[C@H]1CCCN(c2ccc(N)cc2)C1 32112027 NRWXGUIEWHNUCB-LBPRGKRZSA-N 261.369 2.010 10 10 CECE Nc1ccc(NC(=O)CCCCn2ccccc2=O)cc1 33512760 NPLINRPJMWOYQU-UHFFFAOYSA-N 285.347 2.240 10 10 CECE CCCCN(CC1=C[C@H](O)[C@@H](N)C1)c1ccccc1 2131471894 BMNZLALZFSOCQD-HOTGVXAUSA-N 260.381 2.311 10 10 CECE CCn1cnc(CNCc2ccc3c(c2)CCO3)c1 902155722 GPOHAXASBJFNEL-UHFFFAOYSA-N 257.337 2.128 10 10 CECE 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GCACEQHEONPKLS-SWLSCSKDSA-N 263.337 2.060 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@]23CCOC[C@@H]2C3)CC1 1880222555 IOPSGRWEXJCCST-LOWVWBTDSA-N 264.329 2.104 10 10 CECE Cc1noc(C)c1[C@@H](C)C(=O)NCc1cc(O)ccc1O 1153879145 HANVHBYSTFTUSD-MRVPVSSYSA-N 290.319 2.123 10 10 CECE CCN1C[C@@H](C(=O)O)Cc2cc(OC)c(Cl)cc21 84802733 YCOWHAOAOOMRNH-VIFPVBQESA-N 269.728 2.432 10 10 CECE O=C(c1cccs1)[C@H]1NCCc2c1ccc(O)c2O 75794213 FRKLFEPBVSBFSC-LBPRGKRZSA-N 275.329 2.229 10 10 CECE O=C(c1cc(O)cs1)N1CCOc2ccc(O)cc2C1 1167706893 SOXIEEOPVMBYSF-UHFFFAOYSA-N 291.328 2.194 10 10 CECE COc1ccc2c(c1O)[C@H](c1cncc(C)c1)NCC2 83708265 QFXTZUIIQXIFRA-HNNXBMFYSA-N 270.332 2.339 10 10 CECE CC(=O)c1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)n(C)c1 701263733 JCJQRYUBSNEICV-NSHDSACASA-N 275.312 2.143 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](CCN(C)C)C2)cc1 701421598 UEUOCDANLZRPIR-ZIAGYGMSSA-N 261.413 2.484 10 10 CECE Oc1c(CNCc2cscn2)ccc(F)c1F 703260192 XSLYRPOBPNROSQ-UHFFFAOYSA-N 256.277 2.417 10 10 CECE C[C@H]1CC[C@H](NCc2ccc(F)c(F)c2O)CO1 703285822 LFGJYKBKMUPHQS-WPRPVWTQSA-N 257.280 2.328 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@H]2CNC[C@@]2(C)C1 703594022 JSFFNVZMHMMUQU-UNEWFSDZSA-N 273.424 2.355 10 10 CECE CN(Cc1ccsn1)c1ccc(CN)cc1F 705694579 KEIPFONFCFDIPZ-UHFFFAOYSA-N 251.330 2.377 10 10 CECE COC[C@@H]1CN(c2ccc([C@H](C)O)c(Cl)c2)CCO1 705825652 BBCDCJUXYGIVFW-JQWIXIFHSA-N 285.771 2.245 10 10 CECE CCN(CCN1CC[C@H](C)C1)Cc1ccc(N)cc1 707944764 SHQHDWAMXCUBAF-AWEZNQCLSA-N 261.413 2.433 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC(F)(F)C[C@@H]1C(=O)O 713601783 PWEABFFCXHCJHX-GMSGAONNSA-N 289.253 2.387 10 10 CECE NCc1ccc(N2CC[C@@]3(CCOC3)C2)cc1Cl 687911813 DQVJRPIXPGTIKF-CQSZACIVSA-N 266.772 2.416 10 10 CECE CC[C@H](N)c1ccc(N(C)C2CC(S(C)(=O)=O)C2)cc1 716096940 SBKZJSUYAJIYTQ-NRXISQOPSA-N 296.436 2.108 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H]2COC[C@@H]2C1 718149407 YXALHIREDCOAMM-VWYCJHECSA-N 251.301 2.171 10 10 CECE CN1Cc2ccc(N3CCN4CCCC[C@H]4C3)cc2C1 689493384 SVDRXLGHGNUTQS-KRWDZBQOSA-N 271.408 2.307 10 10 CECE C[C@H]1CN2CCC[C@@H]2CN1c1ccc2c(c1)CN(C)C2 689410520 KKXAJKUORABJGP-SUMWQHHRSA-N 271.408 2.305 10 10 CECE C[C@@H]1C[C@@H](N(C)c2ccc(CN)c(F)c2)CCO1 721406071 WTBAGFBBRVNEOW-MFKMUULPSA-N 252.333 2.288 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1cc2c(o1)CCCC2 1263769332 WKJRNXFPSILPOK-UHFFFAOYSA-N 287.315 2.500 10 10 CECE Cc1ccc(N(C)C(=O)/C=C/c2cnccc2C)nn1 1360679943 JSGAUIDHHMPZSY-FNORWQNLSA-N 268.320 2.165 10 10 CECE CNCc1ccc(N(C)CCn2cccc2)c(F)c1 2115197272 LTGYXNHDTCDETB-UHFFFAOYSA-N 261.344 2.483 10 10 CECE Oc1ccc(O)c(CNc2cncc(Cl)n2)c1 1458575627 YWYQNKWZDOZGBS-UHFFFAOYSA-N 251.673 2.153 10 10 CECE C/C(=C\c1cccnc1)C(=O)N1CCOc2ncccc21 1534033853 YNDJXROPOXYAGQ-ZRDIBKRKSA-N 281.315 2.306 10 10 CECE COc1ccccc1/N=N/N1CCC(C(=O)O)CC1 1860485849 BICWZKACMNLKLC-CCEZHUSRSA-N 263.297 2.491 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@@H]1[C@H]2CCCO[C@@H]12 2119918046 WBFQPUUCVVADIF-IIAWOOMASA-N 261.365 2.349 10 10 CECE Cc1ncncc1CN(C)c1ccc([C@@H](C)N)cc1 2122273336 OJCXPPIJJIFNHE-LLVKDONJSA-N 256.353 2.441 10 10 CECE COCCN(CC(C)C)c1cc(OC)c(OC)cc1N 213444008 LWYPFJYZNZKLBO-UHFFFAOYSA-N 282.384 2.395 10 10 CECE CCNCc1ccc(N(C)C[C@H]2OCC[C@H]2F)cc1 2122547802 DGJUNWJOVGTHQE-HUUCEWRRSA-N 266.360 2.359 10 10 CECE O=C(c1ccccc1-c1cn[nH]c1)N1CCCc2n[nH]cc21 1634268739 PSSKMKACRFTVOJ-UHFFFAOYSA-N 293.330 2.393 10 10 CECE C[C@H]1C[C@@H]1CN(C)CCC(=O)Nc1ccc(N)cc1 104428420 YGVPCEOPYKCZCY-NWDGAFQWSA-N 261.369 2.185 10 10 CECE Cc1cc(CN2[C@H](C)C(=O)N[C@@H](C)[C@H]2C)ccc1N(C)C 1654910113 FQNACUSFBMXLCW-BFHYXJOUSA-N 289.423 2.158 10 10 CECE CN(Cc1cc(N)ccc1O)[C@H]1C[C@@H]2CC[C@H](C1)O2 2124947995 JFUVMIJKGSHYTD-ZSOGYDGISA-N 262.353 2.116 10 10 CECE COc1ccc(N(C)CC(=O)Nc2ccccn2)cc1 1654124819 TVVSTJQOTLJASR-UHFFFAOYSA-N 271.320 2.165 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)[C@H]2C[C@@H]3CC[C@H](C2)O3)C1 2124918595 YFQRLUJUPAUOEW-KKOKHZNYSA-N 264.329 2.103 10 10 CECE COCC1(CN2CCCC[C@H](CN=[N+]=[N-])C2)COC1 1910587554 KJLCAUNAYJQZGN-GFCCVEGCSA-N 268.361 2.062 10 10 CECE COc1ccc(N(C)[C@@H](CO)C(C)C)c(OC)c1C 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CN[C@H]1CCc2cc(N3CC(C)(C)[C@@H]3CO)ccc21 2128297929 YNJXITICVSDBGR-GJZGRUSLSA-N 260.381 2.100 10 10 CECE Cc1cc2c(cc1N(C)CCCCC(=O)O)OCO2 258870235 KWMVLUPGFDLYQO-UHFFFAOYSA-N 265.309 2.415 10 10 CECE CNCc1ccc(N2CCC3(CC[C@@H]3O)CC2)cc1 2130892517 XKOQLMJEPGXOEV-HNNXBMFYSA-N 260.381 2.147 10 10 CECE OCc1ccc(N2C[C@H]3COC[C@@H]32)cc1C(F)(F)F 2129728741 YCEBTLVCUFRWNY-CABZTGNLSA-N 273.254 2.033 10 10 CECE CO[C@H]1CC[C@@H]1CC(=O)N(C)Cc1ccc(N)cc1 2130362004 PTYMHNUFKVWQIK-OCCSQVGLSA-N 262.353 2.042 10 10 CECE C[C@@H]1OC2(CN3CCc4cc(CN)ccc43)CC1C2 2133384353 PRQXSWGGHLVPKT-WJFWJRBTSA-N 258.365 2.075 10 10 CECE COC[C@@H]1C[C@@H]1CN1CCc2cc([C@H](C)N)ccc21 2133591610 HTAQRTSGHHOAMD-GLQYFDAESA-N 260.381 2.351 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])C[C@@H]2CC[C@@H]2C1 1912147224 HOSUUAWQDPRJTF-IAZYJMLFSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=NC1CCN(C[C@H]2CC3(CCOCC3)CO2)CC1 1912159318 GODKURUXYYBDTK-CYBMUJFWSA-N 280.372 2.347 10 10 CECE COc1ccc(C)c([C@H](NCCN=[N+]=[N-])C(=O)O)c1 1912152636 WRRKPJVHZLPADC-NSHDSACASA-N 264.285 2.029 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1n[nH]c2c1CCCC2 1912143172 BLKDXHNBKGJOOS-UHFFFAOYSA-N 262.317 2.061 10 10 CECE Cc1cccc(O[C@@H](C)C(=O)N2CC(N=[N+]=[N-])C2)c1 1912171448 KOZYSIPOALMIQA-JTQLQIEISA-N 260.297 2.283 10 10 CECE COc1ccc(C(=O)N(C)CCN=[N+]=[N-])c(F)c1 1912167555 MGFVEXRJAXHFII-UHFFFAOYSA-N 252.249 2.217 10 10 CECE CN(Cc1ccccc1)C(=O)CN1CCC[C@@H](N=[N+]=[N-])C1 1912152424 SWCLKSAERPDFNR-CQSZACIVSA-N 287.367 2.420 10 10 CECE COc1ccc(C(=O)N2CCC(N=[N+]=[N-])CC2)cc1O 1912161085 FBSFTNQYAOHRNG-UHFFFAOYSA-N 276.296 2.316 10 10 CECE CN(CCN=[N+]=[N-])C(=O)COc1ccc2c(c1)CCC2 1912210152 FRVZIIJQIZXGBE-UHFFFAOYSA-N 274.324 2.323 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@@H](O)C(F)(F)F)C1 1912203725 RZDDRLHPMAFSNW-DTWKUNHWSA-N 266.267 2.322 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)CC(C)(C)C(=O)O 2134640091 YAXFIJBEBBTELD-SECBINFHSA-N 267.325 2.201 10 10 CECE Nc1ccc(CCN2[C@H]3CC[C@H]2[C@H]2CC[C@H]3O2)cc1 1901441407 MUTJNQGOEOVQMC-CAOSSQGBSA-N 258.365 2.206 10 10 CECE Cc1ncnc(CNCc2ccc(F)cc2O)c1C 2141686628 VIAWIEGGNSSWDZ-UHFFFAOYSA-N 261.300 2.228 10 10 CECE CC[C@@H]1COC[C@]1(Sc1nccs1)C(=O)O 1904799980 IPQYJXRAGNGPHU-GMSGAONNSA-N 259.352 2.115 10 10 CECE C[C@@H](O)c1ccc(N(C)C2(CO)CCC2)c(F)c1 1914972565 PUBPHYSAPPYFEV-SNVBAGLBSA-N 253.317 2.230 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@H]2CC(F)(F)CO2)c1 1966190126 CQVODFOEYDXKMD-MWLCHTKSSA-N 287.306 2.476 10 10 CECE C[C@H]1CCO[C@@H]1Cc1noc(Cc2ccc(N)cc2)n1 1918147991 OMPVUWOESXODJA-GXFFZTMASA-N 273.336 2.210 10 10 CECE Cc1cnc(NC(=O)c2ccc(O)c(O)c2)s1 226955435 TYNBVTNOSKJAPW-UHFFFAOYSA-N 250.279 2.115 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](C)[C@@H]2CO)cc1O 227039190 BWSMGIVJUBXIIK-JMSVASOKSA-N 278.396 2.270 10 10 CECE N[C@H]1CN(Cc2ccccc2O)Cc2ccccc21 1967982632 AWUIWRKJZCROTK-HNNXBMFYSA-N 254.333 2.408 10 10 CECE C[C@@H](NCCC(=O)NC(C)(C)C)c1ccc(O)cc1O 228335900 FWKJYFYMSJIQIH-SNVBAGLBSA-N 280.368 2.053 10 10 CECE CC1(C)C[C@@H](N)CN1Cc1cc(Cl)ccc1O 1925247596 SUCFKEMESVNGMZ-LLVKDONJSA-N 254.761 2.357 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@H]2CC(O)C3)cc1 251780713 SOUKFZJHRMAMGG-UGFHNGPFSA-N 260.381 2.459 10 10 CECE Cc1cccc(CN[C@@H]2C[C@H]3CC[C@@H](N3)[C@@H]2F)c1O 2139759095 WEKGVCOBDNMWTD-SYQHCUMBSA-N 264.344 2.021 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2CC(C)(C)CO2)c1O 2139763640 ICKYLYJNEHLHLM-LBPRGKRZSA-N 263.337 2.132 10 10 CECE Cc1ccc(CNC[C@@]23COC[C@H]2C3(F)F)c(O)c1 2139774117 OVOAYJGZQOLMIW-CHWSQXEVSA-N 269.291 2.072 10 10 CECE CC1(CCC(=O)O)CN(Cc2ccc(F)cc2O)C1 2139775787 PRXICGMUYHDMME-UHFFFAOYSA-N 267.300 2.218 10 10 CECE CNCc1ccc(N2CCOC[C@H]2C)c(Br)c1 234452737 KZCMUMSXFSLDAC-SNVBAGLBSA-N 299.212 2.394 10 10 CECE CO[C@@H]1CN(c2ccc(CO)cc2Cl)C[C@@H]1F 1942648563 VHKZGFGATKHSKQ-CMPLNLGQSA-N 259.708 2.005 10 10 CECE c1cc(N2CCOCC2)ccc1CNC1[C@H]2CCC[C@H]12 2150180771 KWIMHZRGMPMARS-HOTGVXAUSA-N 272.392 2.411 10 10 CECE C[C@]1(CNS(=O)(=O)Cc2ccc(N)cc2)C=CCCC1 2146889409 BRNSPLPANHCRNR-HNNXBMFYSA-N 294.420 2.435 10 10 CECE COc1cc(C2(C(=O)O)CCCC2)cc(O)c1O 1951518587 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C[C@@H](N)c1ccc(N2CCC[C@@](F)(CO)C2)c(F)c1 2101311646 JGIMHAKMYDMSFC-YGRLFVJLSA-N 270.323 2.146 10 10 CECE COc1ccc(N2C[C@@H](C)[C@H](CN)C2)c(F)c1F 2081859226 GELKBGHZGOJRLD-RKDXNWHRSA-N 256.296 2.004 10 10 CECE Cc1nc([C@H]2CCCN2c2ccc(CO)cc2)no1 2104170781 DSMJVNOXOBTHCD-CYBMUJFWSA-N 259.309 2.212 10 10 CECE OCc1ccc(N2CCc3nnccc3C2)cc1Cl 2104906160 FOROJQJOBQRSFN-UHFFFAOYSA-N 275.739 2.185 10 10 CECE CN(Cc1c(O)ccc2ccccc12)[C@@H]1CC[C@@H]1N 2105091465 KWENTDBQBFKTBP-LSDHHAIUSA-N 256.349 2.467 10 10 CECE C[C@@H]1[C@H](CN(C)c2cc3c(cc2N)OCCO3)[C@@H]1C 2105243401 ACTXKAFYODSNOT-JGPRNRPPSA-N 262.353 2.378 10 10 CECE CCCN1CCC[C@](N)(c2ccc(N(C)C)cc2)C1 2106792098 ZMAXMFTXEPIZTC-MRXNPFEDSA-N 261.413 2.412 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H]3CCC[C@@H]3N)ccc21 2106800140 DZMMLEISWLSUOJ-HZUKXOBISA-N 260.381 2.230 10 10 CECE O[C@@H](CN1CCC1)c1ccc(N2CCCCC2)cc1 2106824089 WEVPOJNILVOERP-INIZCTEOSA-N 260.381 2.416 10 10 CECE CN(C)c1ccc([C@H](N)[C@]2(O)CCCC2(F)F)cc1 2106847957 BMFDIKKHGBMQLX-QWHCGFSZSA-N 270.323 2.303 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3CCCNC3)ccc21 2106805356 MPQPXCNRVAQGHL-HOCLYGCPSA-N 260.381 2.102 10 10 CECE CN(C)c1ccc([C@H](N)[C@@]2(O)CCCC2(F)F)cc1 2106847958 BMFDIKKHGBMQLX-STQMWFEESA-N 270.323 2.303 10 10 CECE CN1CCCc2cc([C@]3(O)CCOC3(C)C)ccc21 2106830722 JGNIJGHFAWHFIS-MRXNPFEDSA-N 261.365 2.456 10 10 CECE CC(C)[C@H](C)[C@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2106854856 IGKLYONDNYLINT-XZJROXQQSA-N 262.397 2.332 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)[C@H]1CNCC[C@H]1C 2107366812 VERWCSQLCGDNEK-WOPDTQHZSA-N 264.369 2.089 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H]2CCN[C@H]2C1 2087464957 NXCIJARMIDWVFG-GYSYKLTISA-N 264.344 2.276 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H]1C[C@@H](C)CCN1 2107911785 UILNNEWQVKNFHG-APHBMKBZSA-N 261.413 2.401 10 10 CECE CCOC(=O)[C@@H](NC)c1ccc(N2CCCC2)cc1 2107916445 JPIMDUBHSLBXFN-AWEZNQCLSA-N 262.353 2.110 10 10 CECE Cc1cc(CO)ccc1N1[C@H](CO)C[C@@H]2CCC[C@@H]21 2108392052 OOJGXEWUALRKHP-DZKIICNBSA-N 261.365 2.227 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H]2CC[C@H]3O)c(C)c1 2088641864 SAEZGXNJKLRQSZ-IIAWOOMASA-N 260.381 2.064 10 10 CECE Cc1cccc(O)c1CN[C@H]1CCn2nccc2C1 2108927236 KHKXELVWGRHMPL-LBPRGKRZSA-N 257.337 2.002 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@H]1CC2(CC2)CO1 2110082509 MWOQKPLRUCQOIP-CQSZACIVSA-N 261.365 2.493 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@H](CO)[C@@H]3C2)cc1Cl 2093096739 AYCLKIDGMNOBEZ-WTDIUWLJSA-N 280.799 2.424 10 10 CECE C[C@H]1CCC[C@@H]1CS(=O)(=O)NCc1ccc(N)cc1 2093565981 CWEAWAYIOGZGTQ-WCQYABFASA-N 282.409 2.124 10 10 CECE Oc1ccc(CN[C@@H]2CCC[C@H]2C2CC2)c(O)c1O 2093672186 DPPYHGGWNMUZMX-NWDGAFQWSA-N 263.337 2.472 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCNCC(C)(C)C1 2093992560 FHTLZBFCLAHPEZ-NSHDSACASA-N 264.369 2.090 10 10 CECE Oc1ccc(F)cc1CN1CCOC[C@H]1C(F)(F)F 2094065313 PAFQFPLXTPGWQI-NSHDSACASA-N 279.233 2.294 10 10 CECE C[C@H](N)c1ccc(N2CCOC3(CCC3)C2)cc1O 2095420189 UJJIGVTWNCIBAE-NSHDSACASA-N 262.353 2.171 10 10 CECE O=C(NC[C@H]1CCC[C@H](F)C1)c1ccc(O)c(O)c1 2096006247 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CECE CSc1ncc(CN=c2cc(C)nc(C)[nH]2)s1 2208435969 YMBLRCQXUOHXCN-UHFFFAOYSA-N 266.395 2.306 10 10 CECE COc1ccc(N2CC(C)(C)C[C@H]2CO)cc1F 2219612961 RQZOYWVTAHPGDG-NSHDSACASA-N 253.317 2.432 10 10 CECE COC[C@@](C)(CO)N(C)c1ccc(OC)c(Cl)c1 2219755906 HVRGCBXNUXMHHD-CYBMUJFWSA-N 273.760 2.182 10 10 CECE CNCc1cc(OC)ccc1N1CCC=C(F)C1 2220417766 RIADKTCWEZTQHV-UHFFFAOYSA-N 250.317 2.478 10 10 CECE CCn1cc(NC(=O)Cc2ccc(N)cc2)c(Cl)n1 2230789111 ISAQNLJTWUSNIC-UHFFFAOYSA-N 278.743 2.320 10 10 CECE CN(CC1(C(=O)O)CCCC1)c1ccc(CN)cc1 2230913002 ZMSWSEVILYODNG-UHFFFAOYSA-N 262.353 2.227 10 10 CECE CCN(C)C1CN(c2ccc([C@@H](C)NC)cc2C)C1 2232029943 AWVMRAYJFILHQE-CYBMUJFWSA-N 261.413 2.416 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[C@H](O)[C@H]2CC[C@H]21 2232092725 XQSPBFXJGIRNLJ-YUDUHTQSSA-N 261.365 2.398 10 10 CECE C[C@]1(O)C[C@H]2[C@@H]1CCN2c1ccc2c(c1)CCC[C@H]2N 2233771270 XPYKXAXPSIXZMQ-YVSFHVDLSA-N 272.392 2.372 10 10 CECE C[C@]1(C(=O)O)CC[C@H]1C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2234177680 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CCN[C@@H](C)c1ccc(N2CC=C[C@]2(C)CO)cc1O 2237168212 BBBQFOJYVCCOIR-BLLLJJGKSA-N 276.380 2.190 10 10 CECE COc1ccc(N2CCN[C@](C)(C3CC3)C2)c(F)c1 2227543720 DFMPXQFOWYFHAL-HNNXBMFYSA-N 264.344 2.413 10 10 CECE C[C@@H]1CCOC[C@]1(Oc1ccc(N(C)C)cc1)C(=O)O 2237685406 SRFWRVZYTRMXRE-IAQYHMDHSA-N 279.336 2.011 10 10 CECE COc1nscc1[C@@H](N)COc1ccc(N(C)C)cc1 2237685701 WJLXAQFRJUKBMG-ZDUSSCGKSA-N 293.392 2.297 10 10 CECE COc1ccc(N2CC[C@@H](OC)C[C@@H]2C)c(CN)c1 2227672665 JSNHSAGHQCDVCZ-SMDDNHRTSA-N 264.369 2.158 10 10 CECE CC[C@H](C)NCCNCc1cnc(SC)s1 2243843310 AHLIMXAOAJCOHQ-VIFPVBQESA-N 259.444 2.343 10 10 CECE COCC[C@](C)(Oc1ccc(N(C)C)cc1)C(=O)O 2229370576 NIDPJZMHZDJZDQ-AWEZNQCLSA-N 267.325 2.011 10 10 CECE OCc1ccc(N2[C@H](CO)C[C@@H]3CCCC[C@H]32)c(F)c1 2240700542 IJQCAVWJCQBXML-KCQAQPDRSA-N 279.355 2.448 10 10 CECE CCCS(=O)(=O)CCN(C)c1ccc([C@@H](C)N)cc1C 2240833306 MJRANKBBTYJDJT-CYBMUJFWSA-N 298.452 2.276 10 10 CECE Cc1cc(N2CC[C@@H]3OCCO[C@H]3C2)ccc1[C@@H](C)O 2285163718 AFPMMSIBAVYKMX-KCXAZCMYSA-N 277.364 2.042 10 10 CECE CSc1ncc(CN[C@@H](CC(=N)NO)C(C)C)s1 2256958686 KQOKJKONRYCPBG-VIFPVBQESA-N 288.442 2.325 10 10 CECE CCCN(C[C@H](C)O)c1ccc(OC)c(OC)c1 2259765333 WDBHCAFQJBJJMI-NSHDSACASA-N 253.342 2.301 10 10 CECE CC[C@@H](N)c1ccc(N2CCn3cncc3C2)cc1 2271011496 GSQXQBAKONLJHS-OAHLLOKOSA-N 256.353 2.313 10 10 CECE O=C(O)[C@@]1(F)CCCN(Cc2c(O)cccc2Cl)C1 2265815829 AKSAEBYJZHWZMH-CYBMUJFWSA-N 287.718 2.434 10 10 CECE FCOc1ccc(N2CCC[C@H](C3CNC3)C2)cc1 2278488122 MZOVUPNHQNBWIY-LBPRGKRZSA-N 264.344 2.428 10 10 CECE Cc1cc(N(C)Cc2cncn2C)ccc1[C@H](C)N 2269651102 HGSUZTQHKCUAMH-LBPRGKRZSA-N 258.369 2.385 10 10 CECE CN1CCc2cc([C@]3(O)C[C@H]4CC[C@H]3C[C@H]4N)ccc21 2284881030 SWTKPWFHJFFBMS-DUFGSWQCSA-N 272.392 2.014 10 10 CECE Cc1cc(N(C)C[C@@H]2CCCS2(=O)=O)ccc1[C@@H](C)O 2285154176 QHLGRZFZWCHQNS-OCCSQVGLSA-N 297.420 2.062 10 10 CECE CC1(O)[C@H]2C[C@H]1CN(c1ccc3c(c1)CCC[C@H]3N)C2 2286219313 KHMGICYEIMGIMB-HEHGZKQESA-N 272.392 2.230 10 10 CECE OCc1ccc(N2C[C@H]3COC[C@H]2C3)c(C(F)(F)F)c1 2286930547 CZZPHYAGIGWCAK-WDEREUQCSA-N 287.281 2.423 10 10 CECE O=C(O)[C@H]1C(=S)C=CC2=C1Nc1ccccc1N2 584577472 BIHFMCKFLALKPJ-NSHDSACASA-N 258.302 2.376 10 10 CECE C[C@H](CN(C)C)N(C)Cc1cccc(Cl)c1O 2306871590 ITVKXISNDPOVCP-SNVBAGLBSA-N 256.777 2.428 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCOC[C@@H](F)C1 2315069049 SIMWPCDYYLKWCN-YPMHNXCESA-N 253.317 2.223 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H](C)O)c(C)c1C 2318386483 AIOJWIJQSNWUDC-ZWNOBZJWSA-N 250.386 2.401 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2c1ccc(CO)cc1Cl 2318320852 FDNVUCKCXUMPGB-COPLHBTASA-N 267.756 2.446 10 10 CECE CC[C@@H](C(F)F)N1CCc2cc(O)c(O)cc2C1 2318675522 REHUEIMFAMSMMB-JTQLQIEISA-N 257.280 2.500 10 10 CECE Cc1ccc(CN[C@H]2C[C@@H]3CC[C@@]2(CO)C3)c(O)c1 2333190997 PSHCFRDDQVSFQZ-RCBQFDQVSA-N 261.365 2.341 10 10 CECE CC[C@@H](O)CNCc1cc(OC(F)(F)F)ccc1O 2335909761 LCSMPFBRFZKWJR-SECBINFHSA-N 279.258 2.151 10 10 CECE COc1cccc(O)c1CN[C@H]1COC2(C)CC1C2 2337715628 DIMCGBFGEGLFTR-JYHUIVOISA-N 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CNCc1ccc(N(C)[C@H](CCOC)COC)c(F)c1 2165974352 MMCZSIPUOXUJMH-CYBMUJFWSA-N 284.375 2.033 10 10 CECE CC[C@H](COC)N(C)[C@@H](CN)c1ccc(N(C)C)cc1 2165981523 CPTVFZWCABBISS-ZBFHGGJFSA-N 279.428 2.109 10 10 CECE COc1ccc(N(C)[C@](C)(CN)[C@H]2CCCOC2)cc1 2168335183 IGFYYPACLIWZGY-XJKSGUPXSA-N 278.396 2.275 10 10 CECE Cc1cc(CNC2CC2)ccc1N(CCO)[C@H]1C[C@H]1C 2167113802 YAIUFSSUJVGKDK-DYVFJYSZSA-N 274.408 2.454 10 10 CECE Cn1ccnc1SCCNCc1cc(F)cc(F)c1O 2165088571 XVMZVCFGNFVWPV-UHFFFAOYSA-N 299.346 2.286 10 10 CECE CN(C[C@H](O)C1CCCC1)c1c(F)cc(CN)cc1F 2167593428 ANCHPEXZKFVWIT-AWEZNQCLSA-N 284.350 2.411 10 10 CECE CO[C@H]1C[C@@H](OC)CN([C@@H](C)c2cc(C)ccc2O)C1 2165454804 IIHUHZNZSPTZJX-MELADBBJSA-N 279.380 2.497 10 10 CECE Cc1cc(CN2C[C@H](C(N)=O)CC[C@H]2C)ccc1N(C)C 815037332 IAHLZBTUZUFCLK-UKRRQHHQSA-N 289.423 2.147 10 10 CECE C[C@H](N[C@H]1CCNC[C@@H]1C)c1cc(F)ccc1O 817971954 RYTYBINHEHKXRS-KWBADKCTSA-N 252.333 2.180 10 10 CECE C[C@H]1CN(Cc2cc(F)ccc2O)C[C@@H]1CC(=O)O 722645563 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869597177 DKEYKHVECOHBBQ-MRVPVSSYSA-N 257.380 2.327 10 10 CECE COc1ccc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)cc1C 770751799 DELLRQKNFQWMHY-WBVHZDCISA-N 291.391 2.431 10 10 CECE CCN(C)c1ccc(CN2CCN(C(C)=O)C[C@H]2C)cc1 773767111 WTKNPXDUWBSHIX-CQSZACIVSA-N 289.423 2.195 10 10 CECE CN(C[C@H]1C[C@H]1CF)c1ccc(CO)c([N+](=O)[O-])c1 1875815350 OIOULTWDEYIYND-WDEREUQCSA-N 268.288 2.129 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H]1CCCS1 1875864432 PYVMMTQRRBYWFU-RBSFLKMASA-N 280.437 2.270 10 10 CECE CCN(CC1CCC1)C(=O)c1cc(O)c(O)c(O)c1 2132349008 WQWDIDZCMAKVDR-UHFFFAOYSA-N 265.309 2.066 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CNC(=O)c1cc(O)cs1 899411323 HHQCSDSHTCYDRN-DEKFOEGESA-N 251.351 2.476 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCC[C@H]2[C@@H](C)O)c(F)c1 1880484593 GVLGIPHAFBRKRQ-KKFJDGPESA-N 271.307 2.368 10 10 CECE CC[C@H](COC)NC(=O)c1ccc(N=NC(N)=O)cc1 1147752185 MOYMOFWHCXNGQR-SNVBAGLBSA-N 278.312 2.004 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCOC3(CC3)C2)c(F)c1 1880923756 KZSSAJQPOSAWPK-SECBINFHSA-N 268.307 2.354 10 10 CECE C[C@@H](NC(=O)c1cnn(C)c1Cl)c1ccccc1O 1302533068 ZOUVKTGRQPMRLM-MRVPVSSYSA-N 279.727 2.270 10 10 CECE CC[C@@]1(C)CN(CCCO)c2cc(OC)c(OC)cc2N1 76930887 QJYKTITUBCXUCA-INIZCTEOSA-N 294.395 2.487 10 10 CECE Cn1c(COc2ccc(N)cc2)nc2cccnc21 82556587 RAFLMCKGVYTKBF-UHFFFAOYSA-N 254.293 2.130 10 10 CECE Cc1cccc(O)c1CN=c1[nH]n(C)cc1Br 1963063696 CVDQYRHPRIHWHL-UHFFFAOYSA-N 296.168 2.231 10 10 CECE CC[C@H](CNCc1ccc(N(CC)CC)cc1)C(N)=O 83422477 ZHDBSVYXXRXCCO-CQSZACIVSA-N 277.412 2.134 10 10 CECE CC[C@@H](CC(=O)N1CC(N=[N+]=[N-])C1)NC(=O)OC(C)(C)C 1885563443 URQMMZZCBXUFJF-VIFPVBQESA-N 297.359 2.201 10 10 CECE C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)Nc1ccc(N)cc1 686184364 CLONVWQWFNNUEZ-VKKKGTNTSA-N 275.352 2.034 10 10 CECE C[C@H]1C[C@@H](C)[C@H](C(=O)O)CN1Cc1ccc(N)cc1 1891640376 ZSEFOJYPICIZSH-UHIISALHSA-N 262.353 2.200 10 10 CECE CSC(C)(C)CN(C)C(=O)c1cccc(O)c1O 713903361 DDTPVZDEJYMWSP-UHFFFAOYSA-N 269.366 2.311 10 10 CECE C[C@H](c1ccccc1O)N1CCC(F)(F)[C@H](C(=O)O)C1 717893842 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C[C@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)[C@H](C(=O)O)C1 163694919 YUKRQYLEVOXWIN-WCFLWFBJSA-N 291.347 2.098 10 10 CECE C[C@@H](NCc1cccc(F)c1O)c1nnc2ccccn12 164962041 JAHHYJZAFFXLEU-SNVBAGLBSA-N 286.310 2.425 10 10 CECE CN(C)c1ccc([C@@]2(C)N[C@H](C(=O)O)CCS2)cc1 159216064 NJKGERKJOBOIMO-JSGCOSHPSA-N 280.393 2.105 10 10 CECE CN1CC[C@H]2[C@H]1CCCN2c1ccc(CN)c(Cl)c1 2127351707 GZRXYWBCGATISL-CABCVRRESA-N 279.815 2.472 10 10 CECE COc1cccc(OCC(=O)Nc2ccc(N)cc2)c1 20327178 YQLDTZDSEIPOHH-UHFFFAOYSA-N 272.304 2.295 10 10 CECE Oc1cccc(Br)c1CN[C@H]1C[C@H]1F 1887538227 UJIWNWNUYKFEHC-BDAKNGLRSA-N 260.106 2.355 10 10 CECE CC(C)N(CCN(C)C)c1ccc2c(c1)CC[C@H]2O 2128318715 WZQBINCTIPWXBJ-MRXNPFEDSA-N 262.397 2.443 10 10 CECE CN1C[C@H]2[C@@H](NCc3c(O)cccc3Cl)CC[C@H]2C1 1658174420 FGUJNYCLIMUIJV-SUHUHFCYSA-N 280.799 2.475 10 10 CECE Oc1c(F)cccc1CN1CC[C@@H]2CCOC[C@H]2C1 2128999596 UEVCKOPTPLGZME-DGCLKSJQSA-N 265.328 2.390 10 10 CECE Cc1cc(C)nc(CNCc2ccc(O)c(O)c2O)c1 2201649971 HRNRHKWXNPQFBI-UHFFFAOYSA-N 274.320 2.105 10 10 CECE Cc1cc(N2CC[C@@H](O)[C@@H]2C)ccc1CNC1CC1 1914261152 XLQSHKDHIJMTSU-BLLLJJGKSA-N 260.381 2.207 10 10 CECE C[C@@H]1CCS[C@@H]1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912161306 HRPZMZFPXQNRJV-UTLUCORTSA-N 254.359 2.429 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cc(F)c(F)c(F)c1 1912150620 WBYMCTPGNXHQQH-UHFFFAOYSA-N 258.203 2.486 10 10 CECE CC[C@@]1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)CCCO1 1912158167 WBOBNAUNLIHCCZ-PWSUYJOCSA-N 252.318 2.247 10 10 CECE CSc1ccc([C@H](NCCCN=[N+]=[N-])C(N)=O)s1 1912192553 HIOPIWGWVTUOTL-VIFPVBQESA-N 285.398 2.286 10 10 CECE C[C@]12CCCC[C@H]1C[C@@](NCCCN=[N+]=[N-])(C(N)=O)C2 1912197742 YAYVTASBYUQPDE-YUTCNCBUSA-N 279.388 2.491 10 10 CECE C[C@H](C(=O)N1CCCCCC1)N(C)CCCN=[N+]=[N-] 1912186916 CZRRSRUOPGRZEK-GFCCVEGCSA-N 267.377 2.410 10 10 CECE CCOC(=O)[C@H](C)CN1CCC[C@@H](CN=[N+]=[N-])C1 1912188056 LTWUVXSGBLEMDK-MNOVXSKESA-N 254.334 2.208 10 10 CECE Cc1cc(N2C[C@H]3COC[C@H]3C2)ccc1C=CC(=O)O 1912136644 IDNHAIXCSUHDKL-OKILXGFUSA-N 273.332 2.175 10 10 CECE 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UAFLIJHQIUYWRL-JTQLQIEISA-N 274.320 2.352 10 10 CECE CN(C)c1ccc(OC[C@H]2CCNCC2(F)F)cc1 2229384321 VWARZZBXKAGZGV-LLVKDONJSA-N 270.323 2.376 10 10 CECE Nc1ccc(CCN2CC(OC(F)(F)CF)C2)cc1 2229328939 IHBVWIMMMVRQHH-UHFFFAOYSA-N 274.286 2.074 10 10 CECE CCOc1ncc([C@@H](O)[C@H](NC)c2ccccc2O)s1 2239774056 VBRMKLGMQHOIHI-CHWSQXEVSA-N 294.376 2.242 10 10 CECE Cc1cccc(CNC(=O)c2c(Cl)c(C)nn2C)c1O 2240982493 UQZFWAVUFPDQMR-UHFFFAOYSA-N 293.754 2.326 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)NC1CCSCC1 2254182647 HWQFJZZOCHIDQD-NXEZZACHSA-N 269.374 2.413 10 10 CECE CN(CC1CC1)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2254678194 FNYUGGBHZJFENM-NSHDSACASA-N 251.334 2.471 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]3[C@H]2CO)cc1C 2285119563 BSZBSTRRSKGWQZ-DLTLXFJOSA-N 274.408 2.483 10 10 CECE COc1c(F)cc(N2CC[C@@H](N)[C@@H](C)C2)cc1F 2256183397 XLVKSOGEECAWPW-QPUJVOFHSA-N 256.296 2.147 10 10 CECE CSc1ncc(CNC[C@]2(N)CCC[C@H]2C)s1 2248735230 LTWDRDMUKRSFBE-BXKDBHETSA-N 271.455 2.472 10 10 CECE FC(F)Oc1ccc(N2C[C@H]3CCNC[C@@H]3C2)cc1 2278483889 NNOIUVBIAGXLGW-GHMZBOCLSA-N 268.307 2.334 10 10 CECE Cc1cc(N2CC(C)(C[S@](C)=O)C2)ccc1[C@@H](C)N 2269670307 WMXZYCVLOIAKIG-BLVKFPJESA-N 280.437 2.220 10 10 CECE Cc1cc(N2CCN(C)[C@@H]3CC[C@H]32)ccc1[C@@H](C)N 2269664468 AWFWBVGGNAAABE-DAXOMENPSA-N 259.397 2.298 10 10 CECE COC[C@]1(C)[C@@H]2C[C@H]2CN1CCOc1ccc(N)cc1 2284540134 YPJDEYBNTKBLMS-APHBMKBZSA-N 276.380 2.004 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3C[C@H]4CCC[C@H]3N4)ccc21 2295073040 GBDPOYULYRJHLN-ANQUJSFKSA-N 272.392 2.243 10 10 CECE Cc1ncc([C@](C)(O)[C@H](N)c2ccc(N(C)C)cc2)s1 2285009231 LXUUHNAFEDTTPQ-CABCVRRESA-N 291.420 2.425 10 10 CECE CSc1ncc(CN[C@@]2(C(=O)O)CC[C@@H]2C)s1 2304869414 LZUPMQROJGOCKR-CPCISQLKSA-N 272.395 2.208 10 10 CECE CN[C@@H]1CCCN(c2ccc(OC)cc2F)CC1 2317792053 NSJJZSTWUKZBEF-LLVKDONJSA-N 252.333 2.413 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@@H](N)[C@H]2C)cc1F 2308905972 YEIUDMOXVHQQBV-GPCCPHFNSA-N 252.333 2.396 10 10 CECE OCc1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)c(Cl)c1 2325324793 CNTRMEAESOBOKH-HERUPUMHSA-N 267.756 2.182 10 10 CECE Cc1cccc(N=NN2CCC(C(N)=O)CC2)c1C 2330269898 QXECGWWMICFQQO-UHFFFAOYSA-N 260.341 2.499 10 10 CECE NC1(c2ccc(N3CC4(C3)CC4(F)F)cc2)CC1 2326875204 LCCBRQLPHFKRAB-UHFFFAOYSA-N 250.292 2.480 10 10 CECE CSc1cc(N(CCCO)C(C)C)ccc1CN 2328545989 CVGAOLLFBZNYEC-UHFFFAOYSA-N 268.426 2.464 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CN([C@@H](C)c2ccccc2O)C1 2328741009 JTNZQXQLJCKEKX-SDDRHHMPSA-N 263.337 2.496 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1C[C@@H]3C[C@H]1C[C@H]3O)CC2 2330905911 ZBHNVWFSXZIFTL-RLPMIEJPSA-N 259.349 2.129 10 10 CECE Nc1ccc(CCCN2CC[C@@H](O)[C@@H]3CC[C@@H]32)cc1 2331945451 NHZGJSSEINGSJO-OWCLPIDISA-N 260.381 2.047 10 10 CECE OC[C@@H]1[C@H]2CN(c3ccc(OC4CC4)cc3)CC[C@@H]12 2333689276 QQUNBYFXIJNAKC-PMPSAXMXSA-N 259.349 2.292 10 10 CECE C[C@H](N)c1cc(F)c(N2CCOC[C@H](F)C2)c(F)c1 2336672752 CETUWYGIFWBZOH-WCBMZHEXSA-N 274.286 2.159 10 10 CECE CCC=C(C)COC[C@H](O)COc1ccc(N)cc1 2338486669 LHGPZPFPZGCUFM-AWEZNQCLSA-N 265.353 2.381 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H](F)[C@H](CO)C2)c1C 2340847639 GYHDOGKJOJNCEI-SGMGOOAPSA-N 266.360 2.090 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](C)[C@@H](O)C2)c(F)c1 2341300063 RRAYRLNYTGNCQI-ZETOZRRWSA-N 266.360 2.313 10 10 CECE C[C@@H]1[C@@H](O)CCN(c2ccc([C@@H](C)O)cc2F)[C@@H]1C 2344543422 PZRTZXUJAPLIKI-SQYUCLKFSA-N 267.344 2.475 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@H](C)[C@H]2C)c(C)c1 2344572071 HSJLETPDULRQGQ-IOASZLSFSA-N 262.397 2.310 10 10 CECE CN[C@@H](CN(C)c1ccc(OC)cc1)[C@@H]1CC1(F)F 2352326157 ZYCLKUGGEWTJLN-STQMWFEESA-N 270.323 2.375 10 10 CECE CSc1cc(N2CCN3CCC[C@@H]3C2)ccc1CN 2353854870 AQKQQPMMTFYPQU-CQSZACIVSA-N 277.437 2.152 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2C[C@H]1C[C@@]2(C)O)c1ccc(O)cc1O 2355731312 WSQHZMQLYUALJN-FPTLTGCRSA-N 277.364 2.298 10 10 CECE CCCCCOC[C@@H](O)COc1ccc(N)cc1 51328082 QZHXJCOBKKGIQU-CYBMUJFWSA-N 253.342 2.215 10 10 CECE CNCc1ccc(N2[C@@H]3CC[C@@H]2CC(O)C3)c(F)c1 111392878 KVFNJXHVGJHRLC-VXGBXAGGSA-N 264.344 2.037 10 10 CECE CCN[C@H](C)c1ccc(N2CCN(C)C[C@H]2C)cc1 300536280 BBTKMQLIOREQAV-ZIAGYGMSSA-N 261.413 2.497 10 10 CECE C[C@@H](CO)N(C)c1ccc(CNC2CC2)cc1Cl 122679192 SLUSNZWORAZCMB-JTQLQIEISA-N 268.788 2.409 10 10 CECE CCOc1ccc(O)c(CN(C)[C@@H]2CCOC2)c1 132167996 ICTHQMHHFWZQNY-GFCCVEGCSA-N 251.326 2.012 10 10 CECE CN(C)c1ccc([C@H](N)CN)c(OCc2ccccc2)c1 44477161 QWRVIJQAAZZBKN-MRXNPFEDSA-N 285.391 2.290 10 10 CECE COCCN(Cc1cc(C(C)=O)ccc1O)[C@@H](C)COC 42608901 DUMAKDAVSZEIIQ-LBPRGKRZSA-N 295.379 2.078 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1ccccc1COC 90257277 FFTWOICSVWRAJN-ZDUSSCGKSA-N 292.339 2.337 10 10 CECE CCCNC(=O)CN(C)c1ccc(CNC)c(Cl)c1 233048664 FEKCBYVZNZBDHR-UHFFFAOYSA-N 283.803 2.022 10 10 CECE Oc1cc(Br)c(F)c([C@@H]2CCCN2)c1O 258508820 HJRGYBASPBZIMB-LURJTMIESA-N 276.105 2.424 10 10 CECE CN1C[C@H](CN)C[C@H]1c1cccc(Br)c1O 258553510 NITDSOPOCBBGJK-KWQFWETISA-N 285.185 2.106 10 10 CECE COc1ccccc1/C=C\C(=O)NCc1ccc(O)c(O)c1 255074664 AWGIROOVWITUFB-CLFYSBASSA-N 299.326 2.436 10 10 CECE COC(=O)c1ccc(O)c(CNC(=O)OC(C)(C)C)c1 261235060 RPDMLCBOEQLIQQ-UHFFFAOYSA-N 281.308 2.204 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CCO[C@@]2(CCOC2)C1 371514268 LPVDWWQIARPLJJ-DOMZBBRYSA-N 297.782 2.473 10 10 CECE CN(C)c1ccc(CN2CCO[C@H](C(F)F)C2)cc1 801560056 NQHVFNYBASFHOV-ZDUSSCGKSA-N 270.323 2.219 10 10 CECE CC[C@@H]1OCC[C@H]1C(=O)N[C@H](C)c1cc(OC)ccc1O 802782058 MZHMVVIDVMXXNJ-HCKVZZMMSA-N 293.363 2.393 10 10 CECE CCN1CCc2cc([C@]3(N)CCN(C)C[C@H]3C)ccc21 2163064737 YLAOFFXYOWSQII-DYVFJYSZSA-N 273.424 2.195 10 10 CECE C[C@@H]1CN[C@H]([C@H](O)c2ccc3c(c2)CCN3C)[C@@H](C)C1 2163069002 OCAATBPPZVRXQF-MWDDYTRKSA-N 274.408 2.346 10 10 CECE Nc1ccc(CC[C@H](O)CC2=CSC3=NCCN23)cc1 700131136 SZSPDMKJHQUEQW-AWEZNQCLSA-N 289.404 2.212 10 10 CECE CN1CCCc2cc([C@](C)(O)c3ccncn3)ccc21 2163095635 CPYRHHRFGSYSHC-INIZCTEOSA-N 269.348 2.115 10 10 CECE C[C@@H]1C[C@](N)(c2ccc3c(c2)CCCN3C)CCN1C 2163099498 IYUFUNAJVAHSRR-DYVFJYSZSA-N 273.424 2.337 10 10 CECE C[C@@H]1[C@@H]2OCC[C@H]2[C@]1(N)c1ccc(N2CCCC2)cc1 2163101852 FNRJOMLWTVCYES-VDNDLQMASA-N 272.392 2.496 10 10 CECE CCCN(C[C@@H]1C[C@H]2OCC[C@H]2O1)c1ccc(N)cc1 2163231567 XBZVKQFWKNKOMT-ARFHVFGLSA-N 276.380 2.432 10 10 CECE CN(C)c1ccc([C@@H](O)Cc2cc(Cl)n(C)n2)cc1 706585244 OXTPUKZHYPJXNI-ZDUSSCGKSA-N 279.771 2.416 10 10 CECE CN(CCCC(F)F)C(=O)[C@@H]1CNc2ccccc2N1 2166573153 JGORMVURRWAECL-LBPRGKRZSA-N 283.322 2.396 10 10 CECE CN1CCCc2cc(CNCC3(CO)CCC3)ccc21 717631494 AJDAZAXFMWGESF-UHFFFAOYSA-N 274.408 2.321 10 10 CECE CC[C@@H]1CC[C@H](C)N1S(=O)(=O)Cc1ccc(N)cc1 135942785 YSWQHBDWOGODRG-SMDDNHRTSA-N 282.409 2.362 10 10 CECE CCOC(=O)[C@@H](F)[C@H](N)c1cc(F)cc(Cl)c1O 725275309 SAJJOULRLLEORI-DTWKUNHWSA-N 279.670 2.086 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@@]2(C)CO)cc1O 723033339 XPVTXHDPWQFTCK-NHYWBVRUSA-N 265.353 2.187 10 10 CECE Cc1ncsc1/C=C\C(=O)N1CCc2cnccc21 588518790 DJSAXILJIPHVGR-IHWYPQMZSA-N 271.345 2.449 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](OC)C2CCC2)c1 830539915 BNFMDDWGUIISDE-MEBBXXQBSA-N 293.363 2.393 10 10 CECE COc1ccc(C)cc1NC(=O)c1cc(O)c(O)c(O)c1 586735537 SRSJVLKSHGLGAN-UHFFFAOYSA-N 289.287 2.373 10 10 CECE CCN(OC)C(=O)CNCc1ccc2ccccc2c1O 843430690 OLXWDYGENJDHMW-UHFFFAOYSA-N 288.347 2.045 10 10 CECE CCN(C)c1ccc([C@@H](C)NCC[C@]2(O)CCOC2)cc1 846194627 OOFIZUDBQCJIFT-PBHICJAKSA-N 292.423 2.335 10 10 CECE CC1(C)C[C@@H]1CNC(=O)NCc1c(O)cccc1F 918316410 DXRIRUMBULGPJM-SECBINFHSA-N 266.316 2.377 10 10 CECE C[C@@H]1CCC[C@@H](CNC(=O)NCc2c(O)cccc2F)O1 923285567 HTWHAIBOAVLXRG-MNOVXSKESA-N 296.342 2.288 10 10 CECE O=C(NC[C@@H]1C[C@H]1C(F)(F)F)c1cccc(O)c1O 831366367 XEOLMQZSZYHSCA-POYBYMJQSA-N 275.226 2.026 10 10 CECE CCOc1ccc(O)c(CNC2COC(C)(C)OC2)c1 758009865 BOBAOPQASNUXMI-UHFFFAOYSA-N 281.352 2.032 10 10 CECE O=C(NCC1(O)CCC(F)(F)CC1)c1cc(O)cs1 856202362 LEOQWRWQZSYWFL-UHFFFAOYSA-N 291.319 2.124 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)/C=C\SC)C2)cc1 855232958 CUIFVTLQWIJFJR-VPUINMBXSA-N 292.404 2.267 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)NCC[C@H]2CCOC2)c1 757656747 MBYWOKXWYLFACS-NEPJUHHUSA-N 293.363 2.256 10 10 CECE C[C@H](NC(=O)NC[C@@H]1CCCCO1)c1ccccc1O 868360830 ZTRLSQHZRIBPLW-RYUDHWBXSA-N 278.352 2.322 10 10 CECE CC[C@@H](C)N(CCO)Cc1ccc(N2CCOCC2)cc1 862388261 YPYYVUKWPIIELI-OAHLLOKOSA-N 292.423 2.116 10 10 CECE C[C@@]12CNC[C@]1(C)CN(Cc1cccc(Cl)c1O)C2 863649615 BNIMGWPEPRFYHA-GASCZTMLSA-N 280.799 2.477 10 10 CECE CCCN(C)C1CN(c2ccc3c(c2)CC[C@H]3O)C1 1877424494 IIXVFJVXJYEELH-MRXNPFEDSA-N 260.381 2.197 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1CNCCC1(C)C 1877536903 CJWMKKWKCUXUHJ-AWEZNQCLSA-N 262.397 2.460 10 10 CECE CC(C)(C)OC(=O)N1CCN(c2ccc(N)cc2)[C@H]2C[C@H]21 1955944093 YCOBARKYGXHMAG-UONOGXRCSA-N 289.379 2.467 10 10 CECE Cc1c(NC(=O)c2cc(O)cs2)cccc1C(N)=O 1136197344 BDFIZRJGSOYTLS-UHFFFAOYSA-N 276.317 2.113 10 10 CECE CN[C@H](c1ccccc1O)C1(O)CCP(C)(=O)CC1 1879130280 SNMXAWBAZVCAPI-VFPJAPOESA-N 283.308 2.171 10 10 CECE C[C@@H]1OCC[C@@H]1CC(=O)N(C)Cc1ccc(N)cc1 1885775424 SQNMMVYNRLHTDB-WCQYABFASA-N 262.353 2.042 10 10 CECE C[C@@H]1OCC[C@H]1CC(=O)N(C)Cc1ccc(N)cc1 1885775422 SQNMMVYNRLHTDB-AAEUAGOBSA-N 262.353 2.042 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cccn1CC(F)(F)F 167379882 YNSAAKXXVKVNPH-UHFFFAOYSA-N 261.207 2.091 10 10 CECE CCN(CC)CCN1CCNc2cc(OC)ccc21 76926885 UOMCAEUHCNJHMQ-UHFFFAOYSA-N 263.385 2.269 10 10 CECE C[C@@H]1[C@@H](C(=O)O)CCN1Cc1ccc(Cl)cc1O 1963117863 BQDGNOKDQVMNAW-KCJUWKMLSA-N 269.728 2.341 10 10 CECE Oc1c(F)cccc1CN[C@H]1c2ccccc2C[C@H]1O 1963624072 HAHVKWCQCYBQQY-CABCVRRESA-N 273.307 2.279 10 10 CECE CCCC[C@H](N)CC(=O)N(C)Cc1ccccc1O 1963243882 PYXYPFRVHJOTSP-ZDUSSCGKSA-N 264.369 2.258 10 10 CECE C[C@@H](NC[C@H]1CCCOC1)c1ccc(O)cc1O 38044105 RZSCIBSXHDNFSM-GHMZBOCLSA-N 251.326 2.175 10 10 CECE CN1CC[C@@H]2CN(Cc3ccc(F)c(F)c3O)C[C@H]2C1 703447879 MVMNVMQCHXMXQU-ZYHUDNBSSA-N 282.334 2.054 10 10 CECE CCN(CC(=O)c1ccc(O)c(O)c1)C[C@H]1C[C@H]1C 704736986 JDOKPHNKNVCKRU-ZYHUDNBSSA-N 263.337 2.258 10 10 CECE CCOc1cccc(CN(CC)[C@H](C)C(=O)O)c1O 707972165 UIJIYDCFBJTXOV-SNVBAGLBSA-N 267.325 2.086 10 10 CECE C[C@@H]1COC[C@@H]1N(C)c1ccc(CO)cc1Cl 710971698 UMUYVNHSQCSTGT-RNCFNFMXSA-N 255.745 2.303 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2COC[C@H]2C)c(F)c1 688230301 YAMPJOAVVYGJAY-ISTVAULSSA-N 252.333 2.317 10 10 CECE CN(C)c1ccc([C@@H](N)CC(=O)N2CCCCC2)cc1 41413574 QXYICCJMGGGXDU-HNNXBMFYSA-N 275.396 2.155 10 10 CECE CSC(C)(C)CN(C)C(=O)COc1ccc(N)cc1 713948295 HAOJWXMMJLHBIQ-UHFFFAOYSA-N 282.409 2.248 10 10 CECE COC(=O)[C@@](NCCCN=[N+]=[N-])(C(C)C)C(F)(F)F 1893058553 FRABQFHWRJPAJE-VIFPVBQESA-N 282.266 2.407 10 10 CECE C[C@@H]1[C@H](N)CC(C)(C)CN1Cc1cc(F)ccc1O 1916273431 HDJLISBJGFYUIY-ZWNOBZJWSA-N 266.360 2.479 10 10 CECE CN(C)c1ccc(CN2CCC[C@H](c3cn(C)nn3)C2)cc1 1460946801 PSMKWDAUFQXRSP-HNNXBMFYSA-N 299.422 2.261 10 10 CECE COc1cccc(O)c1CN[C@@H](CO)c1cccs1 2118996127 ITIFAXUTJHTQMF-NSHDSACASA-N 279.361 2.286 10 10 CECE CN(C)c1ccc([C@H](O)C[C@H]2N[C@@H]3CC[C@H]2C3)cc1 2120499201 XXVCAUBWNMTFKX-SJXGUFTOSA-N 260.381 2.317 10 10 CECE O=C(NCc1ccccc1O)c1csc(C(=O)O)c1 2122157272 FEPLLIYCRKVDGQ-UHFFFAOYSA-N 277.301 2.082 10 10 CECE CN(Cc1cncnc1)c1cc(Cl)c(CN)cc1F 2122277436 CGJBBARXKKCRAM-UHFFFAOYSA-N 280.734 2.364 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@]2(C1)CC2(F)F 1557332722 YZDLPPHSLLUGBD-CQSZACIVSA-N 297.301 2.288 10 10 CECE Cc1cccc(N)c1N[C@H](C)CCN1CCOC1=O 2122708215 GGKWWRHIKWRCNR-LLVKDONJSA-N 263.341 2.220 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Cl)no1 1638347032 AVJLHSIGVPCSTB-ZETCQYMHSA-N 296.710 2.100 10 10 CECE COC[C@H]1CCN[C@H](c2ccc3c(c2)CCN3C)C1 1909377093 RNWTYJTZVVULRI-WFASDCNBSA-N 260.381 2.366 10 10 CECE O=C(C[C@H]1Cc2ccccc2O1)NCc1c(O)cccc1O 1597574219 KOUWKGFINSYNFN-GFCCVEGCSA-N 299.326 2.108 10 10 CECE C/C(=C(\F)C(=O)NCc1c(O)cccc1O)C1CC1 1597575146 YSBFSBFJJGMSNE-MDWZMJQESA-N 265.284 2.368 10 10 CECE CCC[C@H](O)CN[C@H](C)c1ccc(OC)cc1O 168770964 OQMIZZKKUWVFQX-MNOVXSKESA-N 253.342 2.212 10 10 CECE CN(C[C@@H](O)C1CC1)c1ccc2c(c1)CCC[C@H]2O 2128276394 AMEPDDSOVZXSQA-HZPDHXFCSA-N 261.365 2.263 10 10 CECE C[C@H](O)CN(c1ccc2c(c1)CCC[C@H]2N)C1CC1 2128278079 VFCJFXMVBAPHRW-MEDUHNTESA-N 260.381 2.372 10 10 CECE C[C@H]1CC[C@H](C(=O)NCCCSc2nccs2)O1 154609609 JXQHNYSAVICFBL-VHSXEESVSA-N 286.422 2.309 10 10 CECE CCN[C@@H]1CCc2cc(N3CC[C@H](CO)C3)ccc21 2128293846 IBXMWKPXTFAMQU-BLLLJJGKSA-N 260.381 2.102 10 10 CECE CC(C)N1CCN(c2ccc3c(c2)CC[C@@H]3N)CC1 2128321985 OOGCPAYDUKRDPJ-INIZCTEOSA-N 259.397 2.163 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@H]3N)C[C@H](C)C1O 2128311175 QSDCDEVMLYNOEW-ZIBATOQPSA-N 260.381 2.086 10 10 CECE CN[C@@H]1CCc2cc(N(C[C@H](C)O)C(C)C)ccc21 2128314941 MLNNICASROVTNQ-BLLLJJGKSA-N 262.397 2.489 10 10 CECE CCN(CC)c1ccc(CN2CCCN(C)CC2)c(O)c1 19360673 QMOHMQFERNTSEK-UHFFFAOYSA-N 291.439 2.376 10 10 CECE COc1cc(C)c(N(C)C[C@H]2CCCN2)cc1OC 258952091 RMRZGZMVXLSPTM-GFCCVEGCSA-N 264.369 2.200 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc([C@@H](C)N)cc1F 2131054532 VFNPTULINCBPDJ-KGYLQXTDSA-N 263.360 2.128 10 10 CECE CN(CCCn1c(O)nc2ccccc21)CCN=[N+]=[N-] 1912164468 WLXRTNNIZWZVDI-UHFFFAOYSA-N 274.328 2.374 10 10 CECE [N-]=[N+]=NCCNC1(C(=O)O)C[C@@H]2CCCC[C@H]2C1 1912186583 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2.153 10 10 CECE CN1CCc2cc([C@@H](N)Cc3cscn3)ccc21 2037177959 ISSIPNQZWWEDNM-ZDUSSCGKSA-N 259.378 2.378 10 10 CECE C[C@@H]1C[C@H](CO)CN1c1ccc(CN)cc1C(F)(F)F 2156540463 RZBVDJONGLICDC-KOLCDFICSA-N 288.313 2.371 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1CC[C@H]2[C@@H]1C2(F)F 2040540347 DVYUBTSSEIJZCO-HRDYMLBCSA-N 258.272 2.437 10 10 CECE CSC[C@@H]1CCCN1CC(=O)N(C)c1ccc(N)cc1 400224428 MRXXLKGACVUSCK-AWEZNQCLSA-N 293.436 2.059 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCCOC2)c(F)c1 401490444 XRXDVSKLBUYSOM-GFCCVEGCSA-N 252.333 2.160 10 10 CECE CN(CCCOc1ccc(N)cc1)[C@H]1CCCOC1 401514519 JPXZFACYQQUGDE-AWEZNQCLSA-N 264.369 2.149 10 10 CECE COC[C@H](C)CN(C)c1c(F)cc(CN)cc1F 310924936 GOBRLQAYIPFFIY-SECBINFHSA-N 258.312 2.142 10 10 CECE CO[C@@H]1COCC[C@H]1N[C@@H](C)c1ccc(C)cc1O 311607535 DVCSMJFWZLYWQB-NJZAAPMLSA-N 265.353 2.155 10 10 CECE CNC1CCN([C@@H](C)c2cc(OC)ccc2O)CC1 311968963 ATTAOQRHLDPNGX-NSHDSACASA-N 264.369 2.146 10 10 CECE CSC1CCN(CCC(=O)Nc2ccc(N)cc2)CC1 312486883 XQTLHWNZGDXFHE-UHFFFAOYSA-N 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2.076 10 10 CECE Oc1ccc(CNCc2nc(Cl)cs2)c(O)c1O 2076455984 LDFOPERWYGTUNU-UHFFFAOYSA-N 286.740 2.203 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@]3(C[C@H](O)CO3)C2)c(Cl)c1 2201778995 NAWHDPXRFAREHA-ITDIGPHOSA-N 296.798 2.090 10 10 CECE C[C@H]1OC2(C)CC1(CNCc1ccc(O)c(O)c1)C2 2100426283 WRTFWYCYMIXQKZ-SFNBMPIDSA-N 263.337 2.145 10 10 CECE COCC1(C(=O)N2CCCC[C@H](CN=[N+]=[N-])C2)CC1 2101804820 OFBIBUDAIBSNOE-LLVKDONJSA-N 266.345 2.352 10 10 CECE COc1ccc(N2CC[C@@H](N)[C@H](C)C2)c(F)c1F 2081861388 IMZIRWUNCYDSJL-RKDXNWHRSA-N 256.296 2.147 10 10 CECE COc1ccc(N2CCN[C@@H](C)CC2)c(F)c1F 2081868252 SADCNGMWVRSDKW-VIFPVBQESA-N 256.296 2.162 10 10 CECE [N-]=[N+]=NC1CCN(CC23COC(CF)(C2)C3)CC1 2082656004 TVRURAZOSZQCTN-UHFFFAOYSA-N 254.309 2.280 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@@H]1COC(C)(C)C1 2103159688 XZPBSRRIVUKIAR-LLVKDONJSA-N 264.369 2.221 10 10 CECE Nc1ccc(CCC(=O)NC[C@@H]2C[C@@H]2C(F)F)cc1 2103536610 MFUZJKNMRXBOGZ-JQWIXIFHSA-N 268.307 2.219 10 10 CECE CCN[C@@H](C)c1cnc(Sc2nnnn2C2CC2)s1 2103568013 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CCN1CCc2cc([C@@H](O)[C@H](N)C(C)(C)C)ccc21 2106792390 CNFFHVDAKOCPBD-CABCVRRESA-N 262.397 2.476 10 10 CECE C[C@@H]([C@H](NN)c1ccc(N(C)C)cc1)[C@H]1CCCO1 2106858319 VIHMGKNMNRHHJX-DFBGVHRSSA-N 263.385 2.072 10 10 CECE CC[C@H](CCN)[C@H](O)c1ccc2c(c1)CCN2CC 2106804742 FLTLNXHRJZOYJY-WBMJQRKESA-N 262.397 2.477 10 10 CECE C[C@@H]1OCC[C@@H]1[C@@H](N)c1ccc2c(c1)CCCN2C 2106830782 KBQLZSLMTBNEJN-PJODQICGSA-N 260.381 2.494 10 10 CECE CN1CCC(N)(c2ccc(N3CCCC3)cc2)CC1 2106826795 WNDBTUDSWBJKEH-UHFFFAOYSA-N 259.397 2.166 10 10 CECE C[C@H]1C[C@@H](C)NCCN1c1ccc2c(c1)COCC2 2108185924 NROCNLDGXUFGDC-OLZOCXBDSA-N 260.381 2.336 10 10 CECE CCCO[C@H]1C=CCN(c2ccc(CO)cc2F)C1 2108782664 VWWUITBPURVLAU-ZDUSSCGKSA-N 265.328 2.489 10 10 CECE Cc1cc(N2CC=C[C@H](O)C2)ccc1CNC(C)C 2108786964 DAGODGFKDPWVEA-INIZCTEOSA-N 260.381 2.230 10 10 CECE C[C@@H](N[C@H](C)c1c(O)cccc1O)c1ncccn1 2089066259 BRHGTKMGKGQHSL-NXEZZACHSA-N 259.309 2.300 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@H](CN)C[C@H]1C 2091831827 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Cc1nc2n(c1C)CCN(c1ccc(CO)cc1)C2 2114699237 GJNZYTPKERIWLO-UHFFFAOYSA-N 257.337 2.012 10 10 CECE CCN(C)[C@H]1CCCN(Cc2c(O)cccc2F)C1 2114839315 GJSMCVIYZWAMRX-LBPRGKRZSA-N 266.360 2.447 10 10 CECE COc1cc(N(C)Cc2csnc2OC)ccc1CN 2204553322 JMKVTHPYCFOKHY-UHFFFAOYSA-N 293.392 2.255 10 10 CECE CCCNCc1ccc(N2CCC[C@H]2CO)cc1OC 2204552838 GZFMHTJKYUOHLV-HNNXBMFYSA-N 278.396 2.156 10 10 CECE Cc1cccc(CNC(=O)c2cc(O)ccc2F)c1O 2204610459 MLXWVKWJDRGLCR-UHFFFAOYSA-N 275.279 2.475 10 10 CECE Cc1ccc(CNCc2ccn3cnnc3c2)c(O)c1 2204639071 GGPXXWSAWCKKGF-UHFFFAOYSA-N 268.320 2.033 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCN2CC1CC(O)C1 2205406087 ROPOBEOKVIKMPJ-VEAWUBTESA-N 274.408 2.491 10 10 CECE CC[C@@H]1CN(c2ccc([C@H](C)NC)c(O)c2)C[C@@H]1CO 2205799260 RKUAFLLRRXAWHR-YNEHKIRRSA-N 278.396 2.127 10 10 CECE CCSC1CN(c2ccc(OC)cc2CNC)C1 2220415752 VSVRURVKIMNOOO-UHFFFAOYSA-N 266.410 2.356 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCN(C)C2(CC2)C1 2232095110 ABFYQLOHHKOTRU-ZDUSSCGKSA-N 260.381 2.333 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC[C@H](O)[C@H]1C1CC1 2232095068 ZMUQKFSTMQYMDK-XFBWCDHKSA-N 261.365 2.398 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@@H]3[C@@H]2CO)c(C)c1 2232103258 WPRAFSKWRNMRGC-DSRCVFDASA-N 260.381 2.092 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)C[C@H](CC(=O)O)C1CC1 2234172052 QUASZVFFSWKKPS-GHMZBOCLSA-N 280.328 2.179 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2CC[C@H](C(=O)O)C2)CC1 2234173745 ZAFUTFFUZBZXHE-GARJFASQSA-N 280.328 2.179 10 10 CECE COc1ccc(N2CC[C@@](C)(O)[C@@H](O)C2)cc1C(C)C 2235142424 DNERFOPGLDDMHA-JKSUJKDBSA-N 279.380 2.141 10 10 CECE COc1cc(N(CCO)C(C)(C)C)cc(OC)c1OC 2235134403 MYEAUFBBRKXCJE-UHFFFAOYSA-N 283.368 2.310 10 10 CECE COc1ccc(N(C)[C@H]2[C@H]3[C@H]4[C@H]3C[C@@H]3[C@H]4[C@H]23)c(CN)c1 2235976886 KQHDWTAQYUGUSZ-VQTGRZPPSA-N 270.376 2.100 10 10 CECE CCCNCc1cc(OC)ccc1N(CC)C[C@@H](C)O 2235965780 JBNHEYMEQHILPU-CYBMUJFWSA-N 280.412 2.402 10 10 CECE COc1ccc(N2CCC[C@@H](OC)[C@@H]2C)c(C(=O)O)c1 2235952237 MARMMPZXJSDORS-IINYFYTJSA-N 279.336 2.397 10 10 CECE COc1ccc(N(C)CC23CC(C2)[C@@H](C)O3)c(CN)c1 2235966274 QHDGWIFSEKDZKO-FFKNIBCLSA-N 276.380 2.158 10 10 CECE COc1ccc(N2C[C@@H](OC)C[C@@H](C)C2)c(CCN)c1 2235977015 LWIQOLRBEPVYCE-DOMZBBRYSA-N 278.396 2.058 10 10 CECE CCCC[C@@H](C)OC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 2236263170 OADDUUZNOZGCGP-PWSUYJOCSA-N 281.352 2.090 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H](O)C[C@H](F)C2)cc1 2226290296 SYFGURDKHZTGQO-WHOFXGATSA-N 266.360 2.266 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1COC2CC1C2 2226358839 KNUXXWLCVSWODT-KRBLXSNTSA-N 269.291 2.185 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CCCO3)CC12CC2 2226667554 ISZXNZFDATXMAQ-HNNXBMFYSA-N 259.349 2.363 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@H](O)C4(CC4)C3)ccc2O1 2226699162 FNHJQQGHELCCEZ-ABAIWWIYSA-N 259.349 2.361 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@]3(CO)C2)c(F)c1 2226788332 JZKKROZTQFUUDO-XHDPSFHLSA-N 265.328 2.433 10 10 CECE Nc1ccc(CCN2CC(COC(F)(F)CF)C2)cc1 2236855862 XYNASEGUFGIYIR-UHFFFAOYSA-N 288.313 2.322 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc(OC)cc1OC 2226803336 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CN(C)c1ccc([C@H]2CN3CCCC[C@@H]3CN2)cc1 258534141 GKTKKLLETPITQJ-HZPDHXFCSA-N 259.397 2.251 10 10 CECE CCNCc1cc(Br)cc(OC)c1O 32026413 IAPDYWAKAINOLR-UHFFFAOYSA-N 260.131 2.273 10 10 CECE CCN[C@H]1CCc2cc(N(CCO)C3CC3)ccc21 2128293249 DFQCCOUCSSBEOT-INIZCTEOSA-N 260.381 2.245 10 10 CECE CC1(C)C[C@@H](O)CN(c2ccc3c(c2)CC[C@H]3O)C1 2128322829 QUIBNWCRCLLSNI-UKRRQHHQSA-N 261.365 2.263 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@H]3O)C[C@@H](C)[C@@H]1O 2128320310 BGMPUTFJQWRTKF-CJTUPEFNSA-N 261.365 2.119 10 10 CECE COc1cccc(O)c1CN(CCN)C1CCCC1 2130095750 STFNNYBGPGJNPI-UHFFFAOYSA-N 264.369 2.104 10 10 CECE CN1CCC[C@H](CCNCc2cccc(F)c2O)C1 839179864 ALXMHUOYWKWHBH-GFCCVEGCSA-N 266.360 2.353 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@H]3COC[C@@H]3C2)c(F)c1 1911989386 SNRJGEGFXMORJW-RYUDHWBXSA-N 277.295 2.006 10 10 CECE NCc1cc(F)c(N2C[C@@H](CO)C3(CCC3)C2)c(F)c1 1914011887 WVUIIIAIUXRCRE-NSHDSACASA-N 282.334 2.022 10 10 CECE COC[C@H](CN1CCCC[C@@H](CN=[N+]=[N-])C1)OC 1912196446 VKVIQCIAXJLECQ-RYUDHWBXSA-N 256.350 2.060 10 10 CECE CCCN(c1ccc([C@@H](C)NC)c(O)c1)C1COC1 1915636611 KOIVDQAUYIKFER-LLVKDONJSA-N 264.369 2.288 10 10 CECE C[C@@H]1SCCN([C@H](C)C(=O)Nc2ccc(N)cc2)[C@H]1C 221960111 HGZLPUYFGBDTCG-TUAOUCFPSA-N 293.436 2.422 10 10 CECE CO[C@H](CN(C)[C@@H](C)c1ccccc1O)[C@@H]1CCOC1 1968788498 FHQBVCWMIDGIMQ-WOSRLPQWSA-N 279.380 2.437 10 10 CECE CCN(c1cc2c(cc1Cl)[C@@H](N)C(=O)N2)[C@H](C)COC 227448139 RVDXDSASKOCQIZ-AMIZOPFISA-N 297.786 2.153 10 10 CECE CCOc1cccc(CNCc2cc(Cl)n(C)n2)c1O 1967894105 BEUUFCNDUKJXOA-UHFFFAOYSA-N 295.770 2.468 10 10 CECE Cc1cc(CNCc2ccc(N(C)C)cc2)c(C)nn1 1968438235 GMQCNSVCSOHFAI-UHFFFAOYSA-N 270.380 2.449 10 10 CECE Cc1ccc(O)c(CNCCONC(=O)OC(C)(C)C)c1 1928415228 OVWWGEIWAPWUAQ-UHFFFAOYSA-N 296.367 2.247 10 10 CECE COc1cccc(O)c1CNC[C@@]1(O)CC[C@H](C)C1 2136899880 NWBSLGUFGLZNQF-XHDPSFHLSA-N 265.353 2.042 10 10 CECE CC[C@H](C)N(CCOC)c1ccc(CO)c(OC)c1 2139682235 FCPQWXJINLCTOJ-LBPRGKRZSA-N 267.369 2.439 10 10 CECE CC[C@@H]1OCC[C@H]1CNCc1cc2c(cc1O)OCO2 233924113 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C[C@@H](NC[C@]1(F)C[C@@H](CO)C1)c1cc(F)ccc1O 1974385954 AIYSUSVAPROHSR-RULNRJAQSA-N 271.307 2.293 10 10 CECE Nc1[nH]ncc1-c1cc(O)c(O)cc1C(F)(F)F 258313626 DCMGBHRWOOYGPB-UHFFFAOYSA-N 259.187 2.089 10 10 CECE CCOc1cccc(CN(C)C[C@@H]2CCN(C)C2)c1O 156020170 AZNYDRIUHHBFDL-CYBMUJFWSA-N 278.396 2.174 10 10 CECE CCC[C@H](C)NC(=O)c1ccn(-c2ccc(N)cc2)n1 35427849 XWWWUOYNJVHTJA-NSHDSACASA-N 272.352 2.373 10 10 CECE Nc1ccc(OCCN2C[C@H]3CCCC[C@@H]3C2=O)cc1 2145026668 AASWPXPKAAROOP-DOMZBBRYSA-N 274.364 2.296 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1c(C)nn(C)c1Cl 2148165751 ZFEIOZXWFQWLPC-STQMWFEESA-N 295.770 2.082 10 10 CECE CC[C@H](NC1CCC(C(N)=O)CC1)c1ccccc1O 37152343 HYIZDNUBKFDPQW-YIZWMMSDSA-N 276.380 2.477 10 10 CECE CN(C)[C@@H]1CC[C@H]1NCc1ccc(Br)cc1O 1996066634 BXLFVJBQODPANB-VXGBXAGGSA-N 299.212 2.337 10 10 CECE C[C@H](NC(=O)COc1ccc(N)cc1)[C@H]1CCCSC1 2146124965 BJFNTXHEHITTIK-RYUDHWBXSA-N 294.420 2.296 10 10 CECE N[C@@H]1[C@@H]2CN(Cc3cc(Cl)cc(Cl)c3O)C[C@@H]21 2000283723 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CO[C@@H](C)CN(C(=O)CCc1ccc(N)cc1)C(C)C 708284739 ZLHMNIVUAVERDD-ZDUSSCGKSA-N 278.396 2.473 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](CO)[C@@H](C)C2)c(Cl)c1 708754240 GYOBNELOXHDGRP-UMNHJUIQSA-N 269.772 2.458 10 10 CECE C[C@H](CO)CN(C)c1ccc(CNC2CC2)cc1F 688307844 TVRSZPHLWGUCKK-NSHDSACASA-N 266.360 2.142 10 10 CECE CCCNC[C@H]1CCN(c2ccc3c(c2)CN(C)C3)C1 689492458 OKIXAIDJZZVGQF-CQSZACIVSA-N 273.424 2.458 10 10 CECE CCCN(Cc1ccc(N)cc1)Cc1nccn1C 689515861 SIAVQYWHCBIWII-UHFFFAOYSA-N 258.369 2.415 10 10 CECE CN(C)c1ccc([C@]2(C)[C@@H](N)CCN2C2CC2)cc1 711953210 HAEVRNPUTLWWOW-JKSUJKDBSA-N 259.397 2.163 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c(F)c1 380479266 WDGJTRYVBPWKGK-CKPQTPHLSA-N 276.355 2.051 10 10 CECE O=C(N[C@@H]1C[C@@H]2CCCC[C@H]21)c1ccc(O)c(O)c1 712573102 SUFDEPDCXURZMZ-MVWJERBFSA-N 261.321 2.406 10 10 CECE CNC(=O)[C@@H](CC(C)C)N[C@@H]1CCc2cccc(O)c21 380507405 OTKXBKSXILFNRG-CHWSQXEVSA-N 276.380 2.130 10 10 CECE COC(=O)c1ccnc(OCCc2ccc(N)cc2)c1 2176331725 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COc1cccc(CNC[C@H]2C[C@H]3CC[C@H]2O3)c1O 388538778 MXVIGSXDMYBSSH-JHJVBQTASA-N 263.337 2.058 10 10 CECE C[C@H](N[C@@H](C)c1ccc(F)cc1O)c1cn(C)nn1 720546141 PVNJFOGQVLCHLT-IUCAKERBSA-N 264.304 2.072 10 10 CECE COC[C@H](C)CN(C)c1cc(OC)c(OC)cc1N 389406350 JVIIGHCLFQJOPK-SNVBAGLBSA-N 268.357 2.005 10 10 CECE C[C@H](NCCN1CC=CCC1)c1c(O)cccc1O 392294764 PYTZEOJHWZVDIR-LBPRGKRZSA-N 262.353 2.010 10 10 CECE CN1[C@H]2CC[C@H]1CN(Cc1cccc(Cl)c1O)C2 723685446 CQJAWNYYPGXVPQ-RYUDHWBXSA-N 266.772 2.324 10 10 CECE C[C@@H]1C[C@@H](CNCc2ccc3c(c2)CCO3)CN1C 396674905 SKMSLNHRVLCFQP-OCCSQVGLSA-N 260.381 2.051 10 10 CECE O=C(C[C@H](O)C1CC1)NCc1c(O)ccc2ccccc12 2062431526 LAOOXDUNPFSSHC-INIZCTEOSA-N 285.343 2.323 10 10 CECE Nc1ccc(NC(=O)N2[C@H](CO)C[C@@H]3CCC[C@H]32)cc1 2164843862 XREOMUGFRRDOCG-LEWSCRJBSA-N 275.352 2.036 10 10 CECE CCc1cnn(Cc2cccc(Cl)c2O)c1N 2070244680 KKSOEOZBQLZPIT-UHFFFAOYSA-N 251.717 2.435 10 10 CECE COc1cccc(Cn2cc(Cl)c(O)n2)c1O 2070600335 PMPVOMQOYVNQRK-UHFFFAOYSA-N 254.673 2.005 10 10 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Cc1cccc2nc(C(=O)N3CC[C@H](N=[N+]=[N-])C3)cn12 1912159674 KYGFZOZIWRBALS-JTQLQIEISA-N 270.296 2.168 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C1 1912206455 FZTIJIWGQKSQNI-SSDOTTSWSA-N 279.231 2.259 10 10 CECE COCCNCc1ccc(N2CC[C@@H](O)[C@H]2C)c(Cl)c1 1914236266 LVEKDHSEHOEMPU-IAQYHMDHSA-N 298.814 2.036 10 10 CECE Cc1ccnc(C(=O)Nc2ccc(O)cc2C(=O)O)c1 1912393484 GTYQZKPJCNPFQN-UHFFFAOYSA-N 272.260 2.046 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2CC1(CO)CC1 1913933349 BMOZDJPWDKXTQP-GFCCVEGCSA-N 260.381 2.231 10 10 CECE COc1cc(N2CCC[C@](C)(OC)C2)ccc1CO 2139682412 HLGAKMHSYZIDHP-HNNXBMFYSA-N 265.353 2.193 10 10 CECE COc1cc(N2C[C@H](OC)CC[C@H]2C)ccc1CN 2139696498 IKKKJDFGZMDRTE-BXUZGUMPSA-N 264.369 2.158 10 10 CECE COc1cc(N(C)CCOC(C)(C)C)ccc1CO 2139684174 HCQDSOVGKDBVCW-UHFFFAOYSA-N 267.369 2.439 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC2(CCC2)C1 1914958858 HPZJVTWAQWAZHU-NSHDSACASA-N 259.353 2.082 10 10 CECE CC(C)(C)OC(=O)NC[C@@](C)(N)c1ccccc1O 220982728 OJYSESXEWAUKAM-CQSZACIVSA-N 266.341 2.091 10 10 CECE CC=C1CCN([C@@H](C)C(=O)Nc2ccc(N)cc2)C1 1915310865 DBVYMZDCXHMUOJ-NSHDSACASA-N 259.353 2.248 10 10 CECE Nc1ccc(CC(=O)N2CC[C@@H](CC(F)F)C2)cc1 1916615994 AVCLUTXYCYXLCD-NSHDSACASA-N 268.307 2.315 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC[C@@H](CC(=O)O)C1 226420680 MRAGHSZMPUZZEO-QWRGUYRKSA-N 279.336 2.346 10 10 CECE CCOc1cccc(CNC[C@@H](CO)C(F)(F)F)c1O 1967742247 FPQAZPATDUGLFO-JTQLQIEISA-N 293.285 2.051 10 10 CECE Oc1cc(F)ccc1CNC1(C(F)F)CCOCC1 1967806017 WPZMEKQMESGXLC-UHFFFAOYSA-N 275.270 2.435 10 10 CECE NCc1ccc(N2CCO[C@H]3CCCC[C@H]32)cc1F 228188357 OUXSKABJDGLNTH-CABCVRRESA-N 264.344 2.432 10 10 CECE COc1ccc(CNC(C)(C)C(C)(C)O)c(O)c1 229038858 AUSHAYGCDJKQSC-UHFFFAOYSA-N 253.342 2.040 10 10 CECE CCCNCc1ccc(N2CC[C@](C)(O)C2)c(C)c1 233112662 SDLAWTNIHUSIRD-INIZCTEOSA-N 262.397 2.456 10 10 CECE CNCc1cccc(CN(C)c2ccc(OC)cc2)n1 234426245 SIDXUBXGJCXLGT-UHFFFAOYSA-N 271.364 2.446 10 10 CECE CCN1CCN(c2ccc(CNC)cc2F)CC1(C)C 2145694632 JKYXJWZMIYQQKD-UHFFFAOYSA-N 279.403 2.466 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)c1ncc(CC)[nH]1 2148158139 YHUXFQBHFZLXRR-KGLIPLIRSA-N 275.352 2.062 10 10 CECE COc1ccc([C@@](C)(O)[C@@H](N)c2ccccc2O)cc1 2148162837 KOWWQBVZSDTFOD-JKSUJKDBSA-N 273.332 2.308 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)COC[C@@H]1C(C)C 2148150570 CVQGOGASBDGZJH-BMFZPTHFSA-N 279.380 2.076 10 10 CECE C[C@H](N)c1ccc(N2CCC([C@H](C)O)CC2)cc1O 235570755 SOUJVJNQHHPQGE-QWRGUYRKSA-N 264.369 2.009 10 10 CECE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2O)C[C@H]1C(=O)O 1952829916 QNDHAEHKBSKOKJ-ZUZCIYMTSA-N 293.319 2.217 10 10 CECE O=C(O)[C@@H]1C[C@@]12CCCN(Cc1cc(F)ccc1O)C2 2146459199 GBQGTTVZFFAQTB-SWLSCSKDSA-N 279.311 2.218 10 10 CECE CO[C@H]1CN(c2ccc(C=CC(=O)O)cc2F)C[C@H]1F 2146474683 XNKHVPZDWODAQX-YPMHNXCESA-N 283.274 2.097 10 10 CECE CO[C@@H](CCO)CNCc1cc(Cl)cc(Cl)c1O 1972504554 WWHXARQNSXGJFU-JTQLQIEISA-N 294.178 2.186 10 10 CECE Cc1cnc(CN2CCc3cc(N(C)C)ccc32)nc1 2143369760 HSUMLQUYEGUIHE-UHFFFAOYSA-N 268.364 2.414 10 10 CECE N[C@H](CCC(=O)O)c1ccc(C(F)(F)F)cc1O 258333237 CRLZXCDJCDOFPE-MRVPVSSYSA-N 263.215 2.276 10 10 CECE O=C(O)c1cc(-c2cc(O)c(O)cc2C(F)(F)F)no1 258384034 ACAASPQTFJHNCU-UHFFFAOYSA-N 289.165 2.470 10 10 CECE Cn1nc(-c2cc(C(C)(C)C)cc(O)c2O)cc1N 258534483 ZAZVSXVIEBYNGH-UHFFFAOYSA-N 261.325 2.378 10 10 CECE CCN(CC)C(=O)CCCN(C)Cc1ccc(N)cc1 2148889088 OEGUGKSWYIYYSY-UHFFFAOYSA-N 277.412 2.349 10 10 CECE C[C@H](Nn1nnc2c1CCCC2)c1ccc(F)cc1O 2143846202 FKDXROWBDBHJOT-VIFPVBQESA-N 276.315 2.306 10 10 CECE CN(C)CC1CCN(CCCc2ccc(N)cc2)CC1 158204763 SAAPGKAKPIHDLI-UHFFFAOYSA-N 275.440 2.475 10 10 CECE CC(C)NCc1ccc(N2CCCN(C)CC2)cc1 34824326 KFIRMWLDSOSXSC-UHFFFAOYSA-N 261.413 2.327 10 10 CECE Oc1cccc(CN[C@@H]2CCC[C@@]34C[C@@H](CO3)[C@H]24)c1O 2144359315 RIJBEKYUEOJCGA-DMEJVMROSA-N 275.348 2.145 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CCO3)C2)cc1Br 2004482969 WXDXNFDQPDFBQJ-SECBINFHSA-N 298.180 2.482 10 10 CECE Oc1ccccc1CN[C@@H]1CCC[C@H]1n1ccnc1 37106754 XFZOTBAJUHIGRQ-ZIAGYGMSSA-N 257.337 2.472 10 10 CECE Cc1ccc(CC(=O)NCc2ccc(N)cc2)cc1 37666332 DPACIEBUCZACPR-UHFFFAOYSA-N 254.333 2.436 10 10 CECE COc1ccc([C@H](C)NC[C@H]2C[C@]23CCOC3)c(O)c1 2156734359 SRNQYWDKKBAVGU-OZVIIMIRSA-N 277.364 2.478 10 10 CECE NCc1ccc(N2CCOC3(CC3)C2)cc1Br 2002877247 PTWOKMICVMJRRD-UHFFFAOYSA-N 297.196 2.277 10 10 CECE CCSCCNCc1ccc(N2CCOCC2)cc1 273678707 GWCVENOTXDTOFN-UHFFFAOYSA-N 280.437 2.366 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3COC[C@H]2C3)cc1Br 2021458937 ZBHBKWSVUJESDW-JMJZKYOTSA-N 298.180 2.480 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@@H]1CCOC1(C)C 2153795484 FGBZNWDAXFEHRW-CQSZACIVSA-N 276.380 2.227 10 10 CECE CC[C@@]1(N)CCCN(Cc2cc(F)ccc2O)C1 2027502315 XNZNDTUBIBKLNA-CQSZACIVSA-N 252.333 2.235 10 10 CECE CN1CCc2cc([C@H](O)c3cnn(C(F)F)c3)ccc21 2154541254 ZHPNNNNGMBZKTP-ZDUSSCGKSA-N 279.290 2.352 10 10 CECE CC(C)[C@@](C)(NCc1ccc(Cl)cc1O)C(N)=O 2029642284 XVPSUUUJLWMZPJ-CYBMUJFWSA-N 270.760 2.035 10 10 CECE CC[C@H](CN(C)C)N[C@H](C)c1ccc(O)cc1O 2029862902 WHPKBWUFZZKMSM-GHMZBOCLSA-N 252.358 2.089 10 10 CECE CN(CCOc1ccc(N)cc1)C[C@]1(C)CCCN1C 2154952003 KDWYQADNUZUKGY-INIZCTEOSA-N 277.412 2.064 10 10 CECE C[C@@H]1CCN([C@H](C)c2ccc(O)cc2O)[C@H](CN)C1 300094053 UJDPVSAJCIEGTN-UTUOFQBUSA-N 264.369 2.218 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCCO[C@@]1(C)CC 2155094982 PMABEKOOYUHLJS-QWHCGFSZSA-N 284.360 2.167 10 10 CECE CCCNCc1ccc(OC[C@H](O)CF)c(C)c1 2037502442 YSPIGQUDPYGOHQ-CYBMUJFWSA-N 255.333 2.204 10 10 CECE CN(C)c1ccc2c(c1)OCCN2[C@@H]1CCC[C@]1(C)O 2155596478 KFQMUKUWTSWMIX-CVEARBPZSA-N 276.380 2.255 10 10 CECE CN1CCC[C@H](CN2CCC[C@H](N=[N+]=[N-])CC2)C1 2038010593 VDXSKVSHJHNYKE-STQMWFEESA-N 251.378 2.493 10 10 CECE OCc1ccc(N2CC(COC(F)(F)F)C2)cc1 2038698762 HTLHMAXUBWDJGM-UHFFFAOYSA-N 261.243 2.152 10 10 CECE N[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1C(F)F 2040867690 HRVLQMSDXOWRPF-NXEZZACHSA-N 276.714 2.070 10 10 CECE C[C@H](NC[C@H](C)N1CCC1)c1cc(F)ccc1O 2041319113 RRLHTDKCVIMUPB-QWRGUYRKSA-N 252.333 2.276 10 10 CECE CN(c1ccc(CN)c(F)c1F)[C@H]1CCCOC1 401621845 QUBQTVLBXKKMOX-JTQLQIEISA-N 256.296 2.039 10 10 CECE CCN(c1ccc([C@@H](C)N)c(O)c1)[C@@H]1CCCOC1 402651362 JSXBFWYFQIWQFR-DGCLKSJQSA-N 264.369 2.417 10 10 CECE C[C@H](OCc1ccccc1)C(=O)NCc1ccc(N)cc1 404444658 ZMCZFKGNTKHERN-ZDUSSCGKSA-N 284.359 2.490 10 10 CECE CN(Cc1ccc(O)c(O)c1)C1(C(=O)O)CCCCC1 312933007 OFFBGZDIDXWBCE-UHFFFAOYSA-N 279.336 2.317 10 10 CECE CC(C)(C)[C@H]1C[C@H]1C(=O)NCc1cc(N)ccc1O 700007933 POAQEWULYDSSFX-NEPJUHHUSA-N 262.353 2.273 10 10 CECE C[C@@H](c1ccccc1O)N1CCC(CS(C)(=O)=O)CC1 313609998 XBJIEERMSIYTMH-LBPRGKRZSA-N 297.420 2.210 10 10 CECE CC(C)[C@H]1CNCCCN1[C@@H](C)c1cc(O)ccc1O 2159168481 OCNBGAOCGBDPOO-SWLSCSKDSA-N 278.396 2.479 10 10 CECE CCC(CC)(CO)SC[C@H](O)COc1ccc(N)cc1 322694850 PDQWJYDMBDGWKN-CYBMUJFWSA-N 299.436 2.293 10 10 CECE C[C@H](N[C@H]1CCOC1(C)C)c1c(O)cccc1O 328207797 IUXDYJRBFPWNAU-CABZTGNLSA-N 251.326 2.316 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCN[C@@H]2CC[C@H]21 2177704660 MLHSLYVPALWXHS-ZACQAIPSSA-N 272.392 2.246 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)NCCCN=[N+]=[N-] 701302798 GOOAZVRWFOOLLB-AXFHLTTASA-N 253.350 2.064 10 10 CECE CC(C)CN1CCN(c2ccc([C@H](C)N)c(O)c2)CC1 93671440 LRMGMJVLOLFGJR-ZDUSSCGKSA-N 277.412 2.190 10 10 CECE Cn1cc(NCc2cc(Cl)cc(Cl)c2O)nn1 701824686 BZSIWHOEPMFTDR-UHFFFAOYSA-N 273.123 2.440 10 10 CECE C[C@@H]1OCC[C@@H]1CNCc1ccc(F)c(F)c1O 703275874 OUHOHCFBHACCCT-DTWKUNHWSA-N 257.280 2.185 10 10 CECE CCCN(Cc1ccnn1C)c1ccc(CO)cc1F 2170073008 YPUQUZOKGFFFJF-UHFFFAOYSA-N 277.343 2.468 10 10 CECE CNCc1cc(F)c(N2C[C@H](CO)CC[C@H]2C)c(F)c1 688738826 QYELWVGMXPEWCA-GHMZBOCLSA-N 284.350 2.281 10 10 CECE C[C@@H]1C[C@H](CN)CN1Cc1c(O)cccc1Br 706861427 VGPHRNSSXWNTOL-NXEZZACHSA-N 299.212 2.324 10 10 CECE NC[C@@H](CC(=O)NCc1ccccc1O)C1CCCC1 686967054 PHFQJGXTUZECSZ-CQSZACIVSA-N 276.380 2.164 10 10 CECE CNCc1ccc(N2CCS[C@@H]3COCC[C@@H]32)cc1C 2170510751 LMEOCJKDUVWJKH-JKSUJKDBSA-N 292.448 2.425 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CC[C@]2(CCCNC2)C1 709970349 IQJHRSVVRUWZSL-LRDDRELGSA-N 276.380 2.234 10 10 CECE C[C@H]1CSCCN(CCC(=O)Nc2ccc(N)cc2)C1 379533052 ZIWXSLNMEZANKW-GFCCVEGCSA-N 293.436 2.282 10 10 CECE C[C@H](CNCc1ccc(O)cc1O)[C@H]1CCCCO1 711965549 OXQPTMDAOTVGOG-IAQYHMDHSA-N 265.353 2.393 10 10 CECE Oc1c(F)cccc1CN[C@H]1CO[C@@H](C2CC2)C1 691425368 XTNUWJAPMKLKTD-DGCLKSJQSA-N 251.301 2.188 10 10 CECE CCOc1cccc(CN2CC[C@@H](N(C)C)[C@H]2C)c1O 380684578 DFNRWVNHZWFLGG-TZMCWYRMSA-N 278.396 2.315 10 10 CECE CCC(F)(F)CN(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 692860290 BUOYOFWPHPBLIM-LBPRGKRZSA-N 283.322 2.144 10 10 CECE CN(Cc1cccn1C)C(=O)CCc1ccc(N)cc1 2170998177 WJKHXLAKQPTKTQ-UHFFFAOYSA-N 271.364 2.199 10 10 CECE CC(C)CNCc1ccc(N2CC[C@@H]3C[C@]3(O)C2)cc1 2171004781 KYSBEGZYKJDXER-WBVHZDCISA-N 274.408 2.393 10 10 CECE CNCc1ccc(N2CCC[C@H](N3CCCC3)C2)cc1 382509197 XHZJYDAMOBIGBZ-KRWDZBQOSA-N 273.424 2.471 10 10 CECE CCOCCCN(C)[C@H](CN)c1ccc(N(C)C)cc1 382812943 QWYONMMVJXHBNR-MRXNPFEDSA-N 279.428 2.111 10 10 CECE CC[C@@H]1[C@H](C)CCN1c1ccc2c(c1)NC(=O)[C@@H]2N 384016752 PITDDWIYCNJLMN-OWYVNGRQSA-N 259.353 2.263 10 10 CECE 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272.142 2.155 10 10 CECE C[C@H](CO)c1cc(Br)c(F)c(O)c1O 258345048 DSLGPSVCWFWUTJ-SCSAIBSYSA-N 265.078 2.095 10 10 CECE C[C@H](c1ccccc1O)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2 251568865 UIFAYFAFPJPVEE-DNIRFERGSA-N 261.321 2.391 10 10 CECE Nc1ccc(OCc2nc([C@H]3C[C@H]4CC[C@H]3O4)no2)cc1 250004172 RVAORIYOVPDLFX-FRRDWIJNSA-N 287.319 2.266 10 10 CECE CCN(CC(=O)OC)Cc1cccc(Cl)c1O 271716018 IKLYBYJYYPGLFM-UHFFFAOYSA-N 257.717 2.041 10 10 CECE CCOc1ccc(O)c(CNC2(COC)CCC2)c1 283798941 AGAYBAPTAOWBNG-UHFFFAOYSA-N 265.353 2.450 10 10 CECE CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@@H](O)C(F)F 294927525 BKGVJIQGWKBTEF-YDEJPDAXSA-N 289.322 2.456 10 10 CECE CN(C[C@@H]1COC2(CCCC2)O1)c1ccc(N)cc1 702103223 DAMWWKKPBSBDOQ-CQSZACIVSA-N 262.353 2.391 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H](N)CC(F)(F)F)ccc21 2163065011 ZYRYSGQYSCKUIY-WCQYABFASA-N 288.313 2.382 10 10 CECE CCN1CCc2cc([C@H](N)[C@]3(O)C[C@@H](C)[C@H]3C)ccc21 2163131411 QUGKJLPHXAMXQL-UDVXPWBQSA-N 274.408 2.476 10 10 CECE CC[C@H](OC)[C@@H](O)[C@H](N)c1ccc(N2CCCC2)cc1 2163231972 XKYHOJIPRWKXCM-ARFHVFGLSA-N 278.396 2.073 10 10 CECE CNCc1ccc(N2CCO[C@@]3(CCOC3)C2)cc1Cl 2168206722 UWJWXLSCPMDSFX-HNNXBMFYSA-N 296.798 2.055 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](CO)OCC2(C)C)cc1Cl 2167526739 KKDKQGCQDGCTQA-PWSUYJOCSA-N 298.814 2.336 10 10 CECE CCC[C@]1(O)CCCN(c2ccc(CO)cc2F)C1 710251597 WULNUEBGBPRAFV-HNNXBMFYSA-N 267.344 2.449 10 10 CECE C[C@@H](CCNCc1cc(Cl)c(F)cc1O)[S@@](C)=O 816563506 AHGFXELOWQTGDZ-DCXZOGHSSA-N 293.791 2.431 10 10 CECE C[C@H](CN(C)c1ccc(CN)cc1)N1CCCCC1 2132187725 MMEXMFWNIBMWJC-CQSZACIVSA-N 261.413 2.456 10 10 CECE O=C(O)/C=C/c1cccc2c(O)c(CC(=O)O)sc12 725386673 VEYLANNILZPCNS-SNAWJCMRSA-N 278.285 2.332 10 10 CECE COc1ccc(O)c(CNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3C2)c1 817550141 SCEDSBPPGCHYFM-IJLUTSLNSA-N 275.348 2.453 10 10 CECE C[C@H](N[C@@H]1CCN(C)[C@H]1C)c1cc([N+](=O)[O-])ccc1O 903300986 MLHNRECUEPRZCU-OUJBWJOFSA-N 279.340 2.044 10 10 CECE CCCc1ncc(CNC(=O)c2cc(O)cs2)o1 839787779 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286.331 2.002 10 10 CECE CN[C@H]1CCN(c2ccc(OC)c(OC)c2)C1(C)C 259360107 KGMRDKKWEPPMQH-AWEZNQCLSA-N 264.369 2.281 10 10 CECE CCN(CC)C(=O)CCCN1CCC[C@H]1CN=[N+]=[N-] 2123021664 WQOICFQHMCGFNL-LBPRGKRZSA-N 267.377 2.410 10 10 CECE COC(=O)c1ccc(C(=O)N[C@H](C)c2ccccc2O)o1 1643738634 KBWRUIKZPSIFEC-SECBINFHSA-N 289.287 2.263 10 10 CECE CC[C@@H](C)N1CCN(Cc2ccc(F)cc2O)CC1 1964540017 YUFHBZCQTFYTJK-GFCCVEGCSA-N 266.360 2.447 10 10 CECE CCN(CCCCC(=O)O)Cc1c(O)cccc1OC 1964726283 LLWLKHUTRIYNEO-UHFFFAOYSA-N 281.352 2.478 10 10 CECE COc1ccc(CN[C@H](C)c2ccc(O)cc2O)cn1 20186221 NUFQKXKINQFTLD-SNVBAGLBSA-N 274.320 2.352 10 10 CECE CN1CCCC[C@H](CNCc2c(O)cccc2F)C1 1965948823 NVGKYZHDXKGFNV-GFCCVEGCSA-N 266.360 2.353 10 10 CECE CNCc1ccc(N2CC3(C2)CC(C)(O)C3)c(C)c1 2126890081 UHXAFKBJBLGDEH-UHFFFAOYSA-N 260.381 2.066 10 10 CECE C[C@@]1(CO)CCCCN1c1ccc2c(c1)CC[C@H]2N 2128328314 MSVVCFRPHCRZHE-CVEARBPZSA-N 260.381 2.374 10 10 CECE CCN[C@@H]1CCCc2cc(N3CC[C@H](O)C3)ccc21 2128271418 CKFBPKQXPZCEHF-GOEBONIOSA-N 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295.368 2.084 10 10 CECE CO[C@H]1CCN(c2ccc([C@@H](C)N)cc2F)[C@@H]1C 1914266298 FNAZERVBNBREAY-RULNRJAQSA-N 252.333 2.459 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)c(Cl)c1 2138374126 REVTUUFKFZIALR-NFOTXUCKSA-N 280.799 2.437 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CCC[C@@H]2COC3)cc1O 1900729756 FAIPNUZFYMFFOZ-RTXFEEFZSA-N 262.353 2.170 10 10 CECE OCc1cc(F)c(N2[C@H]3CCC[C@@H]2COC3)c(F)c1 1900706359 BKNAVBKHHGWBGA-PHIMTYICSA-N 269.291 2.215 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)C23CCC3)cc1O 1914399550 WNHXTHAHUHDFJA-IAQYHMDHSA-N 276.380 2.166 10 10 CECE C[C@@H]1O[C@@]2(CNCc3ccc(O)c(O)c3)CC[C@H]1C2 1900996516 OFBUGROAGRTWTG-WBIUFABUSA-N 263.337 2.145 10 10 CECE COc1ccc(N(C)CC[C@H]2CC(C)(C)NC2=O)cc1 1966145147 UACMPJSOPDAEAC-LBPRGKRZSA-N 276.380 2.436 10 10 CECE COc1ccc(N2C[C@@H]3CC[C@H](N)C[C@H]3C2)cc1F 2141240402 BPPKJMRZUDXQIG-SRVKXCTJSA-N 264.344 2.398 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)[C@@H]1CCC=CO1 1920949023 HAAORPSOGHBVBK-XHSDSOJGSA-N 277.364 2.487 10 10 CECE CN(C)c1ccc(CN[C@H]2CC[C@H](CCN)C2)cc1 1968001051 JXFSFFFTFZXFPA-HIFRSBDPSA-N 261.413 2.360 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H](N)CC1(C)C 1925255652 BLMMMORBZOVHDF-MWLCHTKSSA-N 252.333 2.404 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)c1ccnnc1 229150314 PPUJAFXOQLYHOH-UHFFFAOYSA-N 270.336 2.110 10 10 CECE COc1cccc(O)c1CNC[C@]1(O)CC[C@H](C)C1 2136899879 NWBSLGUFGLZNQF-NHYWBVRUSA-N 265.353 2.042 10 10 CECE CCOc1cccc(CN[C@@H]2CCO[C@@H]2C2CC2)c1O 230315195 BNADWILIVRETDL-CZUORRHYSA-N 277.364 2.448 10 10 CECE OCCN(CC(F)F)c1ccc(CNC2CC2)cc1 231329329 VOTXOEBFWQAXIF-UHFFFAOYSA-N 270.323 2.002 10 10 CECE Cc1ccc(CN2CCC[C@@H]3C[C@]32C(=O)O)c(O)c1 2139770266 GMEGUFXLSMYIEH-IUODEOHRSA-N 261.321 2.140 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)CCOCC(F)F 232323305 MHVXAXISUASOIK-UHFFFAOYSA-N 286.322 2.289 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@@H](C(C)(C)N)C1 2139882333 TUATYLFNXNNLSL-GHMZBOCLSA-N 264.369 2.218 10 10 CECE COc1ccc(N2CC[C@H](C(C)(C)N)C2)cc1OC 2139887518 NBCKEKUGSUWVGX-NSHDSACASA-N 264.369 2.267 10 10 CECE C[C@@H](N[C@@H]1CCc2cccc(O)c21)c1cncn1C 1967492219 YITJDCALAGMSED-ZYHUDNBSSA-N 257.337 2.464 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](OC)[C@@H](OC)C2)cc1 233641121 ZXARNFVYQLHETL-KCXAZCMYSA-N 278.396 2.207 10 10 CECE CO[C@@H](c1noc(-c2ccc(O)c(O)c2)n1)C1CC1 234773675 VAFWKVIPNBKILK-LLVKDONJSA-N 262.265 2.245 10 10 CECE CNCc1ccc(N2C[C@]34CC[C@]3(COC4)C2)cc1C 2146566800 YYTSTUDIBNUJPI-CALCHBBNSA-N 272.392 2.331 10 10 CECE CC(C)(C)OC(=O)[C@H](N)C(C)(C)c1ccc(O)c(O)c1 1952542553 FUNRAZBTLZASOX-LBPRGKRZSA-N 281.352 2.044 10 10 CECE CC(C)[C@@H]1CCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 252851179 HXQPVETYGUMTNH-YGRLFVJLSA-N 259.353 2.121 10 10 CECE Oc1c(Cl)cccc1CN1CCOC[C@H]1CF 1971803142 BLEGMIZADDUPTR-SNVBAGLBSA-N 259.708 2.216 10 10 CECE Nc1ccc(CC(=O)N2CCC[C@@H]2COC(F)F)cc1 1972500663 KIJAHKLDOGCSFR-GFCCVEGCSA-N 284.306 2.042 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@H](O)CC(F)(F)F 2143500348 UUOMDLOTWWWCPP-JOYOIKCWSA-N 288.313 2.382 10 10 CECE CCCN(Cc1ccc(N)cc1)Cc1cn(CC)nn1 2143651132 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CN(C)c1ccc([C@H](NN)[C@@H]2CCSC2)cc1 1999536918 QKOFCVAZKLKVPG-YPMHNXCESA-N 251.399 2.010 10 10 CECE CCN(CCCO)c1ccc(CNC2CC2)c(C)c1 165263411 XNMQJWWUBDBDTP-UHFFFAOYSA-N 262.397 2.456 10 10 CECE CCN[C@H](C)c1ccc(N2CC(OCCO)C2)cc1Cl 2152288834 NILOBQDLJHXWSJ-LLVKDONJSA-N 298.814 2.208 10 10 CECE CC(C)(O)C1CN(c2ccc(CN)c(C(F)(F)F)c2)C1 2152264720 ATOGTHCDPQEUBL-UHFFFAOYSA-N 288.313 2.371 10 10 CECE Cc1ccnc(CNC(=O)Nc2ccc(N)cc2)c1F 2153372810 XUKVFIVBRJRQSA-UHFFFAOYSA-N 274.299 2.433 10 10 CECE COc1ccc(O)c(CNCC23CCCN2CCC3)c1 2154938412 FGKGCXDZIIVZBZ-UHFFFAOYSA-N 276.380 2.119 10 10 CECE CNCc1ccc(N(C)CC23CCCN2CCC3)cc1 2154961209 PCWVOWIYVWROFN-UHFFFAOYSA-N 273.424 2.471 10 10 CECE CO[C@]1([C@@H](N)c2ccccc2O)CCCSC1 2018465214 NZIRRNTZPDVZCV-QWHCGFSZSA-N 253.367 2.304 10 10 CECE Nc1ccc(CN(C(=O)[C@@H]2CCCCO2)C2CC2)cc1 50958707 XDMJJVXPZUCFGN-HNNXBMFYSA-N 274.364 2.329 10 10 CECE CN(c1ccc(CN)c(F)c1F)C1C[C@H]2COC[C@@H]2C1 2156136236 QVGSVFKYBXXEKL-QWRGUYRKSA-N 282.334 2.285 10 10 CECE N[C@]1(c2ccccc2O)CCO[C@@H](C(F)(F)F)C1 2029549613 NQPFXBAXMMCLAO-GHMZBOCLSA-N 261.243 2.288 10 10 CECE C[C@H]1CCN(Cc2ccc(Cl)cc2O)C[C@H]1CN 2029655284 DFWBYPFPAXYDCT-CMPLNLGQSA-N 268.788 2.462 10 10 CECE COc1nscc1CNCc1cccc(F)c1O 2031562818 QIVDYMOMQWGJOO-UHFFFAOYSA-N 268.313 2.286 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(Cl)c2)[C@H](C)C[C@H]1O 2032209624 ZGEMNIREERHLOO-GPCCPHFNSA-N 268.788 2.394 10 10 CECE C[C@@H](NCCc1nncs1)c1ccc(F)cc1O 2033510811 FCJCZGGVLMBJCE-MRVPVSSYSA-N 267.329 2.276 10 10 CECE CC[C@@H](CO)CN[C@@H](C)c1ccc(OC)cc1O 2036792912 GYQIKAGZZXJDHV-WDEREUQCSA-N 253.342 2.070 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@H](O)CC(F)(F)F)CC1 2038007456 OVGITDVUZZZAEN-DTWKUNHWSA-N 266.267 2.465 10 10 CECE C[C@H]1CC[C@@H](N(C)CCOc2ccc(N)cc2)CO1 401479869 MRTRSQSABVVCHI-GXTWGEPZSA-N 264.369 2.147 10 10 CECE CCNCc1ccc(N2CCC(C)(CO)CC2)cc1 402938533 LRPNXKFCLCGUEL-UHFFFAOYSA-N 262.397 2.395 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCN(C3CC3)C2)c(F)c1 2160037831 MVRQIKNJKJZTDJ-CQSZACIVSA-N 277.387 2.218 10 10 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CC(C)OC(C)(C)C(=O)NCCc1ccc(N)cc1 384150446 SYESYHJUMYSEMV-UHFFFAOYSA-N 264.369 2.131 10 10 CECE CC1(C)CO[C@@H](CCNC(=O)Cc2ccc(N)cc2)C1 717375061 KATXBKROTXQSNY-AWEZNQCLSA-N 276.380 2.133 10 10 CECE CCN1CCc2cc(N3CC[C@H](C4CNC4)C3)ccc21 2163062105 JQWIKJNBWFBEEB-AWEZNQCLSA-N 271.408 2.115 10 10 CECE C[C@@H]1CCCN(CCOc2ccc(N)cc2)[C@@H]1CCO 697220103 HTIKJDVKVCAKTR-CZUORRHYSA-N 278.396 2.131 10 10 CECE Cc1ccc(O)c(CNCC(C)(C)n2cccn2)c1 697620606 LVMACXQTSYFXIZ-UHFFFAOYSA-N 259.353 2.422 10 10 CECE CN1CCc2cc([C@H](N)[C@@]3(O)CCCSCC3)ccc21 2163140981 PKEHAOGMBZFDBW-JKSUJKDBSA-N 292.448 2.327 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](O)C(C)(C)C2)cc1O 388009929 QZTDCWFHQRORCG-IINYFYTJSA-N 264.369 2.009 10 10 CECE CC[C@@H](c1ccccc1O)N(C)CCOCCOC 388230718 BFUWSLUGEPEPKP-AWEZNQCLSA-N 267.369 2.438 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H](C(F)(F)F)C2)cc1O 698815116 UQMHGZFKNMPFDF-PRHODGIISA-N 290.285 2.179 10 10 CECE CCOC1CC2(C1)C[C@H]2NCc1ccc(O)c(O)c1 721234390 YLHOKJALTYJJON-XGTXGMFGSA-N 263.337 2.145 10 10 CECE C[C@H](N[C@H]1CN(C)C[C@@H]1C)c1ccc(N(C)C)cc1 722293503 ALNTWSSLYQWXGM-XEZPLFJOSA-N 261.413 2.353 10 10 CECE C[C@@H](OCCc1ccc(N)cc1)C(=O)NC1CCCC1 2176289789 HPIPAPHNVIORLM-GFCCVEGCSA-N 276.380 2.275 10 10 CECE C[C@]1(CO)CCCN1c1ccc(CN)c(Cl)c1 722978082 MIHBOFODDUMXCB-CYBMUJFWSA-N 254.761 2.150 10 10 CECE COCC(C)(C)c1noc(Cc2ccc(N)cc2)n1 395532511 VBAAENKMBAKGTN-UHFFFAOYSA-N 261.325 2.167 10 10 CECE Nc1ccc(CCN2CCO[C@H](c3nccs3)C2)cc1 2171858983 KOIIKKRGYGWOOF-AWEZNQCLSA-N 289.404 2.341 10 10 CECE NCCc1ccc2ccn(Cc3cnsn3)c2c1 399944285 PCMNPMYWWGVEJY-UHFFFAOYSA-N 258.350 2.042 10 10 CECE CCN(CC)C1CN(c2ccc(CNC3CC3)cc2)C1 829315588 VOHCONPZYXYLMN-UHFFFAOYSA-N 273.424 2.469 10 10 CECE C[C@@H](c1c(O)cccc1F)n1nccc1C(=O)N(C)C 2069901276 BBLYDZAKADUOGH-VIFPVBQESA-N 277.299 2.039 10 10 CECE CC(C)N(Cc1ccc(N)cc1)CC(C)(C)S(C)(=O)=O 2167890803 VOVWGUFPTIBXHA-UHFFFAOYSA-N 298.452 2.302 10 10 CECE CN(CCc1ccc(N)cc1)Cc1cnn2c1CCC2 2167809385 DYRLVVYXDKFVDI-UHFFFAOYSA-N 270.380 2.086 10 10 CECE C[C@@H](Cc1ccnn1C)NCc1ccc2c(c1)CCO2 2174324297 STYTVRXFEYFAMR-LBPRGKRZSA-N 271.364 2.076 10 10 CECE CO[C@H]1C[C@H](CNCc2cc(F)ccc2O)C[C@H]1OC 2174854854 NTKBFAIWVCRKIV-LYILDCAHSA-N 283.343 2.061 10 10 CECE CC1(C)CN(CCF)CCN1c1ccc(CN)c(F)c1 2175034285 NODRJNXYCCLXGX-UHFFFAOYSA-N 283.366 2.155 10 10 CECE C[C@H]1[C@H](C(=O)O)CCCN1CCCc1ccc(N)cc1 2179660014 NICAXFSGRDRCRV-SWLSCSKDSA-N 276.380 2.387 10 10 CECE Nc1ccc(OCC(=O)N[C@H](C(F)F)C2CCC2)cc1 2197912521 SFKLUZDPQFLLIM-ZDUSSCGKSA-N 284.306 2.198 10 10 CECE C[C@@H]1C[C@@H]2CN(c3ccc([C@@H](C)N)cc3F)CCN2C1 2181270818 ZHDNQQCLTLMWOP-YRGRVCCFSA-N 277.387 2.376 10 10 CECE CC(C)[C@H]1NCC[C@@]1(O)c1ccc(N2CCCC2)cc1 2188251463 GTSGZLZNXWYPHW-IAGOWNOFSA-N 274.408 2.492 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1c([N+](=O)[O-])cnn1C 2192600944 SKRVNMCBORRRDF-VIFPVBQESA-N 276.296 2.231 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)[C@](C)(COC)OC 2198218877 PTSIGSNZQOTBJW-HOTGVXAUSA-N 280.412 2.455 10 10 CECE C[C@H](N)c1ccc(N2CC(N3CCCC3=O)C2)c(Cl)c1 2182224841 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[N-]=[N+]=NCC1(CNC(=O)[C@H]2C[C@]23CC3(F)F)CC1 2054034756 ZLLBFBKXKGTWME-XCBNKYQSSA-N 256.256 2.238 10 10 CECE COc1ccc(CN2CC[C@H]3CCC[C@]32CN)c(O)c1 2197338969 HJVGELARROLLHI-CJNGLKHVSA-N 276.380 2.104 10 10 CECE CCNCc1ccc(N2CC[C@@H]2[C@H](C)O)cc1Cl 2061819570 YXBWVILDTJHCNZ-IINYFYTJSA-N 268.788 2.409 10 10 CECE CN1CCCc2cc([C@H](N)[C@]34CCOC[C@@H]3C4)ccc21 2194437851 UNGIWTSVSIMEHC-XIRDDKMYSA-N 272.392 2.495 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H]3COC[C@@H]3C2)c(F)c1 2194520679 VHQSPIROLMAEAZ-NHCYSSNCSA-N 283.318 2.491 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](CO)[C@H](C)C2)c(F)c1 2194517465 YHJCFDOAPRCPGS-OUAUKWLOSA-N 285.334 2.473 10 10 CECE C[C@H]1C[C@H]1CN(C)c1ccc(CO)c([N+](=O)[O-])c1 2068312554 WHJSZNIBNIQSRY-ONGXEEELSA-N 250.298 2.179 10 10 CECE C[C@H](N)c1cc(F)c(N(C)CCn2ccnc2)c(F)c1 2194687040 DJQJHYLQQCLAIH-JTQLQIEISA-N 280.322 2.317 10 10 CECE CNCc1ccc(N2CC[C@H]2C(C)(C)O)c(Cl)c1 2071154727 YQSOTWIJLIFUFO-ZDUSSCGKSA-N 268.788 2.409 10 10 CECE CCCN1[C@@H](C)CN(Cc2cc(N)ccc2O)C[C@H]1C 2186958623 FNMRUFWXLSMPHU-BETUJISGSA-N 277.412 2.279 10 10 CECE C[C@H]1OC2(CNCc3cc(F)ccc3O)CC1C2 2072863477 VHKSPKHXSIXCNG-FDMSEYEVSA-N 251.301 2.188 10 10 CECE CN(c1ccc(OCC(F)F)cc1)[C@H]1CCNC1 2073886072 NVHFFFSOUUHVKL-NSHDSACASA-N 256.296 2.129 10 10 CECE CC(C)N(CCO)c1c(F)cc([C@@H](C)O)cc1F 2074076285 LLKADFFGCPXGAH-SECBINFHSA-N 259.296 2.225 10 10 CECE C[C@H](O)[C@@H](NCc1cccc(Cl)c1O)C(F)(F)F 2074733031 PSSDRVVLPLENDI-QUBYGPBYSA-N 283.677 2.447 10 10 CECE CC[C@H]1CC[C@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])O1 2081614783 OJWRUEZMCYMVAR-OUAUKWLOSA-N 252.318 2.245 10 10 CECE C[C@H]1C[C@@H](CCNC(=O)Nc2ccc(N)cc2)CO1 2103183557 OEGHXODKWQCFLD-WDEREUQCSA-N 263.341 2.205 10 10 CECE CCC[C@@H](CNCc1ccc(F)cc1O)N(C)C 2084177663 URUPFFVMTGVXQW-ZDUSSCGKSA-N 254.349 2.351 10 10 CECE CCCN(Cc1c(O)cccc1OC)[C@H]1CCOC1 2104434426 UHRXUQSAURXDJC-LBPRGKRZSA-N 265.353 2.402 10 10 CECE COc1cccc(O)c1CNC1([C@@H]2CCCO2)CC1 2104449919 ZIHCUSBBFMAVHF-AWEZNQCLSA-N 263.337 2.202 10 10 CECE COc1cccc(O)c1CNCC[C@@H]1OCC[C@H]1C 2104434105 QHBOLGQVAKIAHZ-RISCZKNCSA-N 265.353 2.306 10 10 CECE COc1cccc(O)c1CNC[C@@H](C)[C@H]1CCCO1 2104442202 IMIGKXPTRWBOIP-BXUZGUMPSA-N 265.353 2.306 10 10 CECE Cc1cccc(O)c1CN(CCC(=O)O)CC1CC1 2104506633 AQBJTZLSMFZKON-UHFFFAOYSA-N 263.337 2.387 10 10 CECE CCN1CCc2cc([C@@](C)(O)[C@H]3CCCO3)ccc21 2106797486 BCPYNLNLMHVQLK-HZPDHXFCSA-N 261.365 2.456 10 10 CECE CCN1CCc2cc([C@H](N)CN3CCCC3)ccc21 2106794363 WGCLDAGTTVZMKY-OAHLLOKOSA-N 259.397 2.165 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)C2CCSCC2)cc1 2106854215 AEJLKRIOGYHFHF-GJZGRUSLSA-N 280.437 2.257 10 10 CECE CCN(CC)c1ccc([C@H](NC)C(OC)OC)cc1 2106833703 MSUUSASLMBXRIJ-AWEZNQCLSA-N 266.385 2.412 10 10 CECE Oc1cccc2c1[C@H](NCCc1ncccn1)CC2 2106930361 XHCCCHMAGVALDG-GFCCVEGCSA-N 255.321 2.002 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCCC3(CNC3)C2)c1 2088024893 JTZUMWWDABZGKJ-CYBMUJFWSA-N 260.381 2.447 10 10 CECE C[C@@]12C[C@@H](CO1)N(c1ccc(C=CC(=O)O)cc1)C2 2088304022 NMRUIGZEJBRVHO-ZFWWWQNUSA-N 259.305 2.152 10 10 CECE Nc1ccc(CC(=O)NC[C@@H]2C[C@@H]3CCC[C@@H]32)cc1 2089201626 VTWMYFPGXOZTND-YDHLFZDLSA-N 258.365 2.364 10 10 CECE C[C@@]1(OCCNCc2cccc(Cl)c2O)CCOC1 2090067908 ZVZIHTHLDCUNJW-CQSZACIVSA-N 285.771 2.331 10 10 CECE CN(C)c1ccc([C@H](O)[C@H](N)[C@H]2[C@H]3CCC[C@H]32)cc1 2111858039 QQAXMCQZXREPKC-JKJDWNRSSA-N 260.381 2.159 10 10 CECE CCOCCCOCCC(=O)Nc1ccc(N)cc1 2092638259 JINZAGFNRFCSGV-UHFFFAOYSA-N 266.341 2.041 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H](O)C3(CC3)C2)c(F)c1 2093174505 PAEHUQJUYXZXSW-YGRLFVJLSA-N 264.344 2.197 10 10 CECE C[C@H](N[C@H](C(=O)O)C1(C)CC1)c1ccc(F)cc1O 2093632304 BJFJSNKURLMDSY-QPUJVOFHSA-N 267.300 2.435 10 10 CECE C[C@H](N)c1ccc(N2CC(C)(C)C[C@@H]2CO)c(F)c1 2094752668 SCMVDWWQUYHCPO-CMPLNLGQSA-N 266.360 2.443 10 10 CECE CC[C@H]1CCN(Cc2cc(C)ccc2O)[C@H]1C(=O)O 2095162864 PLDXCRVUZOMBHR-SMDDNHRTSA-N 263.337 2.386 10 10 CECE Cc1nc(C(C)(C)NCc2c(O)cccc2Cl)n[nH]1 2095739295 WAFRAYDZTGLCRV-UHFFFAOYSA-N 280.759 2.497 10 10 CECE CCN(Cc1nncn1C(C)C)c1ccc(N)cc1 2097368625 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COC[C@]12C[C@](CNCc3ccc(Cl)cc3O)(CO1)C2 2206065727 PFXMWQPPNXJVSO-GASCZTMLSA-N 297.782 2.331 10 10 CECE COc1ncc(CN2CC[C@H](CN=[N+]=[N-])C2)s1 2217096318 FHORWPDUPKKCIK-MRVPVSSYSA-N 253.331 2.284 10 10 CECE COCC1CC(O[C@@H](C)C(=O)Nc2ccc(N)cc2)C1 2207490397 VQYFFMVUDNKGIO-IFQILLTASA-N 278.352 2.037 10 10 CECE Cc1cccc(O)c1CN1C[C@@H]2CC[C@]2(CC(=O)O)C1 2207521759 KOUFXMWIZWZZLA-LRDDRELGSA-N 275.348 2.387 10 10 CECE CC[C@@H](O)CN(C)c1ccc2c(c1)OC(F)(F)O2 2219506942 CYBLCHFSUIRTNX-SECBINFHSA-N 259.252 2.215 10 10 CECE COc1ccc(N2CCC([C@H](C)O)CC2)cc1F 2219619576 NXWYXOJBTVIKKH-JTQLQIEISA-N 253.317 2.432 10 10 CECE CNCc1ccc(N(C[C@H](C)O)C2CCC2)c(F)c1 2272440009 VNYWYHAMUJVMOD-NSHDSACASA-N 266.360 2.285 10 10 CECE Cc1ccc(O)c(CN[C@@H](C(F)F)[C@@H]2CCOC2)c1 2231044661 MAOMNNIQYMUQLS-ZWNOBZJWSA-N 271.307 2.460 10 10 CECE CN[C@H](C)c1ccc(N2CC([C@H](F)CO)C2)c(C)c1 2232032026 XGIXJOPDBJTHPF-BXUZGUMPSA-N 266.360 2.042 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC(N2CCCC2)C1 2232105225 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2.296 10 10 CECE C[C@@H]1CCC[C@@H](OC(=O)[C@H](N)Cc2ccc(O)c(O)c2)C1 40953849 UINULACLFWVEAD-RAIGVLPGSA-N 293.363 2.090 10 10 CECE N[C@H]1CCCN(c2ccc(OC[C@@H]3CCCO3)cc2F)C1 87439536 XLZGNKDJDHTKGB-JSGCOSHPSA-N 294.370 2.311 10 10 CECE C[C@@H](NCC[S@](C)=O)c1cc(Cl)ccc1O 134921776 IBSKEBDAGNUFCB-VPTHRUTESA-N 261.774 2.075 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H](C)N(C)C[C@H]2C)c1 89726412 LOVDDFABLJQNQP-TYNCELHUSA-N 278.396 2.219 10 10 CECE CC[C@@H]1OCC[C@H]1CNCc1cccc(F)c1O 233922305 KRBDAYLYTISDQZ-GWCFXTLKSA-N 253.317 2.436 10 10 CECE CNCCN(C)C(=O)c1cc(C)n(-c2ccccc2)c1C 237345241 LMEUOHVMUOMJJJ-UHFFFAOYSA-N 285.391 2.386 10 10 CECE CCOc1cncc([C@H](NN)c2ccc(N(C)C)cc2)c1 97775186 YTZIYQQHVHHGDF-MRXNPFEDSA-N 286.379 2.099 10 10 CECE COc1ccc(CNC(C)C)cc1Cn1ccnc1 50125486 PEWCJSAHXHMVAJ-UHFFFAOYSA-N 259.353 2.438 10 10 CECE CC1(C)CSC[C@](NCCCN=[N+]=[N-])(C(=O)O)C1 94490192 PLMUTPNLXAHXSO-NSHDSACASA-N 272.374 2.263 10 10 CECE Cc1c(/C=C\C(=O)N2CCc3ccccc32)cnn1C 255669736 DIZFNLLQWUFOJX-FPLPWBNLSA-N 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10 10 CECE O=C(NC[C@@H]1COc2ccccc2O1)c1cc(O)cs1 731867213 ZMVFHHWBCZTRPL-SNVBAGLBSA-N 291.328 2.024 10 10 CECE CCC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 588407662 YLCWGWQWXZBAOU-SCXUMTSISA-N 291.347 2.139 10 10 CECE CN1CCC[C@@H](CN(c2ccc(CN)cc2)C2CC2)C1 691313331 LZCBKYLRIBVJEQ-OAHLLOKOSA-N 273.424 2.456 10 10 CECE CCC[C@H](C)[C@@H](CO)NCc1cc(OC)c(OC)cc1O 846018574 USKWQGZHMXBBCX-WCQYABFASA-N 297.395 2.296 10 10 CECE Cc1ccc([C@H](N)CNC(=O)OC(C)(C)C)c(O)c1 687731571 LZWWSFYECIGZKH-LLVKDONJSA-N 266.341 2.225 10 10 CECE CN(C)c1ccc(CN2CCNC[C@@H]2c2cccnc2)cc1 843118060 VVVXAOUOXMIIDF-GOSISDBHSA-N 296.418 2.294 10 10 CECE Nc1ccc(CCN[C@@H]2CCNC23CCCC3)cc1 925695755 WQTJVCOFMMCGGE-OAHLLOKOSA-N 259.397 2.076 10 10 CECE CCc1cccc(CNC[C@H](CC)N(C)C)c1O 691450269 HBPRMGLGGBWUOS-AWEZNQCLSA-N 250.386 2.384 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)c3ccc[nH]3)C2)cc1 855228980 IJJKHSYDMOBXLV-GFCCVEGCSA-N 285.347 2.032 10 10 CECE O=C(NCc1cc(Cl)ccc1O)c1nnc(C2CC2)o1 866016470 NCZKLKSCTVYAHD-UHFFFAOYSA-N 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2.120 10 10 CECE CCc1ocnc1CNCc1c(O)cccc1F 2042601272 GPILUHJMDFVTHD-UHFFFAOYSA-N 250.273 2.372 10 10 CECE N[C@@H]1CCc2cc(N3[C@H]4CC[C@H]3[C@@H](F)[C@@H](O)C4)ccc21 2190686822 YBUHKVXZDHRULT-YPUPRDRTSA-N 276.355 2.073 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@@H](CO)C23CC3)c(F)c1 2194517429 XYNGAVVRTOUBKV-KOLCDFICSA-N 283.318 2.369 10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2CCC[C@H]2F)cc1 2055210883 SBBWGNUONORMDW-MJBXVCDLSA-N 251.349 2.395 10 10 CECE CN(CC1(C)COC1)c1cc(Cl)c(CN)cc1F 2057254728 PGTRUZDLTRMYLR-UHFFFAOYSA-N 272.751 2.411 10 10 CECE CCCOc1ccc(N(CCN)C2CCOCC2)cc1 2186649585 JZBQAEXTEGJYQJ-UHFFFAOYSA-N 278.396 2.420 10 10 CECE COc1ccc(CN[C@H]2CCOC[C@@H]2F)cc1C 2066719510 KICRZVYXWZGMIV-STQMWFEESA-N 253.317 2.220 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1CCCn2ccnc21 2195442796 DGXFRIWRYGPOEK-NSHDSACASA-N 272.308 2.111 10 10 CECE C[C@@H](CN(C)C(=O)Cc1ccc(N)cc1)OC(C)(C)C 2192206905 SIAASOQCSWYBJN-LBPRGKRZSA-N 278.396 2.473 10 10 CECE NCc1ccc(N2C[C@H]3COC[C@@H](C3)C2)c(Cl)c1 2068761065 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CCc1nc(CNC(=O)c2c(F)ccc(O)c2O)cs1 789972456 FPLXJZKABFTTSG-UHFFFAOYSA-N 296.323 2.186 10 10 CECE N[C@@H](c1nccc(C(F)(F)F)n1)c1ccccc1O 1877285283 QHYLTJJEXLIKGS-SNVBAGLBSA-N 269.226 2.249 10 10 CECE COc1cc(O)c(CN[C@H](C)C(F)F)cc1OC 895729319 GCLCLKWRGUNOKQ-SSDOTTSWSA-N 261.268 2.153 10 10 CECE C[C@@H](c1ccccc1O)n1cncc1[C@H]1CCNC1 1877589965 ZBYLUADTHGTDGD-RYUDHWBXSA-N 257.337 2.275 10 10 CECE C[C@H](NC(=O)[C@@]1(C)CCC[C@H]1N)c1ccccc1O 1877595335 IGSZEAWXNLGZQO-ZBINZKHDSA-N 262.353 2.087 10 10 CECE COc1noc(C)c1CN(C)Cc1ccccc1O 1877543570 SLXHOGQCBIFLCQ-UHFFFAOYSA-N 262.309 2.329 10 10 CECE CN(C)c1ccc(CNC[C@]23CCOC[C@H]2C3)cc1 1880194710 GXBCQXACTCURFE-GDBMZVCRSA-N 260.381 2.269 10 10 CECE Oc1c(Br)cccc1CNC[C@@H]1CC[C@H]1O 1897961792 ZIZBSZINYMOSNH-GZMMTYOYSA-N 286.169 2.015 10 10 CECE C[C@H]1COCCN(c2c(F)cc([C@@H](C)O)cc2F)C1 1880479672 PDLLUCRDULWSHG-NXEZZACHSA-N 271.307 2.491 10 10 CECE CO/C=C1\SC(=S)N(Cc2ccco2)C1=O 1088730212 IDLSFNOZJJJMFN-VURMDHGXSA-N 255.320 2.128 10 10 CECE COc1cccc(O)c1CNCc1cncs1 1963442156 PFZOQTZQCFLWQA-UHFFFAOYSA-N 250.323 2.147 10 10 CECE Cc1ncsc1[C@H]1NCCc2c1ccc(O)c2O 75793893 LUAZBHNGXWWZFX-NSHDSACASA-N 262.334 2.098 10 10 CECE NCCc1csc(/C=C/c2ccc(O)c(O)c2)n1 83456228 PLOGWHGQMNMQNI-DUXPYHPUSA-N 262.334 2.226 10 10 CECE COc1ccc(N2CC[C@H](CNC[C@@H](C)O)C2)cc1Cl 76355927 DKDCQKXDMBOESY-VXGBXAGGSA-N 298.814 2.145 10 10 CECE COc1cc(OC)c2c(c1)[C@H](N)CCN2C(C)C 84101558 NLQXRIAMCVPZFM-GFCCVEGCSA-N 250.342 2.322 10 10 CECE COC[C@@H]1CN(c2ccc([C@H](C)O)cc2Cl)CCO1 705830481 RKFUNKIMOGDDTA-JQWIXIFHSA-N 285.771 2.245 10 10 CECE CC(=O)C(=O)COC(=O)C1(C(F)(F)F)CCCCC1 1327994986 DPRVGQNSYHMMFD-UHFFFAOYSA-N 280.242 2.201 10 10 CECE C[C@@H]1C[C@@H](C)N(Cc2ccc(N)cc2)C[C@@H]1C(=O)O 1891640373 ZSEFOJYPICIZSH-GYSYKLTISA-N 262.353 2.200 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H](C)[C@H]2CO)cc1O 708472397 KASRTVOYSGXIAN-COPLHBTASA-N 265.353 2.043 10 10 CECE CNCc1ccc(N(C)CC2CCN(C)CC2)c(F)c1 63121255 WPEFYPLZYIRDIC-UHFFFAOYSA-N 279.403 2.323 10 10 CECE COc1ccc(N2CCN(C[C@H]3C[C@H]3C)CC2)cc1 754099997 FNJORMYIRKMSEB-ZIAGYGMSSA-N 260.381 2.473 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)C[C@H]2CCSC2)cc1 718240923 XGUGMXWMWBWEBP-CJNGLKHVSA-N 293.480 2.437 10 10 CECE C[C@H](O)[C@@H]1CCCN(c2c(F)cc(CN)cc2F)C1 688914506 DYOQPONRIPKBRB-GXSJLCMTSA-N 270.323 2.021 10 10 CECE CCc1cnc(CNCc2ccc(F)c(F)c2O)[nH]1 719118794 URFSIBFSOXUNDQ-UHFFFAOYSA-N 267.279 2.246 10 10 CECE CC[C@@H](O)c1ccc(N2CCSC[C@H]2CCO)cc1 689197511 MHIYSKUYDZSTCP-HUUCEWRRSA-N 281.421 2.434 10 10 CECE CN(C[C@@]1(C)CC1(F)F)C(=O)c1cccc(O)c1O 689191074 PPKDNPQMSXXNOZ-GFCCVEGCSA-N 271.263 2.215 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1[S@@](=O)c1ccccc1 692826820 IUYJFHPJMORVGB-BTDLBPIBSA-N 250.327 2.484 10 10 CECE CN1Cc2ccc(N3CCCN4CCC[C@@H]4C3)cc2C1 689409145 BTAFROWFGGTAGF-QGZVFWFLSA-N 271.408 2.307 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])c1ccc(Cl)cn1 695209374 ICBNJHRPAPVOKB-NSHDSACASA-N 283.719 2.023 10 10 CECE Oc1cccc(F)c1CNc1cc(-n2ccnc2)ncn1 1187676826 GDSMEXFJNXOUMU-UHFFFAOYSA-N 285.282 2.119 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(N)=O)c1ccc(F)c(Cl)c1 90260229 YIVFGBPHFPNTCY-GFCCVEGCSA-N 299.737 2.470 10 10 CECE CC[C@@H](C(=O)NCCN=[N+]=[N-])N(C)C(=O)OC(C)(C)C 1963818777 YDTIXIRMKHKOOS-VIFPVBQESA-N 285.348 2.058 10 10 CECE Cc1ncccc1/C=C/C(=O)N1CCOc2ccncc21 1435371898 IMNLDKQIHDAWGD-SNAWJCMRSA-N 281.315 2.224 10 10 CECE C[C@@H](Cc1ccnn1C)NCc1c(O)cccc1Cl 2117692984 AXPMOKCVUCKRAQ-JTQLQIEISA-N 279.771 2.500 10 10 CECE COc1ccc(O)c(CN(C)CCCCN(C)C)c1 2121373518 GYJWMLRTGDXLEO-UHFFFAOYSA-N 266.385 2.174 10 10 CECE CC(C)c1nnc(C(=O)NCc2c(O)cccc2O)s1 1558535375 JARKSNHPZDATSL-UHFFFAOYSA-N 293.348 2.003 10 10 CECE COCC1(CNC(=O)Cc2ccc(N)cc2)CCCC1 1964359308 KXPDXVALZPWEDN-UHFFFAOYSA-N 276.380 2.134 10 10 CECE N[C@@H]1CCCN(c2ccc(OC[C@H]3CCOC3)cc2)C1 249975663 CJUKSTUDOJJABH-UONOGXRCSA-N 276.380 2.029 10 10 CECE Cc1ccc(CN(C)CCCCC(=O)O)c(O)c1 1964726879 PWDBHEYCQFKPJR-UHFFFAOYSA-N 251.326 2.387 10 10 CECE C[C@H](NC1CC(n2cnnc2)C1)c1ccccc1O 2127674631 LEQLXXZEEVBPFP-UNXYVOJBSA-N 258.325 2.038 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC1(O)CCOCC1 162606989 AXLMTMCMQVASCA-OLZOCXBDSA-N 291.391 2.380 10 10 CECE CCCN(Cc1ccccc1O)C(=O)c1ccnnc1 155159747 DYHXWBZOWBPEPD-UHFFFAOYSA-N 271.320 2.235 10 10 CECE CCOC(=O)[C@@H](CC)N1C[C@@H](C)Oc2cc(CN)ccc21 251273704 MZSDACGLDBEJIX-DGCLKSJQSA-N 292.379 2.074 10 10 CECE COc1cc(C)c(N(C)C[C@@H](C)CN)c(OC)c1 258778102 OVBIMHYONLYNKA-JTQLQIEISA-N 252.358 2.043 10 10 CECE CN(c1ccc2c(c1)OCCCO2)C(C)(C)CO 258773093 HZZRZGQCRWGGIL-UHFFFAOYSA-N 251.326 2.055 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@H]4COCC[C@@H]43)ccc21 2128317103 BJUOZPBPVRLLCO-UHOFOFEASA-N 259.349 2.281 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2O)C1(CO)CCCC1 2128315866 XHIBRSRYWBCLGF-OAHLLOKOSA-N 261.365 2.408 10 10 CECE COc1ccc([C@H](C)N[C@H]2CCOC[C@H]2F)c(O)c1 2130261077 RVPOXWSRKSFIKZ-BIMULSAOSA-N 269.316 2.178 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H]3C[C@H]2C[C@@H]3O)c1O 933957860 QAJVTXUINOLDBP-LQJRIPTKSA-N 295.766 2.203 10 10 CECE CNCCCCCC(=O)NCc1cccc(C)c1O 2139758998 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[N-]=[N+]=NCC1CCN(C(=O)c2ccc(O)cc2O)CC1 1912150951 ARIOZDYMYLGEHJ-UHFFFAOYSA-N 276.296 2.260 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2ccccc2C(N)=O)C1 1912200654 KDDSPTBGRFDJBT-LLVKDONJSA-N 259.313 2.060 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])c1cccs1 1912207004 MCPOHALBAVBPNU-LLVKDONJSA-N 268.342 2.426 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCOC12CCCCC2 1912211562 YCIXKWCMCLEJLV-CYBMUJFWSA-N 282.344 2.223 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1C[C@@H](CN)C(C)(C)C1 1913120501 WIUUYIXCEYUXBT-WDEREUQCSA-N 264.369 2.076 10 10 CECE COc1ccc(N2C[C@@H](CN)C(C)(C)C2)c([N+](=O)[O-])c1 1913159773 KFZOTPIRJMYQDH-SNVBAGLBSA-N 279.340 2.025 10 10 CECE CCCNCc1ccc(N2CC[C@](F)(CO)C2)c(C)c1 1917094775 CRHCGLZMRSYKFR-MRXNPFEDSA-N 280.387 2.405 10 10 CECE CC[C@@H](NC)c1ccc(N2CC[C@@](F)(CO)C2)cc1 1917071140 HCYWNCUGXFPFRS-CABCVRRESA-N 266.360 2.268 10 10 CECE Nc1ccc(OCCN2CCO[C@@H]3CCCC[C@H]32)cc1 227143892 WENBDPPAUXPULZ-HZPDHXFCSA-N 276.380 2.291 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@H]1NCc1ccccc1O 227548320 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NC(=O)CCN(Cc1ccccc1)c1ccc(CO)cc1 1931977595 LKVILFBVMSLCBC-UHFFFAOYSA-N 284.359 2.061 10 10 CECE CCN(CCCc1ccc(N)cc1)[C@H](C)CN(C)C 232254443 IKQRYIPNARUUPO-CQSZACIVSA-N 263.429 2.473 10 10 CECE CCCN[C@@H]1C(=O)Nc2cc(N(C)CCSC)ccc21 124097828 QTHGJNJASDTRDC-AWEZNQCLSA-N 293.436 2.479 10 10 CECE CC(C)[C@H](C)[S@@](=O)CCC(=O)Nc1ccc(N)cc1 232810601 LVYKWPSQQVOVIT-WLRWDXFRSA-N 282.409 2.391 10 10 CECE CCCNCc1ccc(N2CC[C@@](C)(O)C2)c(C)c1 233111833 SDLAWTNIHUSIRD-MRXNPFEDSA-N 262.397 2.456 10 10 CECE COc1ccc(O)c(CN2C[C@@H](OC)C(C)(C)C2)c1 1967790536 JNRSJGPETZSOIK-CQSZACIVSA-N 265.353 2.258 10 10 CECE Cn1ncc2c1C[C@H](NCc1cc(Cl)ccc1O)CC2 1967776889 UUTCFHGIWURNLR-CYBMUJFWSA-N 291.782 2.426 10 10 CECE CC[C@H](C)NCc1nc(-c2ccc(O)c(O)c2)no1 233993332 OXSJCXHINGRQGD-QMMMGPOBSA-N 263.297 2.036 10 10 CECE CN(Cc1cccnc1)c1ccc(CN)c(F)c1F 234319001 HZBSHJMFTJGZQS-UHFFFAOYSA-N 263.291 2.455 10 10 CECE CNC(=O)CN(C)c1ccc(CNC(C)C)c(Cl)c1 234364212 VYTCOFCYHGDVNA-UHFFFAOYSA-N 283.803 2.020 10 10 CECE 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COC(=O)CN(C)Cc1c(O)ccc2ccccc12 171801721 DOMOCPAIMGLQOK-UHFFFAOYSA-N 259.305 2.150 10 10 CECE Oc1c(C[C@@H]2CCNC2)cc(Br)c(F)c1O 219219175 YYFKLTRUXHGFEB-LURJTMIESA-N 290.132 2.151 10 10 CECE COc1ccc(N(C)C[C@](CO)(NC2CC2)C2CC2)cc1 70338568 YKAXNOACSIZXLK-QGZVFWFLSA-N 290.407 2.025 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCCOCC2)cc1 86875541 KMLGZDMJGCNMQE-HNNXBMFYSA-N 264.369 2.029 10 10 CECE CCN(CC)C(=O)[C@@H](C)OC(=O)CCc1ccc(N)cc1 41101814 CHISVSKVFKAZDS-GFCCVEGCSA-N 292.379 2.002 10 10 CECE Cc1nc(C(=O)NCc2ccc(N(C)C)cc2)cs1 49354174 UBYNDRKWKJQRKS-UHFFFAOYSA-N 275.377 2.448 10 10 CECE CCNC(=O)CN(CC)c1ccc(/C=C\C(=O)O)c(C)c1 220146909 IXIDNEGEMGMXMD-CLFYSBASSA-N 290.363 2.055 10 10 CECE COc1ccc(N2CCC(=O)C2)cc1Br 83869324 JCQHNNBQJWQKQY-UHFFFAOYSA-N 270.126 2.237 10 10 CECE CCC[C@@H](C)OC[C@H](O)COc1ccc(N)cc1 230432026 RBDBMURIWQHTKS-YPMHNXCESA-N 253.342 2.214 10 10 CECE CCN[C@H](C)c1ccc(N(C)CCOC)cc1O 93670794 PHBPCOXXNQVJFA-LLVKDONJSA-N 252.358 2.145 10 10 CECE 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C[C@@H]1CCNC[C@H]1NC/C=C\c1ccc(N(C)C)cc1 841060003 ZWKMTBGBUHCRDR-AYUWKEHRSA-N 273.424 2.353 10 10 CECE CCc1cccc(CNC[C@H]2CN(C3CC3)C(=O)O2)c1O 848929832 JTTQAMUFZIHZKI-AWEZNQCLSA-N 290.363 2.027 10 10 CECE COc1cccc(CNC(=O)N[C@H](C)C(C)(C)OC)c1O 925507264 VKGUXBKQWUSBLL-SNVBAGLBSA-N 296.367 2.014 10 10 CECE Cc1ccc(O)c(CNC(=O)NC[C@]2(C)CCCCO2)c1 927202231 SJTKGFQKTGQCEC-INIZCTEOSA-N 292.379 2.459 10 10 CECE Cc1cc(O)c(CN[C@H]2C[C@@H](C)n3ncnc32)cc1C 850352530 ZSOJBHISONZIGT-YPMHNXCESA-N 272.352 2.396 10 10 CECE Nc1ccc(CCn2cnc(C(F)(F)F)cc2=O)cc1 697550485 OMVQCPMFWAHVOD-UHFFFAOYSA-N 283.253 2.087 10 10 CECE C[C@@]12COC[C@H]1CN(Cc1c(O)ccc3ccncc13)C2 853566078 LGQRRMNXTSTPQM-CXAGYDPISA-N 284.359 2.409 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)C3(C)CC3)C2)cc1 855234297 WURKPSIKZQFUKI-GFCCVEGCSA-N 274.364 2.190 10 10 CECE CC[C@@H]1NCC[C@H]1NCc1cccc(Cl)c1O 863481245 DFHWLAUQAUUJII-NWDGAFQWSA-N 254.761 2.276 10 10 CECE C[C@@H]1C[C@@H]1c1noc(C(=O)N(C)Cc2ccccc2O)n1 865903452 BWZFGVOYXCQCOR-KOLCDFICSA-N 287.319 2.171 10 10 CECE Cc1cccc2c1C[C@@H](NC(=O)c1cc(O)cs1)CO2 862532053 OIAPVRKNFHBDHR-SNVBAGLBSA-N 289.356 2.496 10 10 CECE Cc1ccc(C(=O)N2CCC[C@@](C)(F)C2)c(O)c1O 1117818274 KLNFCZFOHIKPIQ-CQSZACIVSA-N 267.300 2.370 10 10 CECE COc1ccccc1NC[C@H](O)C[C@@](C)(O)C1CC1 872210205 QIANPIGRPXYZCF-IUODEOHRSA-N 265.353 2.019 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CCN(C2CC2)CC1 775649449 RMCNMPBKTQMUEI-UHFFFAOYSA-N 284.762 2.465 10 10 CECE CO[C@H]1C[C@H](NCc2ccc(N(C)C)cc2)C[C@H]1OC 1875522076 LRPMSKMFZIYFRX-MKZZRHPPSA-N 278.396 2.035 10 10 CECE C[C@@H](N[C@H]1C[C@](C)(CO)C1)c1ccc(F)cc1O 1876194967 GCSRUISRCMFKPQ-GLXFQSAKSA-N 253.317 2.343 10 10 CECE Cc1cc(N2C[C@H]3C(C(F)F)[C@@H]3C2)ccc1CCN 1877025260 XPSYFJTXSPKHLS-CHWSQXEVSA-N 266.335 2.444 10 10 CECE CCOC(=O)[C@@H]1C[C@@H]1CN[C@H](C)c1ccccc1O 1877570633 RQTHRHFARYZPMO-NQBHXWOUSA-N 263.337 2.242 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cccnc1CN 1877533576 UTPILRMYZAOCHB-NSHDSACASA-N 257.337 2.443 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2ccccc2O)cn1 1877517657 LLMUPDUNWUDLRE-NSHDSACASA-N 258.321 2.477 10 10 CECE COC1(C[S@](=O)CCCCN=[N+]=[N-])CCOCC1 2254382378 VZMVKJVHVQDHBN-GOSISDBHSA-N 275.374 2.021 10 10 CECE Oc1c(Cl)cc(Cl)cc1CN1C[C@@H]2C[C@@]2(O)C1 895651246 YXEQTCPBYFRETN-QPUJVOFHSA-N 274.147 2.266 10 10 CECE C[C@@H]1CC[C@@](CO)(NCc2cc(F)cc(F)c2O)C1 1880896108 DGFVECOWNQHHFK-YMTOWFKASA-N 271.307 2.311 10 10 CECE CCN(C[C@](C)(COC)OC)c1ccc(CN)cc1 1895876967 XGCSVEGSWOPKBY-OAHLLOKOSA-N 266.385 2.023 10 10 CECE CNC(=O)[C@H]1CCCCN1[C@H](C)c1cc(C)ccc1O 133052486 NMUCGUXDOXWARZ-TZMCWYRMSA-N 276.380 2.362 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC=CC[C@@H]2CO)c(F)c1 1880478867 IVXUNUGLZCSLRD-MWLCHTKSSA-N 269.291 2.145 10 10 CECE Nc1ccc(N2[C@H]3CC[C@H]2CN(C(=O)C(F)(F)F)C3)cc1 1959566829 MPZPIHLLLBIRRL-RYUDHWBXSA-N 299.296 2.011 10 10 CECE C[C@H](C(=O)NCc1cc(O)ccc1O)c1ccco1 1153885891 RHSFZQNNYUSCLX-VIFPVBQESA-N 261.277 2.111 10 10 CECE Nc1ccc(OCCN2Cc3ccc(C(=O)O)cc3C2)cc1 58012012 QKBOTWUQZMODTO-UHFFFAOYSA-N 298.342 2.362 10 10 CECE CN1CCC([C@@H](N)c2ccc(N(C)C)c(F)c2)CC1 75903876 QGFGYARTBHFCRW-OAHLLOKOSA-N 265.376 2.233 10 10 CECE Cc1ccc(O)c(NCc2ccc(O)c(O)c2O)c1 83444043 KVBZXUYVWZJYNB-UHFFFAOYSA-N 261.277 2.430 10 10 CECE Oc1cc(F)c2c(c1)[C@H](c1ccc(O)c(O)c1)NCC2 83627556 OZNPAPHQQDBRBL-HNNXBMFYSA-N 275.279 2.178 10 10 CECE CC(C)C[C@H](CO)CNCc1cccc(F)c1O 1962904494 TUDGDOCAIDESBM-NSHDSACASA-N 255.333 2.276 10 10 CECE COc1ccnc(NCc2cccc(Cl)c2O)n1 1164342969 WCGDZOUSDGHFOG-UHFFFAOYSA-N 265.700 2.456 10 10 CECE C[C@@H](C[C@@](C)(NC1CC1)C(N)=O)Sc1nccs1 84351675 DIWJZMRNZRFGTM-QPUJVOFHSA-N 285.438 2.010 10 10 CECE CCN(CCN(C)C)Cc1cc(F)cc(C(C)=O)c1O 688990054 VIZIMSMZPIHXDC-UHFFFAOYSA-N 282.359 2.117 10 10 CECE C[C@@H](NC(=O)CNCc1ccccc1)c1ccccc1O 1889482715 GVDFPBBTJZICCG-CYBMUJFWSA-N 284.359 2.359 10 10 CECE CNCc1ccc(N2CC[C@H](C(C)(C)O)C2)c(F)c1 721815332 DKAJERZJHAIWNC-LBPRGKRZSA-N 266.360 2.142 10 10 CECE C[C@@H](O)C(C)(C)NCc1c(O)cccc1Br 706875245 ROCLDPUIRMJJLR-MRVPVSSYSA-N 288.185 2.404 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CCCCC[C@@H]43)ccc21 708259881 FZDARPUMZWKUGP-LKTVYLICSA-N 271.364 2.407 10 10 CECE CCCNCc1ccc(N(C)CC2CN(C)C2)c(C)c1 692238881 GYGIXDIMRVPCRG-UHFFFAOYSA-N 275.440 2.492 10 10 CECE COC(=O)[C@@H](CCCC1CC1)NCCCN=[N+]=[N-] 720107004 BYFBVLXLMPROFC-LLVKDONJSA-N 254.334 2.398 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H]3[C@H]2CCCN3C)cc1 720463026 CEJGFFOHUGBWHK-VBNZEHGJSA-N 260.381 2.413 10 10 CECE CNCc1ccc(N2CC[C@H](N(C)C)[C@@H](C)C2)c(C)c1 693658450 DZIOULUWTNFVGK-HOCLYGCPSA-N 275.440 2.491 10 10 CECE CCn1cc(CN(C)c2ccc(CN)cc2F)cn1 693717921 MYVBMQADNDBPTR-UHFFFAOYSA-N 262.332 2.137 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CC=CCC2)cc1 88746453 JQMXOJRYTHWFGO-CYBMUJFWSA-N 260.337 2.263 10 10 CECE C/C(=C/C(=O)N(C)c1ccc2c(c1)OCO2)c1cnccn1 1519564567 SHOJTQYTBJKIQL-XFFZJAGNSA-N 297.314 2.272 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC2(CCO2)C1 2115164658 ZOUKDCLDCZMPCV-UHFFFAOYSA-N 258.365 2.226 10 10 CECE O=C(NCc1cc(O)ccc1O)c1cncc(Cl)c1 1455355256 RLRFYPWPASEAML-UHFFFAOYSA-N 278.695 2.076 10 10 CECE CN(Cc1ccc(Cl)nn1)c1ccc2c(c1)OCO2 1459774382 MWIHEJRPYSDOHJ-UHFFFAOYSA-N 277.711 2.495 10 10 CECE COc1ccncc1NC(=O)c1cc(O)cs1 1292308077 DQRHCGXHJTXGTP-UHFFFAOYSA-N 250.279 2.110 10 10 CECE Cn1cnc(/C=C/C(=O)N2CCc3cc(F)ccc32)c1 1539889575 ZMOPBQXEMGQWDR-HWKANZROSA-N 271.295 2.162 10 10 CECE Cc1ccccc1N(C)C(=O)/C=C/c1cnn(C)c1 1533687639 DSIQGGPTNKHHJA-CMDGGOBGSA-N 255.321 2.405 10 10 CECE NCc1ccc(N2C[C@H](O)C3(CCCC3)C2)cc1F 2117749492 PKWQYCJYJFHXAB-AWEZNQCLSA-N 264.344 2.026 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)cc1 2118012398 HCACYEIUVQNTOD-VCOSZWKGSA-N 260.381 2.296 10 10 CECE CCN(CC)c1ccc(CN[C@@H]2[C@H]3COC[C@H]32)cc1 2118021575 VENJITTTXJLYPT-ZSHCYNCHSA-N 260.381 2.267 10 10 CECE CC(C)[C@H](C(=O)O)N(C)[C@H](C)c1cc(O)ccc1O 2118366429 GIRKQRROVGEBAI-NOZJJQNGSA-N 267.325 2.200 10 10 CECE CC(C)Oc1cc(CNC2CC2)ccc1N1CCNCC1 212160563 GDQGWCFIVHYCIZ-UHFFFAOYSA-N 289.423 2.135 10 10 CECE CC(C)Oc1cc(CN(C)CCC(=O)O)ccc1N(C)C 212153074 PDMPLIJVEHQXJD-UHFFFAOYSA-N 294.395 2.446 10 10 CECE Oc1c(F)cccc1CNCc1cnn(C(F)F)c1 2120838885 HBBCKTGYSROUHF-UHFFFAOYSA-N 271.242 2.413 10 10 CECE CN1CCCc2cc(CNC(=O)CCCCCO)ccc21 1631322916 SLXNKAJSHKGTES-UHFFFAOYSA-N 290.407 2.238 10 10 CECE C[C@@]12CC[C@@](C(=O)NCC3(CN=[N+]=[N-])CC3)(CO1)C2 2121864714 NTQYJIZJIIMQPY-AAEUAGOBSA-N 264.329 2.152 10 10 CECE O=C(NCc1c(O)ccc2c1CCCC2)c1n[nH]cc1F 1635964676 WDUJHZBWOARUNI-UHFFFAOYSA-N 289.310 2.063 10 10 CECE C[C@@H](NN1CCOCC1)c1ccc2ccccc2c1O 214617628 HGEQJUUAXJRKLA-GFCCVEGCSA-N 272.348 2.443 10 10 CECE CN(C)c1cccc(C(=O)NCc2c(O)cccc2O)c1 1645360920 OZSNXMGABAIJRR-UHFFFAOYSA-N 286.331 2.094 10 10 CECE c1cc2c(cc1N1CCNCC3(CC3)C1)CCCO2 2123446524 UGJICSFFCFISIF-UHFFFAOYSA-N 258.365 2.201 10 10 CECE C[C@H](N[C@H](C)c1nccn1C)c1ccc(O)cc1O 2125221943 DRUPMOMDVSVIRP-VHSXEESVSA-N 261.325 2.243 10 10 CECE CC(C)(C(=O)NCc1ccccc1O)[C@@H]1CCCO1 1964889674 NFCOJJGGGYAJHX-ZDUSSCGKSA-N 263.337 2.214 10 10 CECE COCCNCc1ccc(N(C)[C@@H]2CCO[C@@H]2C)c(C)c1 160093051 TVLGMDNPEMPESY-RHSMWYFYSA-N 292.423 2.345 10 10 CECE CCN1C[C@H](C(C)C)NC[C@H]1c1ccc(OC)cc1O 250267431 KQOASXSAWIBTMK-CABCVRRESA-N 278.396 2.392 10 10 CECE CC[C@@H]1CN([C@H](C)C(C)=O)c2cc3c(cc2N1)OCCO3 251714637 JRQVIYZTQDXBST-ZYHUDNBSSA-N 290.363 2.446 10 10 CECE Nc1ccc(NC(=O)C2=NO[C@H](c3ccc(O)cc3)C2)cc1 586038725 XZIABPJUKULGQQ-HNNXBMFYSA-N 297.314 2.431 10 10 CECE CC1(C)[C@H](O)CCCN1c1c(F)cc(CO)cc1F 1887630245 WWWBGILGVAJRLG-GFCCVEGCSA-N 271.307 2.197 10 10 CECE CCN[C@H]1CCCc2cc(N3CC(C)(O)C3)ccc21 2128273675 MIIKNLVNXOPDOE-HNNXBMFYSA-N 260.381 2.245 10 10 CECE O[C@@H]1CCc2cc(N3C[C@H]4C[C@H]3CC[C@H]4O)ccc21 2128320362 BTQIVNGACWSSNS-UIBBOPPKSA-N 259.349 2.016 10 10 CECE CO[C@@H]1CC[C@@H]1C[C@@H](N)c1ccc2c(c1)CCN2C 2130363630 VVKUXJGWXCDFML-IIAWOOMASA-N 260.381 2.494 10 10 CECE Nc1ccc(CNC[C@@H]2CCCc3nccn32)cc1 2129517952 AOZSZTQCWBZLDL-AWEZNQCLSA-N 256.353 2.133 10 10 CECE CN(C(=O)Cc1ccc(N)cc1)c1ccccc1N 1218883177 KPMZHTOYNVJUKO-UHFFFAOYSA-N 255.321 2.057 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2C[C@@H]1C[C@H]1OC 2131636235 XGHANWXBALHEJW-DIOULYMOSA-N 260.381 2.364 10 10 CECE Cc1nc2c[nH]c(=NCc3ccc(N)cc3)nc2s1 2132645983 NCZXRJQEADDXQP-UHFFFAOYSA-N 271.349 2.011 10 10 CECE CC[C@@H](c1ccccc1O)N(C)C[C@@H](C)C(=O)NC 218596633 PPZAVGAEIMCALK-YPMHNXCESA-N 264.369 2.157 10 10 CECE CN1CC[C@H]2[C@H](CCN2Cc2ccc(F)cc2O)C1 2139790069 JDRZQZCKFVSWEK-RISCZKNCSA-N 264.344 2.057 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@H]1C(F)(F)C12CC2 1912198870 LQEURCXKCOKUHM-JGVFFNPUSA-N 256.256 2.333 10 10 CECE C[C@@H](NC(=O)CN(C)CCN=[N+]=[N-])c1cccs1 1912163355 IRMDDNVCDJUWQQ-SECBINFHSA-N 267.358 2.167 10 10 CECE Cc1cn2c(CC(=O)N3CC[C@H](N=[N+]=[N-])C3)csc2n1 1912208074 QUJACEQSRAVWIS-VIFPVBQESA-N 290.352 2.158 10 10 CECE Cc1cc(C(=O)N(C)CCN=[N+]=[N-])cc([N+](=O)[O-])c1 1912209789 CINAEDZFPOVJRT-UHFFFAOYSA-N 263.257 2.286 10 10 CECE Oc1c(CN[C@@H]2C3C[C@@H]4C2[C@@H]4C3)ccc(F)c1F 1916958693 USDNLSFGBNHLNR-LAYARTQFSA-N 251.276 2.414 10 10 CECE C[C@H](N)c1ccc(N2CCN3CCCC[C@H]3C2)cc1 250908807 TYDOJIMCGSADLC-BBRMVZONSA-N 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Oc1ccc(CNC[C@H]2CC[C@@H](C(F)(F)F)O2)c(O)c1 722398170 KAHBUHBTXFIDNW-PWSUYJOCSA-N 291.269 2.297 10 10 CECE CN1CC[C@H](N(C)Cc2cc(Cl)ccc2O)CC1=O 2131933122 AHNKLIITEHSOED-LBPRGKRZSA-N 282.771 2.098 10 10 CECE CC(C)NC(=O)CN(C)c1ccc([C@H](C)N)c(Cl)c1 723160155 REUGSLSCPTUPES-JTQLQIEISA-N 283.803 2.321 10 10 CECE C[C@H]1CCN(Cc2cc3c(cc2O)CCC3)CCO1 905737895 JDMMLYCSYCDHLA-LBPRGKRZSA-N 261.365 2.492 10 10 CECE CN(C)c1ccc(/C=C\CN2CCO[C@@H]3C[C@@H]32)cc1 835052637 IDBSNVDHTBXPSN-MYIWKSEUSA-N 258.365 2.239 10 10 CECE C[C@H](N[C@@H]1CCN(C)[C@@H]1C)c1cc(F)cc(F)c1O 903301537 RGXXCPKLGSMFBO-IGJMFERPSA-N 270.323 2.414 10 10 CECE O=C(NCc1ccc(O)c(O)c1)C1(C2CC2)CCC1 907061748 WVQRLXQVCXKWFB-UHFFFAOYSA-N 261.321 2.294 10 10 CECE C[C@H](Cc1ccco1)C(=O)NCc1ccc(O)c(O)c1 830559679 RVEZOUKDAXNFSA-SNVBAGLBSA-N 275.304 2.186 10 10 CECE COC[C@H](CN(C)c1ccc([C@H](C)O)cc1Cl)OC 691378705 KARGIIOTDSYFCW-JQWIXIFHSA-N 287.787 2.491 10 10 CECE COCc1csc(NC(=O)NCc2ccccc2O)n1 743223595 ZJSFYNWMFNJNJD-UHFFFAOYSA-N 293.348 2.317 10 10 CECE C[C@H](NC[C@@H]1CN(C2CC2)C(=O)O1)c1ccc(F)cc1O 848569129 CDTHTLSARJDQON-JOYOIKCWSA-N 294.326 2.165 10 10 CECE CC(=O)C(=O)CSc1cc(C(F)(F)F)ccn1 849976184 DBHGEYVJHSMVRH-UHFFFAOYSA-N 263.240 2.351 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)C)C2)cc1 855232185 PDXIWHMCOYMIIQ-GFCCVEGCSA-N 276.380 2.436 10 10 CECE C[C@@H](Cc1ccco1)C(=O)NCCc1ccc(N)cc1 851631431 BKEQVNBJXGGYSF-LBPRGKRZSA-N 272.348 2.399 10 10 CECE OCc1ccc(N2CCCC[C@H](CO)C2)c(Cl)c1 696748960 NCFOVCQKMDAKSF-LBPRGKRZSA-N 269.772 2.431 10 10 CECE C[C@H](NC[C@@H]1COCCN1C)c1cc(Cl)ccc1O 858522534 FTRKZNCWEDNIHR-CMPLNLGQSA-N 284.787 2.027 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H]1C[C@H]1c1ccc(C)c(C)c1 850271643 CRLWOTIVKDSRRF-UONOGXRCSA-N 274.316 2.108 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC1(F)F 935945697 HIJASTLDPMLRBK-MRVPVSSYSA-N 276.279 2.149 10 10 CECE CCN(C[C@@H](C)O)c1ccc(CN)cc1Br 691435616 RFGRVBJGABAYBW-SECBINFHSA-N 287.201 2.115 10 10 CECE Cc1cc(O)c(CN[C@@H](C)[C@@H](O)C(F)(F)F)cc1C 865710706 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Nc1ccc(CN2C(=O)[C@H]3CCCCC[C@@H]3C2=O)cc1 1916148552 XVZXHCHLXQBTNL-KBPBESRZSA-N 272.348 2.334 10 10 CECE Cc1cc(N2CCN(C)[C@H](C)C2)ccc1CNC1CC1 110730156 JMMQTXAABZEDSM-CQSZACIVSA-N 273.424 2.387 10 10 CECE CCCOc1cc(N2CCC[C@H](O)C2)ccc1[N+](=O)[O-] 111052808 PISMXZFCOQQWFZ-LBPRGKRZSA-N 280.324 2.345 10 10 CECE COc1ccc([C@@H](NCCO)c2ccccc2)c(O)c1 20597001 CETKAZXCYIHNCC-INIZCTEOSA-N 273.332 2.072 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC[C@@]2(CCN2)C1 1922988784 MGTXKORBJPSMPE-HZMBPMFUSA-N 250.317 2.030 10 10 CECE CCCN[C@@H](c1ccccc1O)c1nnn(CC)c1C 1923665043 QLHLFFOOOXWCII-HNNXBMFYSA-N 274.368 2.401 10 10 CECE Oc1cccc(Cl)c1CNCC1(O)CCSCC1 119401448 SNHKTMHXSOBDLT-UHFFFAOYSA-N 287.812 2.393 10 10 CECE COc1ccc(N(C)C[C@@H](N)C[C@H]2CCCO2)cc1 1926604233 PWKFIDWFLPBYBO-SWLSCSKDSA-N 264.369 2.028 10 10 CECE COc1ccc(N2C[C@@H](N)CC23CCC3)c(F)c1F 2136985684 UISZAFYWFOKNNN-VIFPVBQESA-N 268.307 2.434 10 10 CECE C[C@@H](NCc1csc(=O)[nH]1)c1ccc(N(C)C)cc1 231699203 HXFKDCGEDXMJEY-SNVBAGLBSA-N 277.393 2.353 10 10 CECE CCCN(CC)C1CN(c2ccc(CO)cc2C)C1 2141159412 FRHDTUQSGWHQEP-UHFFFAOYSA-N 262.397 2.408 10 10 CECE COc1cc(N(C)C[C@@H]2C[C@H](C)CO2)ccc1CN 2139690762 ZVLGNUMKNZXMPA-FZMZJTMJSA-N 264.369 2.015 10 10 CECE C[C@H](NCc1ccc(N(C)C)cc1)[C@H]1CC[C@@H](N)C1 2137352144 OBDHVJDUPYEIEF-AEGPPILISA-N 261.413 2.358 10 10 CECE CCCOCC(=O)N(CCC)Cc1ccc(N)cc1 233222071 IMYPJVUWIKCXDA-UHFFFAOYSA-N 264.369 2.434 10 10 CECE N[C@H]1CCN(Cc2ccc(F)cc2O)CC12CCC2 2139769110 MJYNUPXHRKPDCM-AWEZNQCLSA-N 264.344 2.235 10 10 CECE CNCc1ccc(N2CC[C@H](N(C)C)C2)cc1Cl 234376256 QCUNFVGSKNLMLT-ZDUSSCGKSA-N 267.804 2.200 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1[C@H]2CCOC[C@H]21 1968788517 FIJGPDBOCXJZHC-CQROYNQRSA-N 275.348 2.194 10 10 CECE C[C@H](N[C@H](C)[C@H]1CCCS(=O)(=O)C1)c1ccccc1O 2146109469 DBSCNHQXPAZCKJ-AGIUHOORSA-N 297.420 2.256 10 10 CECE CS[C@H](C)[C@@H](N)[C@@H](O)c1ccc(N2CCCC2)cc1 2142096869 JVHZPBJJCPNSAA-DFBGVHRSSA-N 280.437 2.399 10 10 CECE C[C@@H]1CC[C@@H](CNCc2cccc(O)c2O)S1 1946328500 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Nc1ccc(Cn2c(CO)nc3ccccc32)cc1 76079290 RBDUSRQFXZKACS-UHFFFAOYSA-N 253.305 2.159 10 10 CECE NC(=O)c1ccc(COc2ccc(N)cc2)c(F)c1 19519579 COPTUBKBYZLMGO-UHFFFAOYSA-N 260.268 2.086 10 10 CECE O=C(c1cccc(O)c1O)N1CCC[C@H](C(F)F)C1 1963554551 QRADLQANIONYDH-QMMMGPOBSA-N 271.263 2.215 10 10 CECE C[C@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1885562394 FYOOXKJGMPRUCK-TVQRCGJNSA-N 297.359 2.058 10 10 CECE Cc1cccc(O)c1CN1CCC(C)(C(=O)O)CC1 1963064689 ZNLGHLWTDAPSPP-UHFFFAOYSA-N 263.337 2.387 10 10 CECE C[C@H](NC(=O)Cn1ncc2cccnc21)c1ccccc1O 1171731029 WNGBWHUZVLELPE-NSHDSACASA-N 296.330 2.014 10 10 CECE CC(C)O[C@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 701727120 BFXOFVQDWJLCQQ-LBPRGKRZSA-N 279.336 2.120 10 10 CECE C[C@H](N1CCOc2cc(N(C)C)ccc21)C(C)(C)O 1888969400 TWQJPLFFMCATPY-NSHDSACASA-N 264.369 2.111 10 10 CECE O=C(COC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(O)c(O)c1 1327137441 OLIQKKJUTQXHKO-JLLWLGSASA-N 290.315 2.260 10 10 CECE C[C@H]1COC[C@@H](C)N1[C@@H](C)c1c(O)cccc1O 708387398 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10 10 CECE Cc1cc(CN)ccc1N1[C@H]2CC[C@@H]1C[C@@H](CO)C2 2128254596 KRDVORZNZDZXQU-QKDCVEJESA-N 260.381 2.193 10 10 CECE C[C@H](O)[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128270378 FDYLITNZRYPPOS-GHJWDPDVSA-N 260.381 2.230 10 10 CECE N[C@@H]1CCCc2cc(N3CC4(C=CCO4)C3)ccc21 2128273186 VBPNGYUWOVJSKP-OAHLLOKOSA-N 256.349 2.168 10 10 CECE CN[C@H]1CCc2cc(N(C)C(C)(C)CCO)ccc21 2128297611 MHXWZIOYLVAHAW-HNNXBMFYSA-N 262.397 2.491 10 10 CECE CC(C)[C@@H]1[C@H](O)CCN1c1ccc2c(c1)CC[C@H]2N 2128314131 BOTFAKVQMDBTSV-BZUAXINKSA-N 260.381 2.228 10 10 CECE O[C@H]1CCc2cc(N3CC[C@H]4CCO[C@@H]4C3)ccc21 2128304664 UPTROJKPZUHYMR-KNXALSJPSA-N 259.349 2.281 10 10 CECE CCN1[C@@H](C)CN(c2ccc(CN)cc2F)C[C@@H]1C 2130405710 UPTBLBASGPANFF-RYUDHWBXSA-N 265.376 2.203 10 10 CECE Nc1ccc(CC(=O)N2CC[C@H]3CCC[C@H]3C2)cc1 2128439775 UBCZECQWYZQNDV-KGLIPLIRSA-N 258.365 2.460 10 10 CECE C[C@@H](NC1CC(CCO)C1)c1cc(F)ccc1O 903328544 CFJQIQFPLPXIFC-GRZMOONWSA-N 253.317 2.343 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2CC23CC(F)(F)C3)cc1 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2.156 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2C[C@H](N)CC(C)(C)O2)cc1 2194420850 HCIOVXKVOMXTDX-CFVMTHIKSA-N 278.396 2.071 10 10 CECE CN(c1ccc2c(c1)CCC[C@@H]2N)[C@H]1COCC1(F)F 2197011323 DMCJCBFILIJVAD-KBPBESRZSA-N 282.334 2.493 10 10 CECE Cc1cc(N(C)[C@@H]2COCC2(F)F)ccc1C[C@H](C)N 2197017145 OXDADSBRZSJAQP-SMDDNHRTSA-N 284.350 2.355 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1CCOC[C@H]1F)CC2 2066719344 JACVJXSUXHBWJT-IJLUTSLNSA-N 251.301 2.096 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3C[C@H]2CC[C@@H]3O)c(F)c1 2194533409 YMGAHUZJDMCARX-AGSIJNCFSA-N 283.318 2.368 10 10 CECE CNCc1cc(F)c(N(C)C[C@H]2C[C@H]2F)c(F)c1 2068047012 ALTNNBBJEMBJPO-NXEZZACHSA-N 258.287 2.478 10 10 CECE N[C@H]1CCCc2cc(N3CC[C@@H](C4(O)CC4)C3)ccc21 2187050025 WTXBDBXJBNPDAQ-CJNGLKHVSA-N 272.392 2.374 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@@H](C4(O)CC4)C3)ccc21 2187045583 XNOGHTREAVSVKI-CZUORRHYSA-N 273.376 2.408 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC(C)(C)OC[C@@H]2CN)c1 2194663041 ZURCEZZMIKFILV-STQMWFEESA-N 278.396 2.200 10 10 CECE 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O=C(NC[C@@H]1CCC12CCC2)c1ccc(O)c(O)c1 2110490975 QCXHOZMGPSOQDJ-NSHDSACASA-N 261.321 2.408 10 10 CECE COC1(C(=O)N(C)[C@H](C)c2ccccc2O)CCC1 2111537399 SUMWFRKYZURQSG-LLVKDONJSA-N 263.337 2.481 10 10 CECE CC1(C)CC=CCN1c1ccc2c(c1)NC(=O)[C@@H]2N 2093632908 IPEXTHMEKFKLOW-CYBMUJFWSA-N 257.337 2.183 10 10 CECE CC[C@H]1CCOC[C@@H]1OC(=O)Cc1ccc(N)cc1 2096199564 MTJYQEATFUYEHK-JSGCOSHPSA-N 263.337 2.170 10 10 CECE COc1ccc(N2[C@H]3CCC[C@@H](O)[C@H]2CC3)c(N)c1 2097812254 PMKZMLSJLUUAGP-COLVAYQJSA-N 262.353 2.160 10 10 CECE CCN(CC)C(=O)[C@H](C)N1CCC[C@@H](N=[N+]=[N-])CC1 2099336662 MUBIQTKEHJVZGU-NWDGAFQWSA-N 267.377 2.408 10 10 CECE CC[C@@H](O)[C@H]1CCCCN1Cc1cc(N)ccc1O 2114161138 KTODOYXVWACJSD-ZIAGYGMSSA-N 264.369 2.100 10 10 CECE Cc1cc(N2CCC23CCN(C)CC3)ccc1CN 2114135143 VXOAWAFPXXHYEG-UHFFFAOYSA-N 259.397 2.128 10 10 CECE CC(C)[C@H]1CN(C)CCN1CCc1ccc(N)cc1 2114166276 XYNCZOIQACINKI-MRXNPFEDSA-N 261.413 2.083 10 10 CECE CN1CCC[C@H]1[C@@H]1CCCN1c1ccc(CN)cc1 2114911305 LBFRZFQOAGUPDS-HOTGVXAUSA-N 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10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)N(C)C1CCC1 2231247145 UWENGTQSFGJTQN-UHFFFAOYSA-N 284.381 2.150 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@]23CCC[C@@H]2CC3)cc1 2273490319 RCTGWATYSDEMIX-TZMCWYRMSA-N 280.393 2.021 10 10 CECE CN(C)c1ccc(OC[C@@H](N)c2cncs2)cc1 2221876783 VTXUQXWTNKJBJA-GFCCVEGCSA-N 263.366 2.288 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]2CN(C)C)c(C)c1 2232022306 LCWGVFJHWSPCNB-HIFRSBDPSA-N 261.413 2.416 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H](C)[C@@H](N(C)C)C1 2232101887 DFWNPQJACRKJGJ-IOASZLSFSA-N 261.413 2.401 10 10 CECE OCc1cc(F)c(N2CC[C@H]3C[C@@]3(F)C2)c(F)c1 2222658796 VCYUFZBINSHCEG-TVQRCGJNSA-N 257.255 2.395 10 10 CECE CCN(CCCOc1ccc(N)cc1)[C@@H]1CCC[C@@H]1O 2232612244 YGBREGPCBQYNFG-CVEARBPZSA-N 278.396 2.273 10 10 CECE Cc1cnc(Cl)nc1NC(=O)Cc1ccc(O)c(O)c1 2233416424 DEEXEPMABPLTJB-UHFFFAOYSA-N 293.710 2.031 10 10 CECE CCN(c1ccc2c(c1)CC[C@@H]2N)[C@@H]1CCC[C@H]1O 2224419697 ISRXYZOIDQGPDK-ARFHVFGLSA-N 260.381 2.372 10 10 CECE C[C@@H](Nc1cccn(C)c1=O)c1cc(F)ccc1O 2224793315 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277.364 2.402 10 10 CECE CCOc1cccc(CNC[C@H]2CCC[C@@H]2O)c1O 89165414 PRIGZKZYBQTJLS-YPMHNXCESA-N 265.353 2.042 10 10 CECE CCC[C@](NCCCN=[N+]=[N-])(C(N)=O)c1ccccc1 90260493 BAEQYEKCEXBFGR-CQSZACIVSA-N 275.356 2.457 10 10 CECE CNCc1ccc(N(C)CC2(N(C)C)CCC2)cc1 97929607 BPQMKGWYWUEQDU-UHFFFAOYSA-N 261.413 2.327 10 10 CECE Cc1cc(C(=O)NCc2ccc(O)cc2O)c2n[nH]cc2c1 1299573234 ISPQBXMFQHNDBC-UHFFFAOYSA-N 297.314 2.213 10 10 CECE CCN1N=C(C)/C(=C\c2ccc(OC)c(O)c2)C1=O 1865664110 AJYBZJAAYOEUJC-YRNVUSSQSA-N 260.293 2.022 10 10 CECE O=C1Nc2cc(N3CC=C(F)CC3)c(Cl)cc2[C@@H]1O 2116256983 OHXXGCYNSVLCIC-LBPRGKRZSA-N 282.702 2.389 10 10 CECE Cc1c(CNC[C@H]2C[C@H]2CO)n(C)c2ccccc12 2117655280 BATDRHUYEXAPSW-OLZOCXBDSA-N 258.365 2.205 10 10 CECE O=C(O)[C@H]1CC[C@](F)(CNCc2ccccc2O)C1 2117873732 FKNRJSHFEVDGBD-IINYFYTJSA-N 267.300 2.075 10 10 CECE CSc1ncc(CNC[C@@]2(N)CC[C@@H](C)C2)s1 2248741015 MUWMCOKCQAOINM-BXKDBHETSA-N 271.455 2.472 10 10 CECE NC(=O)N=Nc1ccc(C(=O)N2CCCn3nccc32)cc1 1626194777 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10 10 CECE C[C@@H]1CN(C)CC[C@H]1N(C)Cc1ccc(F)cc1O 1964576501 XDFAPCWMWDQQQT-BXUZGUMPSA-N 266.360 2.303 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@H]2C(C)C)cc1C 2126077004 MBIMHFYRIAACLQ-JKSUJKDBSA-N 262.397 2.310 10 10 CECE C[C@@H](O)[C@H]1CCN1c1ccc(CO)c(C(F)(F)F)c1 2125808654 MJUQPAYQZDFOOE-PRHODGIISA-N 275.270 2.157 10 10 CECE Cc1cc(CNC(C)(C)C)ccc1N1C[C@H](O)[C@@H]1C 2126121803 FNBZNCCNMHAEQM-WFASDCNBSA-N 262.397 2.453 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@H]1CC[C@@H]2[C@H]1C2(F)F 1964945505 YPYOIVQKAQWADM-HLTSFMKQSA-N 258.272 2.484 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](N)C(C)(C)C 158276058 AJKHQLQTFRAUNA-HNNXBMFYSA-N 291.439 2.475 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H](C)CN(C)C)c1 168599431 NYTHQVRSKGVLDB-MNOVXSKESA-N 252.358 2.002 10 10 CECE Oc1ccsc1CN1CCC[C@]2(CCCNC2)C1 104158464 OVPVXXDLFJASQM-AWEZNQCLSA-N 266.410 2.419 10 10 CECE Cc1ccc(O)c(CNCC(=O)N(C)Cc2ccccc2)c1 113324881 WYXBFNUXIGZQKN-UHFFFAOYSA-N 298.386 2.449 10 10 CECE CC[C@H]1CN(C)[C@@H](c2cc(Cl)ccc2O)CN1 251758814 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[N-]=[N+]=NCCCN[C@]1(C(=O)O)CCCCC1(F)F 1912196047 JCXPPBFJLIMEOE-VIFPVBQESA-N 262.260 2.309 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1noc2c1CCC2 1912171067 GCCRSYGIOAVPES-QMMMGPOBSA-N 261.285 2.078 10 10 CECE NCc1ccc2c(c1)CCN2CCCCCCCO 2134151025 ZCWQQGDKHLPSHE-UHFFFAOYSA-N 262.397 2.451 10 10 CECE CS(=O)(=O)[C@H]1CC[C@@H](SCCCN=[N+]=[N-])C1 1902442912 VRTVZIDCKJCBDM-BDAKNGLRSA-N 263.388 2.386 10 10 CECE Cc1ccc(CN2CCC(=O)C2)c(O)c1Br 1905118698 VEJFBHZIKUBRIV-UHFFFAOYSA-N 284.153 2.238 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1CCC(F)(F)CO1 1967825038 NHWATNMZTXLGHZ-NSHDSACASA-N 275.270 2.435 10 10 CECE CCN(CCSC)[C@H](CN)c1ccc(N(C)C)cc1 1917015221 UZZSUAVEZKDVRN-OAHLLOKOSA-N 281.469 2.437 10 10 CECE CCN1CC[C@@H](CNCc2ccc(Cl)cc2O)C1 1968789463 ILRIXGJRUQXRBG-NSHDSACASA-N 268.788 2.477 10 10 CECE CC1CCC(CN)(C(=O)NCc2ccccc2O)CC1 228422456 UIJPDXVPWLUUKJ-UHFFFAOYSA-N 276.380 2.164 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H](O)CC3(CC3)C2)cc1 1926413760 JZGMHZFHSIAXJS-SWLSCSKDSA-N 260.381 2.318 10 10 CECE 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2.483 10 10 CECE OC[C@H]1CCC[C@H]1NCc1ccc(Cl)cc1O 1560833075 CAURVKRGSJUFHT-ZYHUDNBSSA-N 255.745 2.296 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2COCC2(F)F)c1O 2131103030 GYJVELGYJFVYHZ-SNVBAGLBSA-N 293.697 2.178 10 10 CECE COCC(CCNCc1cccc(Cl)c1O)COC 2130997219 QWNSJTNJJLRKRW-UHFFFAOYSA-N 287.787 2.434 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCOC[C@@H]2F)c(F)c1 2130203326 WWVIOSFBLPKMCJ-GXTWGEPZSA-N 270.323 2.108 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@@H]3COC[C@H]3C2)cc1 1911996992 LETRIYAJEXVJSC-ZIAGYGMSSA-N 273.332 2.257 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2ccn3ncnc3c2)C1 1912153647 IFLZIWLGWOBILL-LLVKDONJSA-N 257.301 2.004 10 10 CECE Cc1cc(Cl)c(C(=O)N2CC(N=[N+]=[N-])C2)cn1 1912144918 YMBIXGTYOZVMMS-UHFFFAOYSA-N 251.677 2.178 10 10 CECE [N-]=[N+]=NC1CN(C[C@@H]2CC[C@@H](C(F)(F)F)O2)C1 1912169343 JKGOKHYFQSRRIR-YUMQZZPRSA-N 250.224 2.091 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)C2CC3(CSC3)C2)C1 1912152495 USJFHRZAHVWHLA-VIFPVBQESA-N 266.370 2.288 10 10 CECE COC(=O)C1(NCCN=[N+]=[N-])C[C@H]2CCC[C@@H](C2)C1 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278.371 2.156 10 10 CECE CN1CCCc2cc(N3CC[C@H]4[C@H](C3)[C@@H]4CO)ccc21 2235039237 TUNODYHKNOQAMP-HRCADAONSA-N 272.392 2.134 10 10 CECE COc1cc(C)c(N2CCOC[C@](C)(CO)C2)cc1C 2235110831 ZVRSQYZGAZVVEE-INIZCTEOSA-N 279.380 2.147 10 10 CECE OC[C@@]12CCC[C@H]1CN(c1ccc3c(c1)OCCO3)C2 2235100226 ZNAUUFCVPJASQI-LRDDRELGSA-N 275.348 2.057 10 10 CECE COc1ccc(N(C)[C@H]2CCO[C@H](C)C2)c(C(=O)O)c1 2235950646 SGJDKDDIZLHEJF-MNOVXSKESA-N 279.336 2.397 10 10 CECE COc1ccc(N(C)C[C@]23COC[C@H](C2)C3)c(CO)c1 2236365149 KKXYPCGKOXGWCW-DRQUAOQDSA-N 277.364 2.050 10 10 CECE Cc1cccc(O)c1CN1[C@H]2CCC[C@H]1CN(C)C2 2226366419 BHRXKMVBQOEGRM-KBPBESRZSA-N 260.381 2.369 10 10 CECE CN(C[C@H](O)C1CC1)c1ccc2c(c1)OC(F)(F)O2 2226696990 QSYUWHHBMXHICF-JTQLQIEISA-N 271.263 2.215 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCCN3C)C[C@@H]1O 2226662116 OHZAEMBFAXOWKH-WBMJQRKESA-N 260.381 2.276 10 10 CECE O[C@H]1C=CCN(c2ccc(OCC(F)(F)F)cc2)C1 2226738384 AKFJBFDFSNWVRX-NSHDSACASA-N 273.254 2.365 10 10 CECE CCCC1(O)CN(c2ccc3c(c2)OCCCO3)C1 2226809373 CLVGLPBLDFUSJA-UHFFFAOYSA-N 263.337 2.199 10 10 CECE COc1ccc(N2CC[C@](O)(C(C)C)C2)cc1OC 2226805371 JIKAQWGCECWBGG-OAHLLOKOSA-N 265.353 2.301 10 10 CECE C[C@H]1[C@H](O)C[C@@H](C)CN1c1ccc2c(c1)OCCO2 2227599461 LNMWJHLHKKMGHO-NTZNESFSSA-N 263.337 2.053 10 10 CECE COc1ccc(N(CC(C)(C)O)C(C)C)c(C=O)c1 2227696419 NUFFEYAPXLOWAV-UHFFFAOYSA-N 265.353 2.493 10 10 CECE COCCNCc1ccc(N2CC[C@@H]3C[C@@]3(F)C2)cc1 2239016559 NTISYKNCJGTNSU-GDBMZVCRSA-N 278.371 2.361 10 10 CECE Oc1cccc(CN[C@@]2(C3CC3)CCCOC2)c1O 2230030616 RFHCWYMNCQNGQK-HNNXBMFYSA-N 263.337 2.147 10 10 CECE CN(C)c1ccc([C@]2(O)CN[C@H]3CCCC[C@H]3C2)cc1 2279695954 NRBTWYDOBLXFIC-RRQGHBQHSA-N 274.408 2.492 10 10 CECE Cc1cc([C@H](C)O)ccc1N1Cc2cc(O)nnc2C1 2240837058 SAMNFHPMQIDXNV-JTQLQIEISA-N 271.320 2.064 10 10 CECE CSc1ncc(CNC[C@@H]2CC[C@@](F)(CN)C2)s1 2257134524 KRNRWEPCJJPOME-SKDRFNHKSA-N 289.445 2.422 10 10 CECE CN=c1cccc(NCc2cnc(SC)s2)[nH]1 2248744158 SAWBGWTWKCIABX-UHFFFAOYSA-N 266.395 2.336 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1ccc2c(c1)CCC[C@H]2N 2273209875 GDEDPLBVPNSJPO-PMPSAXMXSA-N 260.381 2.372 10 10 CECE C[C@@H](C1CNC1)N(C)c1ccc(OC(F)F)cc1 2263936007 WNLKSCWWDNLTLA-VIFPVBQESA-N 256.296 2.332 10 10 CECE CSc1ncc(CNc2ncnc3c2cnn3C)s1 2269195994 VBHQJKQLODKBCK-UHFFFAOYSA-N 292.393 2.154 10 10 CECE COc1ccc(N2CC[C@H](N)C[C@H]2C(F)(F)F)c(N)c1 2281162075 SJPAIGACFGJLAT-UFBFGSQYSA-N 289.301 2.136 10 10 CECE Cc1cc(N2CCO[C@H]3COCC[C@@H]32)ccc1[C@@H](C)O 2285159561 FQODSMSGBMJETF-KCXAZCMYSA-N 277.364 2.042 10 10 CECE CCN(Cc1cnnn1C)c1ccc([C@@H](C)N)c(C)c1 2285137648 XGWXQOIQSHAIQI-GFCCVEGCSA-N 273.384 2.170 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cnn(C2COC2)c1 2296454719 OSJXNGGYCKFAJR-LLVKDONJSA-N 273.336 2.357 10 10 CECE Cc1noc(C)c1CNC(=O)C=Cc1ccc(O)c(O)c1 2307986625 MVVHHTKDAUAMGQ-UHFFFAOYSA-N 288.303 2.032 10 10 CECE CS[C@H]1CC[C@H]1OC(=O)Cc1ccc(N)cc1 2307269491 SODRWAKRTHYECT-NEPJUHHUSA-N 251.351 2.249 10 10 CECE Cc1ccc(CN2C[C@H]3COC[C@H]32)c(O)c1Br 2307568029 ZIMGZWOJRDTPEC-WDEREUQCSA-N 298.180 2.294 10 10 CECE CN(C)c1ccc([C@@H](NN)[C@@H]2C[C@@H]2C(F)F)cc1 2308910523 CKAGTWWGSVSVDO-GRYCIOLGSA-N 255.312 2.158 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1[C@@H]2CCO[C@@H]21 2330682371 UVWYUAOPGXLZFC-FZKCQIBNSA-N 259.349 2.355 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2C[C@H]1C[C@H]2O)c1ccc(F)cc1O 2330916315 OSIBNDCURZIUEJ-HAOVPJPFSA-N 265.328 2.341 10 10 CECE Cc1cc(N2C[C@H]3CC[C@H]2C[C@H]3O)ccc1[C@@H](C)O 2337168824 BCSYZELGINKPHY-UNIGVISCSA-N 261.365 2.398 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@@H](CO)[C@@H](C)C2)c1C 2341065938 ZZDGDGRTHQDDHS-GDLCADMTSA-N 262.397 2.388 10 10 CECE CO[C@@H](CN1CCc2cc(O)c(O)cc2C1)C(C)C 2341217575 XNQSLSFDQWHAJH-HNNXBMFYSA-N 265.353 2.127 10 10 CECE Cc1nc(CCCN2CCC[C@@H](CN=[N+]=[N-])C2)n[nH]1 2351851497 KFNNDRFRMZTMCF-NSHDSACASA-N 263.349 2.068 10 10 CECE COC(=O)c1cc(NCc2cc(O)ccc2O)ccc1O 2560265 NOFICVMLKCZZHJ-UHFFFAOYSA-N 289.287 2.202 10 10 CECE C[C@H](N[C@@H]1CCCNC1=O)c1ccc2ccccc2c1O 50394343 DADBNXMWLUKFCY-XHDPSFHLSA-N 284.359 2.475 10 10 CECE CCCOCCOC(=O)CCc1ccc(N)cc1 111106506 QVTQVDLAORBEFS-UHFFFAOYSA-N 251.326 2.171 10 10 CECE CCCN(Cc1ccccc1O)C(=O)C[C@H](C)C(=O)OC 178269655 LQWAQKPPEMJRCO-LBPRGKRZSA-N 293.363 2.330 10 10 CECE CN1CCCc2cc(CNC(=O)C3=COCCC3)ccc21 171680097 UDIBXRIWYRXOOX-UHFFFAOYSA-N 286.375 2.380 10 10 CECE COc1ccc(O)c(CNC(=O)c2cccc(O)c2)c1 182836927 DCERXDBFWJAPHV-UHFFFAOYSA-N 273.288 2.036 10 10 CECE C[C@@H](O)C[C@@H]1CCCCCN1Cc1cc(N)ccc1O 312965745 ODEYWDQASCGGGG-DOMZBBRYSA-N 278.396 2.490 10 10 CECE Nc1cccc(Br)c1N[C@@H]1CC[C@H](O)C1 1894024842 WGAQEGYEXDXRTR-SFYZADRCSA-N 271.158 2.357 10 10 CECE CC(=O)c1cc(O)c2c(c1O)C(=O)c1ccccc1C2=O 73816742 ISMYHHALHAHTGI-UHFFFAOYSA-N 282.251 2.076 10 10 CECE Cc1cc(Br)cc(CNC[C@H](C)CO)c1O 132611201 GXPZBSFNZKOTIA-QMMMGPOBSA-N 288.185 2.181 10 10 CECE Cc1ccc(C(=O)Nc2ccc(O)cc2C(=O)O)o1 48847049 WRWDVAXRWFNTBK-UHFFFAOYSA-N 261.233 2.244 10 10 CECE CCOCCCOc1ccc(N2CCCNCC2)c(F)c1 87439336 ZBVMFRXOWWKKES-UHFFFAOYSA-N 296.386 2.431 10 10 CECE [N-]=[N+]=NCCCN1CCC(CN2CCCC2)CC1 62034057 ADRACVQJHNPLAM-UHFFFAOYSA-N 251.378 2.495 10 10 CECE c1cc2c(cc1N1CCCN[C@@H](C3CC3)C1)OCCCO2 86269386 SFQDQMUGLLJAOM-OAHLLOKOSA-N 288.391 2.426 10 10 CECE Nc1ccccc1NC(=O)CSc1nccs1 40676612 NUBQNZBCWFEGIZ-UHFFFAOYSA-N 265.363 2.456 10 10 CECE COc1cc(O)c(CN(C)C[C@@H]2CCC[C@H]2O)cc1OC 245645438 FRMZVGRFCXCLKT-WCQYABFASA-N 295.379 2.002 10 10 CECE CC(=O)C(N=Nc1ccc2c(c1)COCO2)C(C)=O 254297155 NLVBBQZPRKTUJH-UHFFFAOYSA-N 262.265 2.183 10 10 CECE C[C@H](CO)c1c(F)cc(O)c(O)c1Br 258334665 CUYPDBOOKVJIKD-SCSAIBSYSA-N 265.078 2.095 10 10 CECE CC[C@H](c1ccccc1O)N1CCO[C@@H](CN(C)C)C1 369612421 IAZUKXYYBZTXNP-DZGCQCFKSA-N 278.396 2.106 10 10 CECE CC(=O)C(=O)CSc1nc(N)c2c(C)c(C)sc2n1 289643186 NFOLJFIKXVHHBS-UHFFFAOYSA-N 295.389 2.141 10 10 CECE C[C@H](C[S@@](C)=O)NCc1cc(Cl)c(F)cc1O 293717717 VGZYWVJUHSIOPK-IWEMQMMOSA-N 279.764 2.041 10 10 CECE CN(C(=O)/C=C\c1cccnc1)c1cccc(O)c1 706308284 ZTXROLCEFZGELH-FPLPWBNLSA-N 254.289 2.463 10 10 CECE COc1ccc(N2C[C@H](CN)CC23CCOCC3)cc1 2162640655 TYZFAQHUAOVLTP-ZDUSSCGKSA-N 276.380 2.029 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2)CC[C@H]1CO 2165332330 ZMDMVCMFDBEZHJ-HIFRSBDPSA-N 274.408 2.393 10 10 CECE CC(C)Oc1ccc(N2CC[C@H]3OCCN[C@@H]3C2)cc1 2162655459 KLIGTEQYNYUARG-HZPDHXFCSA-N 276.380 2.041 10 10 CECE CN1CCCc2cc([C@@](C)(O)C[C@@H]3CCCN3)ccc21 2163095857 FDJHHRZPANUMLT-RDJZCZTQSA-N 274.408 2.419 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](CCF)C3)ccc21 2165901376 CRHHSJLAMWUELJ-YGRLFVJLSA-N 277.343 2.085 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@]3(CNC(=O)C3)C2)c(Cl)c1 2163341633 LUDREBGKNIFFQP-MEBBXXQBSA-N 294.782 2.110 10 10 CECE Cc1cc(Cl)cc([C@H](C)NCc2cnn(C)n2)c1O 808719559 WDQNQIBEAFTSCJ-VIFPVBQESA-N 280.759 2.333 10 10 CECE Cc1ncn(C)c1CN(C)c1ccc(CN)cc1Cl 2132054136 ARXOYBCKOOGCFV-UHFFFAOYSA-N 278.787 2.477 10 10 CECE CCNCc1ccc(N2C[C@H](O)C3(CCC3)C2)c(F)c1 2165056350 XZVLLDNHLLELBB-HNNXBMFYSA-N 278.371 2.286 10 10 CECE O=[N+]([O-])c1cc(N2CC(CC3CC3)C2)ccc1CO 2132056231 ZPYKBDRKHVBOCE-UHFFFAOYSA-N 262.309 2.323 10 10 CECE Cc1cc(CN2CCCC[C@@H]2CC(N)=O)ccc1N(C)C 815037769 VHCKBVWTYUJUSV-OAHLLOKOSA-N 289.423 2.291 10 10 CECE Oc1cc(F)cc(F)c1[C@@H](C1CC1)N1CCNCC1 575283708 IPQGPAHDLBFYPC-CQSZACIVSA-N 268.307 2.027 10 10 CECE Cc1ccc(/C=C/C(=O)N2CCCn3nccc32)cn1 492471798 KERWOBPDRCSDCA-AATRIKPKSA-N 268.320 2.037 10 10 CECE CCN[C@@H](CC)c1ccc(N(C)CC(=O)N(C)C)cc1 723163848 LBISRPUFYWZKHO-HNNXBMFYSA-N 277.412 2.272 10 10 CECE CC(=O)N[C@](C)(C(=O)N[C@@H](C)c1ccccc1O)C(C)C 828538834 AZWFCNJTJYTGGL-ZBEGNZNMSA-N 292.379 2.120 10 10 CECE C[C@@H]1C[C@H](O)CN1C/C=C/c1ccc(N(C)C)cc1 835050630 QQEULYGWFKFGEF-GNVQUDOXSA-N 260.381 2.221 10 10 CECE CCOc1ccc(O)c(CN2C[C@@H](C)[C@H](CCN)C2)c1 903977559 UELWFYRAHSZQRF-CHWSQXEVSA-N 278.396 2.208 10 10 CECE CC[C@H]1COCCN1Cc1cc2c(cc1O)CCC2 738085151 QADUQESTTOBJQG-HNNXBMFYSA-N 261.365 2.492 10 10 CECE COC(=O)[C@@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)C1 835026667 ZNQYMTYFASCBQE-FOSCPCJNSA-N 288.391 2.261 10 10 CECE CC[C@@H](NC[C@@](C)(CO)OC)c1cccc(Cl)c1O 848556068 LRDCMFIUWAJLBP-OCCSQVGLSA-N 287.787 2.484 10 10 CECE Oc1ccc(Cl)c(F)c1CNCC[C@H]1CCCN1 841054963 IQFICNMGYKHDLG-SECBINFHSA-N 272.751 2.416 10 10 CECE Cc1cc(CN2C[C@@H]3CCC[C@H](C2)N3)ccc1N(C)C 923364175 IXNFYZLJIBDKML-IYBDPMFKSA-N 273.424 2.387 10 10 CECE C[C@H](NC(=O)NCC1CSC1)c1ccc(N(C)C)cc1 922050594 CRGWYSYFOLKKFA-NSHDSACASA-N 293.436 2.476 10 10 CECE C[C@H](NCc1ccc(N2CCOCC2)cc1)C(C)(C)CO 924750963 HTZBDWHZBWIQOB-AWEZNQCLSA-N 292.423 2.020 10 10 CECE Cc1ccc([C@H](C)NC[C@](C)(O)C(F)F)c(O)c1 698676451 GWLGJKUHEJZMTB-ZANVPECISA-N 259.296 2.367 10 10 CECE CCO[C@@H](CNCc1c(O)cccc1Cl)CN(C)C 922757295 DFARDQIIHJXALE-NSHDSACASA-N 286.803 2.102 10 10 CECE COC(=O)[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862225532 XEUSMZSBALIILY-SNVBAGLBSA-N 298.333 2.026 10 10 CECE Cc1ncsc1[C@@H](NN)c1ccc(N(C)C)cc1 698552962 RNJKRUAWKVJTRH-LBPRGKRZSA-N 262.382 2.070 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCNC23CCC3)cc1F 863481516 FYBKEBBZAGTRJQ-OAHLLOKOSA-N 277.387 2.266 10 10 CECE Cc1ccc(C(=O)N[C@]23CCCC[C@H]2C3)c(O)c1O 870537315 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10 CECE [N-]=[N+]=NCCNC(=O)c1cccnc1C(F)(F)F 704271302 GKFQZOBFBCISKE-UHFFFAOYSA-N 259.191 2.141 10 10 CECE CN(Cc1ccccc1)[C@H](CN)c1ccc(O)c(O)c1 59108474 FEJWSXANDRPEHG-CQSZACIVSA-N 272.348 2.230 10 10 CECE CN(C(=O)[C@@]12CCC[C@H]1OCC2)c1ccc(N)cc1 687376746 JEJFEVRIQRFLLK-UKRRQHHQSA-N 260.337 2.191 10 10 CECE NCc1cc(F)c(N2CCO[C@H](C(F)F)CC2)c(F)c1 687567886 TWKCGOHNTRLQBA-NSHDSACASA-N 292.276 2.284 10 10 CECE Cc1ccc(O)cc1NC(=O)c1cccc(O)c1O 692400006 AETVJXURUUKZEZ-UHFFFAOYSA-N 259.261 2.364 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)C1CSC1 718348652 HUSVJBNVOBHUDE-UHFFFAOYSA-N 264.394 2.370 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@]23COC[C@H]2C3)cc1 689305841 RUCDMIPCHGUSAG-XPKDYRNWSA-N 260.381 2.440 10 10 CECE CC(C)[C@H]1CN(c2ccc3c(c2)CN(C)C3)CCCN1 689412490 XWFVXBHBHHZYLN-QGZVFWFLSA-N 273.424 2.456 10 10 CECE Cc1cnc(CNCc2ccc3c(c2)CCN3C)[nH]1 693469962 NNZZWMVONGCLGV-UHFFFAOYSA-N 256.353 2.000 10 10 CECE Nc1cccc(Br)c1N[C@H]1CCNC(=O)CC1 697534969 AMLCATLZBSAXDV-MRVPVSSYSA-N 298.184 2.112 10 10 CECE O=[N+]([O-])c1cccnc1NCc1c(O)cccc1O 1187717923 ZWYSHAKYPKLLFH-UHFFFAOYSA-N 261.237 2.013 10 10 CECE CC[C@@H]1COC[C@H]1NCc1ccc2c(c1)CCN2C 699538511 SWQZMJSCVQKUHU-UKRRQHHQSA-N 260.381 2.194 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])CCc2ccccc21 90259379 CFYCAVZUXMLDTC-CQSZACIVSA-N 274.324 2.291 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C[C@H]1CSCCN1 91136987 CZMWZLDVTOIJHP-RYUDHWBXSA-N 294.420 2.007 10 10 CECE CCCN[C@H](C)c1ccc(N2CCC[C@H](O)C2)cc1O 93670828 FOTDPFPSFXJBFJ-OCCSQVGLSA-N 278.396 2.414 10 10 CECE CC(C)c1nnc(C(=O)NCc2cccc(O)c2O)s1 1348045074 AYWVJAYYTFYNJO-UHFFFAOYSA-N 293.348 2.003 10 10 CECE Cc1ccc2c(c1)N(C(=O)c1ccnc3c1CC(=O)N3)CC2 1292206624 IFCBAXLSEHXSET-UHFFFAOYSA-N 293.326 2.088 10 10 CECE COc1ccnc(COCCc2ccc(N)cc2)c1 2119731941 BPYRJHZSGBRHFS-UHFFFAOYSA-N 258.321 2.432 10 10 CECE CCN[C@H](C)c1ccc(N2CC=C[C@H]2CO)c(F)c1 2119815574 LVXAWBBNKZBOAZ-YPMHNXCESA-N 264.344 2.233 10 10 CECE C[C@H](O)c1ccc(N2CCC3(CC2)COC3)c(F)c1 2121067060 XYJADDLVXIAVQG-NSHDSACASA-N 265.328 2.496 10 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CNCc1ccc(N(C)C[C@H](C)CO)c(Cl)c1 688427478 RYTTVSUPRBGBRX-JTQLQIEISA-N 256.777 2.124 10 10 CECE CCCN(Cc1ccc(N)cc1)[C@@H]1C[P@@](C)(=O)C[C@H]1O 2172982966 VRHMBILKAPMORO-STXHMFSFSA-N 296.351 2.217 10 10 CECE CCN(CC1CN(C)C1)c1ccc(CN)c(Cl)c1 692268638 MTPKHPOHYJIQHD-UHFFFAOYSA-N 267.804 2.187 10 10 CECE Oc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c(O)c1 713523602 QVHDUQYWTZVXJL-YUELXQCFSA-N 275.348 2.145 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2CCC23CCCC3)cc1 693876018 JQLLEQSBEYLJEW-CQSZACIVSA-N 294.420 2.411 10 10 CECE COc1ccc([C@H](C)Nc2cc(OC)n(C)n2)c(O)c1 383559210 WJLTVQZBTYBEIK-VIFPVBQESA-N 277.324 2.316 10 10 CECE CCNCc1ccc(N2CCC[C@H](O)[C@H]2C)cc1C 384917298 ZGRJPVNGRGAXSH-CJNGLKHVSA-N 262.397 2.454 10 10 CECE CN(CCCS(=O)(=O)C(C)(C)C)Cc1ccc(N)cc1 718761566 KHZDQXRLUNUHRK-UHFFFAOYSA-N 298.452 2.304 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H]2CO3)cc1C(F)(F)F 387250364 SANRSXLRUPNEGZ-WDEREUQCSA-N 272.270 2.142 10 10 CECE Nc1ccc(NC(=O)CCN2CC(CC3CC3)C2)cc1 699603617 NIQUOXCBXIFMJS-UHFFFAOYSA-N 273.380 2.329 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC3(CN(C)C3)C2)cc1 398721213 RWRSYGDUTMULRI-AWEZNQCLSA-N 273.424 2.499 10 10 CECE CNCc1ccc(N2CCCOC[C@@H]2C)c(F)c1 398879139 GSPYBZHKLRYYEF-NSHDSACASA-N 252.333 2.160 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@H]2CCOC2)c1 398933009 YSMRAPVKMLDCGZ-GFCCVEGCSA-N 263.337 2.063 10 10 CECE Cc1c(F)cccc1C(=O)NCc1cc(N)ccc1O 399071414 QMPYRAVWTMDLCE-UHFFFAOYSA-N 274.295 2.352 10 10 CECE CC[C@]1(C)CCN(CC(=O)N(C)c2ccc(N)cc2)C1 399427984 NJBCVRWAGJHCMQ-MRXNPFEDSA-N 275.396 2.354 10 10 CECE CCN1CC[C@@H](N(CC)c2ccc(CN)cc2F)C1 822253292 SVILTENTSZQMAY-CYBMUJFWSA-N 265.376 2.205 10 10 CECE CNCc1ccc(OC)c(CN2C[C@@H]3C[C@@H]3[C@@H]3C[C@H]32)c1 2174062075 ABBNIXRPKGNOSA-QCEMKRCNSA-N 272.392 2.255 10 10 CECE CN(C[C@@H]1C[C@H]1CF)c1c(F)cc(CN)cc1F 2071383546 SRLBFWCTKRRMPT-UWVGGRQHSA-N 258.287 2.465 10 10 CECE CCC[C@H](CC)NC(=O)c1cnn2c(O)cc(C)nc12 2062938882 AFMKSEINRZPIRT-JTQLQIEISA-N 276.340 2.052 10 10 CECE CCNC(=O)[C@H]1CCCN1c1ccc([C@@H](C)NC)cc1 2169609292 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2.113 10 10 CECE COc1ccc(N(C)[C@]2(C(=O)O)CC[C@@H]2SC)cc1 2353474879 RGBBWQHHYUFHFX-GXTWGEPZSA-N 281.377 2.480 10 10 CECE COc1cccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@@H]3OC)c1O 2354398743 NIHORSYEYNZFFD-XPCVCDNBSA-N 277.364 2.304 10 10 CECE CN[C@H](C)c1ccc(N(C)CCN(C)C)c(F)c1 111138380 IJRNBIXNVNPHCP-LLVKDONJSA-N 253.365 2.104 10 10 CECE COCCNCc1ccc(N2CCC[C@@H]2CCCO)cc1 62738184 DJICSQCMFDLEAE-MRXNPFEDSA-N 292.423 2.164 10 10 CECE COc1cc(Br)c(O)c(CNC2CC2)c1 113311236 ZZUYOXUGJVSSPW-UHFFFAOYSA-N 272.142 2.415 10 10 CECE CCN(Cc1ccc(N)cc1)c1nccn(C2CC2)c1=O 61768612 BUYWRWSTAVFGCO-UHFFFAOYSA-N 284.363 2.187 10 10 CECE COC(=O)C(C)(C)N[C@@H](C)c1ccc(OC)cc1O 37085106 XRNJZQXPZLVQCY-VIFPVBQESA-N 267.325 2.003 10 10 CECE C[C@H]1CCC[C@@H](C)N1NCc1cccc(O)c1O 213894451 YQYYIKGZJUKHBH-PHIMTYICSA-N 250.342 2.365 10 10 CECE CN(O)Cc1cc(F)c(Br)cc1O 217644678 WKCPJURVRXYLHV-UHFFFAOYSA-N 250.067 2.115 10 10 CECE COC[C@@H]1CN(Cc2cc(Cl)cc(C)c2O)CCO1 180328061 BYOCGPIXDNYVJY-ZDUSSCGKSA-N 285.771 2.201 10 10 CECE 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2.089 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)/C=C\c2cnccn2)c1 761984028 VCHPMRXWBIDDPN-UUSYTGMJSA-N 299.330 2.081 10 10 CECE CCC[C@@H](C)S(=O)(=O)N1Cc2cccc(O)c2C1 867691079 QSMUBDMFZYSBOL-SNVBAGLBSA-N 269.366 2.226 10 10 CECE CCN1CCc2cc([C@H](NN)[C@H]3C[C@H]3CF)ccc21 1875727471 FMCXWZDRJNHXFK-YDHLFZDLSA-N 263.360 2.179 10 10 CECE CC1CC(COC[C@@H](O)COc2ccc(N)cc2)C1 1877092215 HFWUIWXDAIPUQW-ORHYLEIMSA-N 265.353 2.071 10 10 CECE Cc1csc([C@@H](C)NC(=O)c2c(F)ccc(O)c2O)n1 789970661 FPJDPJCGLRVEEC-SSDOTTSWSA-N 296.323 2.493 10 10 CECE C[C@H](C(=O)NC1CC1)N(C)[C@H](C)c1ccccc1O 1877536709 AJQFZHUIVYDWEK-GHMZBOCLSA-N 262.353 2.052 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@@]12CC[C@@H](CO1)C2 1878814058 WBKTWCCQDRPVDX-ZBFHGGJFSA-N 261.365 2.493 10 10 CECE C[C@@H](N)c1cc(F)c(N(CCO)C2CCC2)c(F)c1 1880928568 RMBFTYRTHVLDOL-SECBINFHSA-N 270.323 2.336 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCC[C@@](C)(O)C2)c(F)c1 1880929256 VZNAABHDKQFEMD-YMTOWFKASA-N 270.323 2.336 10 10 CECE COc1ccc(CN(C)CC2CCOCC2)c(O)c1OC 892003129 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10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCCC[C@H]3CF)ccc21 2171801643 DKFQUYDOBYUMTE-FZMZJTMJSA-N 277.343 2.228 10 10 CECE C[C@@H]1C[C@H](CNCc2cccc(O)c2O)CCO1 388883117 MLWBIANRZXXGIN-GHMZBOCLSA-N 251.326 2.003 10 10 CECE CNCc1ccc(N2CC[C@H]3[C@H]2CCCN3C)cc1 720435059 SMDWSXCYQBHAPI-JKSUJKDBSA-N 259.397 2.079 10 10 CECE C[C@H]1CCN(c2ccc(CN)cc2Cl)CCO1 720483936 PWMRHCAEDUXQRW-JTQLQIEISA-N 254.761 2.414 10 10 CECE CO[C@H](C1CCOCC1)[C@@H](N)c1ccc(N(C)C)cc1 2163072723 ZDMBYGPNJBPKIB-JKSUJKDBSA-N 278.396 2.194 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H](CO)[C@@H](C(F)(F)F)C2)cc1 2163287819 FVVCSBFKSVXBCO-XWIASGKRSA-N 288.313 2.313 10 10 CECE CCNCc1cc(F)c(N2C[C@@H]3CCO[C@@H]3C2)c(F)c1 2172045087 OOMJEEBBTAQBHG-SMDDNHRTSA-N 282.334 2.299 10 10 CECE C[C@H](NC[C@@H]1C[C@@H](C)N(C)C1)c1ccc(O)cc1O 396696474 JRJNXSHJZDCUBL-WOPDTQHZSA-N 264.369 2.089 10 10 CECE CC[C@H](O)CCCNCc1cccc(OC)c1O 398601307 WFLPDTBXMBOMLJ-LBPRGKRZSA-N 253.342 2.042 10 10 CECE CCNCc1ccc(N2CCC3(CN(C)C3)C2)c(C)c1 398913693 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MILLPNJRHYQUHU-CYBMUJFWSA-N 295.814 2.292 10 10 CECE Br/C=C/COc1ccc(N2CCNCC2)cc1 2004062229 TXDBCNFOEUPYJU-LZCJLJQNSA-N 297.196 2.384 10 10 CECE CCNCc1cc(F)c(N2CC[C@@](O)(CC)C2)c(F)c1 2150764895 XWCGEOABAWSXDA-HNNXBMFYSA-N 284.350 2.426 10 10 CECE Cc1ccc([C@H](C)N(C)C[C@H]2CCS(=O)(=O)C2)c(O)c1 2148788195 SIRLIMNNCDCXPC-QWHCGFSZSA-N 297.420 2.128 10 10 CECE CCCSC[C@H](NN)c1ccc(N(C)C)cc1 1999527271 LHSQZPWTGXVDAH-ZDUSSCGKSA-N 253.415 2.400 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)C[C@H]1C[C@H]1C 2000625069 XCTCMRRJYHKEQJ-PSASIEDQSA-N 255.339 2.098 10 10 CECE CNC(=O)[C@@H]1[C@@H](C)CCN1c1ccc([C@H](C)N)c(Cl)c1 2146446479 CPUKOTPWFZUWCT-BHDSKKPTSA-N 295.814 2.321 10 10 CECE C[C@@H]1CCCCN1CCCNCc1cccc(O)c1O 41116323 VKAXQHCPKMPWSO-CYBMUJFWSA-N 278.396 2.452 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@@H]2OCC[C@@H]2C)c1 2152427877 NSKSIWCTNPYKSG-ZBEGNZNMSA-N 277.364 2.452 10 10 CECE C[C@@H]1CCC[C@@]1(O)CNCc1cccc(F)c1O 294111151 SQGZKYJPYIRLDB-QMTHXVAHSA-N 253.317 2.172 10 10 CECE C[C@@H](N[C@H]1CN2CCC1CC2)c1ccc(F)cc1O 62744897 XMFQFGIUECTLPH-YGRLFVJLSA-N 264.344 2.276 10 10 CECE Cc1cc(N2C(=O)[C@H]3C[C@H](C)C[C@H]3C2=O)c(C)cc1N 300148582 XPURVKXEJGRTAH-VTYGSRLXSA-N 272.348 2.421 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc([C@@H](C)O)cc1F 2038890360 LCTGAUBVQNPXSQ-HBNTYKKESA-N 253.317 2.086 10 10 CECE C[C@H]1CNC[C@H](C)N(Cc2c(O)cccc2Cl)C1 2041199925 CVEXJWRYPYKXFI-QWRGUYRKSA-N 268.788 2.475 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2CC[C@H]1[C@@H]1CNC[C@@H]21 2160787589 ZIKDGPGHZACNNO-CTASWTNQSA-N 272.392 2.130 10 10 CECE CC(=O)N(C1CCC1)[C@H](C(=O)O)c1c(O)cccc1F 2160772837 SBJDMYLHELVUJZ-ZDUSSCGKSA-N 281.283 2.058 10 10 CECE CCCN(CC(N)=O)c1ccc(CNC2CC2)cc1Cl 312639774 DBACLABFSUXPHX-UHFFFAOYSA-N 295.814 2.294 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CC4CCC3CC4)cc21 313018608 CSSFVCOFVNOBPF-NWHVRFAMSA-N 271.364 2.042 10 10 CECE Cc1cccc(O)c1CN1C[C@@]2(C)CN(C)C[C@]2(C)C1 2160772793 RJWSCBSVXKYZJL-IAGOWNOFSA-N 274.408 2.474 10 10 CECE CC(F)(F)[C@H]1CCCN1C(=O)COc1ccc(N)cc1 2160115394 CAZWPJMOQVEFLU-GFCCVEGCSA-N 284.306 2.294 10 10 CECE COCCO[C@H]1CCN([C@H](C)c2cc(F)ccc2O)C1 2158827451 DOCIOUOYGIVUNT-YPMHNXCESA-N 283.343 2.330 10 10 CECE COc1cccc(O)c1CN[C@]1(CO)CCCC1(C)C 2160729904 XZTPGLXXHLUPAE-INIZCTEOSA-N 279.380 2.432 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)CC[C@@H]1CCCO1 701173174 JMNYLWUUANYZCO-MNOVXSKESA-N 252.318 2.247 10 10 CECE CC[C@@H]1CNCCN1c1ccc2c(c1)OCCCO2 86176900 SNZCUQRUYORCCF-GFCCVEGCSA-N 262.353 2.036 10 10 CECE CCCNCc1ccc(N2C[C@H]3C[C@H]2C[C@H]3O)c(C)c1 2172097099 HEOQGOULFZSOAG-HLLBOEOZSA-N 274.408 2.454 10 10 CECE CN(C(=O)c1ccc2nc[nH]c2c1)c1ccc(N)cc1 702047257 APZMRIIGDGBMMH-UHFFFAOYSA-N 266.304 2.422 10 10 CECE CCC(O)(CC)CN(C)c1ccc(CN)c(F)c1 706411982 QUTAFIUCWDAERL-UHFFFAOYSA-N 254.349 2.272 10 10 CECE C[C@H]1[C@H](C)CN1c1cc2c(cc1Cl)[C@H](N)C(=O)N2 706819268 ROISSBJFRQCJNA-LTMDPNIMSA-N 265.744 2.137 10 10 CECE CN[C@@H](C)c1ccc(N2CC(n3ccnc3)C2)cc1 707663434 BVQPQINHIFSHSU-LBPRGKRZSA-N 256.353 2.225 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1CNC(=O)Nc1ccc(N)cc1 686388904 PPGSUEHQCBSVNB-VWYCJHECSA-N 263.341 2.204 10 10 CECE NCc1ccc(N2CC(OCC(F)(F)F)C2)c(F)c1 708284204 RGSPCJJTXYJGEB-UHFFFAOYSA-N 278.249 2.052 10 10 CECE CO[C@H]1C[C@@H](CN[C@@H](C)c2c(O)cccc2O)C1 708665414 YENGGKKQQMHYJJ-GARJFASQSA-N 251.326 2.173 10 10 CECE CN1CCCc2cc([C@@H](O)CC[C@@H]3CCNC3)ccc21 2163107361 OJTXPVFOBAKYCM-DYVFJYSZSA-N 274.408 2.492 10 10 CECE C[C@H](CNC(=O)Cc1ccc(N)cc1)[C@H]1CCCCO1 712087881 RYXOBZPBAWBFHD-IUODEOHRSA-N 276.380 2.133 10 10 CECE COCC1(CNCc2ccc3c(c2)CCN3C)CC1 691797482 RZAGEFYGOLPAGZ-UHFFFAOYSA-N 260.381 2.195 10 10 CECE CCNCc1ccc(N2CC3CC2(CO)C3)c(Cl)c1 694518466 QUECFZFLGBQCLV-UHFFFAOYSA-N 280.799 2.411 10 10 CECE CCCNCc1ccc(N2CC(O)(C3CC3)C2)cc1 384076347 WORVQBMWEBZLPV-UHFFFAOYSA-N 260.381 2.147 10 10 CECE CCc1nn(Cc2ccc3c(c2)CCCN3C)cc1N 716706831 NDQAENCLZZFISU-UHFFFAOYSA-N 270.380 2.458 10 10 CECE C[C@H](NC[C@H](C)CCCO)c1cc(O)ccc1O 384738752 QLFVATNFRVVNDP-MNOVXSKESA-N 253.342 2.157 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)CCOC1CCC1 716860210 NQBAMVFXNAYISV-JTQLQIEISA-N 252.318 2.247 10 10 CECE CC(C)N(CC(F)F)S(=O)(=O)Cc1ccc(N)cc1 386219714 ZXCWKCVSXAWNGR-UHFFFAOYSA-N 292.351 2.074 10 10 CECE CO[C@@H](C1CC1)[C@H](C)NCc1ccc(O)cc1O 388243029 RMUSSMXCJLCCPF-LKFCYVNXSA-N 251.326 2.001 10 10 CECE COC1(C)CCN(CCOc2ccc(N)cc2)CC1 389132065 TWNOVULDPCPAFO-UHFFFAOYSA-N 264.369 2.149 10 10 CECE CC[C@@H](C)[C@H]1CN(c2ccc3c(c2)CCO3)CCN1 395028910 FLCKTNKMXCMGSK-IUODEOHRSA-N 260.381 2.446 10 10 CECE C[C@@H](NC[C@@]1(C)CCOC1)c1ccc(O)cc1O 397309112 RGKQJMQASOYLNB-QMTHXVAHSA-N 251.326 2.175 10 10 CECE COc1ccc([C@@H](C)N[C@@H](C)c2ncon2)c(O)c1 398048812 DLLSIMBEZZIELW-BDAKNGLRSA-N 263.297 2.196 10 10 CECE CC[C@H]1CN(c2ccc(CN)cc2C#N)C[C@@H](CC)O1 398582771 MQYXLYZEODVBMW-GASCZTMLSA-N 273.380 2.411 10 10 CECE CCc1cc(C(=O)NC)n([C@H](C)c2c(O)cccc2F)n1 2070200662 XYYLGDMIFVNPNG-SECBINFHSA-N 291.326 2.259 10 10 CECE CCN1CC[C@@H]1CNCc1ccc(Cl)cc1O 1207294342 OTVRVUFNQRBQBM-GFCCVEGCSA-N 254.761 2.229 10 10 CECE CC[C@]1(CO)COCCN1c1ccc([C@H](C)N)c(Cl)c1 2169037162 SFNXBJSQLBTYPD-NHYWBVRUSA-N 298.814 2.337 10 10 CECE Cc1cc(C)n(CCCN(C)c2ccc(CN)cc2)n1 2169555645 UWTYTDIQZSWAFM-UHFFFAOYSA-N 272.396 2.485 10 10 CECE CNCc1ccc(N(C)C[C@@H]2[C@H]3CCCO[C@@H]23)c(F)c1 2176462430 RLIRNMARLYFIDR-XJKCOSOUSA-N 278.371 2.406 10 10 CECE COC(=O)c1ccc(CN2CC[C@@H](CN=[N+]=[N-])C2)cn1 2176734250 NXRVEUZKCRNCOF-NSHDSACASA-N 275.312 2.000 10 10 CECE Oc1cc(Cl)ccc1CN[C@H]1CCCC[C@@H]1O 1308710409 UJFFHXGUZPKYTJ-RYUDHWBXSA-N 255.745 2.439 10 10 CECE Cc1ccc([C@H](C)N(C)[C@H]2CCCCNC2=O)c(O)c1 2171241433 KYOGGTIGUFVSOS-JSGCOSHPSA-N 276.380 2.362 10 10 CECE COC[C@H]1CC[C@H](C(=O)N(C)Cc2ccccc2O)C1 2181803460 ASWATHALVFGSJD-STQMWFEESA-N 277.364 2.413 10 10 CECE CC[C@@H]1CCCCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2188875256 PHJRRBDFZKJKMS-SNVBAGLBSA-N 279.336 2.456 10 10 CECE C[C@@H](O)c1ccc(N2CC(O)(c3ccsc3)C2)cc1O 2193363381 WZFWEOUOGPRZKQ-SNVBAGLBSA-N 291.372 2.215 10 10 CECE CO[C@@H](c1noc(-c2cc(O)c(O)c(O)c2)n1)C(C)C 2188917544 XTQSJVNOHKVTJE-LLVKDONJSA-N 280.280 2.197 10 10 CECE CCN[C@@H](C)c1ccc(N(CCOC)C2COC2)cc1 2193571645 ZQHLTIKESYIPET-ZDUSSCGKSA-N 278.396 2.209 10 10 CECE CCN(CC1CN(C)C1)c1ccc2c(c1)CCC[C@@H]2O 2184688841 IKHAAWCQSQNAIZ-KRWDZBQOSA-N 274.408 2.444 10 10 CECE CN(C)C[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3N)C1 2184693551 SFPYQSNJILQRLM-CXAGYDPISA-N 273.424 2.411 10 10 CECE O[C@H]1CN(c2ccc3c(c2)CC[C@H]3O)CC2(CCC2)C1 2184733164 FEWHXPMVDUHJOV-GDBMZVCRSA-N 273.376 2.408 10 10 CECE O[C@H]1C[C@@H]2CN(c3ccc4c(c3)CCC[C@@H]4O)C[C@@H]2C1 2185081684 CETJFRHCXQMRIX-SHFYGJNESA-N 273.376 2.263 10 10 CECE CC[C@H]1CN(Cc2c(O)cccc2F)CC[C@@H]1N 2042632027 ACQKDCIBHYHQBX-GWCFXTLKSA-N 252.333 2.091 10 10 CECE C[C@@H]1CC[C@H](CO)N(c2ccc(CN)cc2Cl)C1 2048052214 LWYGKKWRPIESLE-ZYHUDNBSSA-N 268.788 2.396 10 10 CECE CC(C)[C@@H](O)CN(C)c1ccc([C@H](C)O)cc1F 2048724855 REOYTCVRFMIWEV-HZMBPMFUSA-N 255.333 2.332 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2CCCCN2C)cc1O 2186102919 WOAFPSRAYMHICI-OCCSQVGLSA-N 278.396 2.366 10 10 CECE C[C@@H]1CNCCC1=Cc1nccn1CC(F)(F)F 2050587351 CWYGHECDZNZYTP-SECBINFHSA-N 259.275 2.458 10 10 CECE CCCOc1cc(N2C[C@@H]3CC[C@H](N)[C@H]3C2)ccc1N 2191592967 MOKWGGAIKCNAPE-UBHSHLNASA-N 275.396 2.231 10 10 CECE CN(C[C@@H]1[C@@H]2CCO[C@@H]21)c1ccc(CN)c(Cl)c1 2056396509 JHYZVIXKNJUKKA-SCRDCRAPSA-N 266.772 2.270 10 10 CECE CC(C)c1conc1C(=O)NCc1cc(N)ccc1O 2195403026 GOICFPZMCIRZEK-UHFFFAOYSA-N 275.308 2.016 10 10 CECE CC(C)[C@@H](NC(=O)[C@@H]1CNc2ccccc2N1)C(F)F 2192090588 BTQDJYPYBWYAHU-NWDGAFQWSA-N 283.322 2.299 10 10 CECE Nc1ccc(C[S@](=O)CCCOC2CCC2)cc1 2065051153 ALCYFYFJBJEBPP-GOSISDBHSA-N 267.394 2.477 10 10 CECE C[C@H](N[C@H](CO)[C@H]1CC=CCC1)c1c(O)cccc1O 2196143249 UYNOFNBQSAPNOG-RWMBFGLXSA-N 277.364 2.466 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc(CO)cc1Cl 2067403379 CQZGKMBJLREWPI-NWDGAFQWSA-N 266.772 2.115 10 10 CECE CCC[C@]1(C(=O)N[C@H](C)c2ccccc2O)CCCN1 2192625988 XZSONBJMYSZNCH-MLGOLLRUSA-N 276.380 2.492 10 10 CECE C[C@@H]1CN(c2ccc(CO)c([N+](=O)[O-])c2)C[C@H]1C 2068311989 SZASENCTIZBAJX-NXEZZACHSA-N 250.298 2.179 10 10 CECE CN1CCN(c2ccc3c(c2)CCC[C@H]3N)CC12CC2 2188415824 MWJGZKHLQBYZOX-MRXNPFEDSA-N 271.408 2.307 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@@H]3C[C@@]32CO)c1 2188657104 UOTYXJHYSLDPKW-IRHXVLAXSA-N 277.364 2.212 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC(CCCN)C1 2078783705 QVCDXXPJVHFINP-JTQLQIEISA-N 252.333 2.263 10 10 CECE CC[C@H](N)c1ccc(N2CCC[C@@](F)(CO)C2)cc1 2101307987 JLCABHGBWNOTMR-GJZGRUSLSA-N 266.360 2.397 10 10 CECE COc1cccc(CNC[C@H]2COC(C)(C)C2)c1O 2103163311 BAANVABZZOZCIW-NSHDSACASA-N 265.353 2.306 10 10 CECE CSCC[C@H](O)CCNCc1ccc(F)cc1O 2084166618 RTUDXUWQROLOJT-GFCCVEGCSA-N 273.373 2.125 10 10 CECE Cc1nc(C(C)(C)NCc2c(C)cccc2O)n[nH]1 2104512413 JKECGBZRLKTNPU-UHFFFAOYSA-N 260.341 2.152 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1CN(C)c1ccc(CO)cc1[N+](=O)[O-] 2105241764 LRPVNVLVIRVBJW-IAZYJMLFSA-N 264.325 2.425 10 10 CECE COc1ccc(N2CC[C@H]3NCCC[C@@H]3C2)cc1F 2106375051 AOKJKMJPETWVCB-BXUZGUMPSA-N 264.344 2.413 10 10 CECE C[C@@H]1CCNCCN1c1ccc2c(c1)OCCCO2 2106568015 QZDLAYQFGIIAFR-GFCCVEGCSA-N 262.353 2.036 10 10 CECE CCN1CCc2cc(N3CCC[C@H](CN)C3)ccc21 2106798004 GRUXREPWWIZPHY-CYBMUJFWSA-N 259.397 2.244 10 10 CECE Cc1cnn(C)c1[C@](C)(O)c1ccc(N(C)C)cc1 2106792654 GBPOIGJSVWJVGB-OAHLLOKOSA-N 259.353 2.050 10 10 CECE CCN1CCc2cc([C@]3(O)COCC[C@@H]3C)ccc21 2106789824 BTWIFACQDTUWDG-LRDDRELGSA-N 261.365 2.313 10 10 CECE CN1CCc2cc([C@]3(O)CCCOC3(C)C)ccc21 2106799747 AFYZGRCGGHVDPQ-MRXNPFEDSA-N 261.365 2.456 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)c1ncccn1 2106828657 PBIXRGJCBMFLNJ-CQSZACIVSA-N 254.337 2.125 10 10 CECE CC[C@H]1CCOC[C@]1(O)c1ccc2c(c1)CCN2C 2106800509 IJMYPCREQKZYTL-XJKSGUPXSA-N 261.365 2.313 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@]1(O)CC[C@H]2C[C@H]21 2106854547 FKKFOSSDNSHKLS-XZDPQHSOSA-N 260.381 2.174 10 10 CECE CCCC[C@@H](O)[C@H](NC)c1ccc2c(c1)CCN2C 2106859874 NWMYDFJCUYEOGJ-HZPDHXFCSA-N 262.397 2.491 10 10 CECE CC[C@H]1CCNC[C@@H]1NCc1ccc(N(C)C)cc1 2107376834 HKFJCYRYHSSGFF-HOCLYGCPSA-N 261.413 2.230 10 10 CECE CCO[C@H]1C[C@H](OC)CN(Cc2ccccc2O)C1 2109145213 SGBLFOYDTLCVMV-KBPBESRZSA-N 265.353 2.018 10 10 CECE O=Cc1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1 2089406174 MKINEWCFDYPXRS-UHFFFAOYSA-N 277.301 2.006 10 10 CECE COc1ccc(CN2CCOCC(C)(C)C2)c(O)c1 2090047072 GJVUASNMMSLWRT-UHFFFAOYSA-N 265.353 2.259 10 10 CECE CCC[C@H](C(=O)O)[C@@H](O)c1ccc2c(c1)CCN2C 2110646624 SWLZVIVUSITVIV-JSGCOSHPSA-N 263.337 2.213 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H](O)C(C)C)cc1O 2111301008 DIJXWNNDQKWPAS-NHYWBVRUSA-N 266.385 2.126 10 10 CECE CCN[C@H](CC)c1ccc(N2C[C@H](F)[C@H](O)C2)cc1 2092829721 VMVHNFAUUGDBEH-RRFJBIMHSA-N 266.360 2.266 10 10 CECE CCCN[C@H](C)c1ccc(N2C[C@H](O)[C@H](F)C2)cc1 2092828869 LQSOHLHIBXLYIT-DFBGVHRSSA-N 266.360 2.266 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H](O)C3(CC3)C2)c(F)c1 2093335386 IHELJWUHADMGHA-HZMBPMFUSA-N 264.344 2.067 10 10 CECE CCN(C(=O)c1ccnn1CC)c1ccc(N)cc1 2094289930 CNWBRPLYEXJAOK-UHFFFAOYSA-N 258.325 2.152 10 10 CECE CNCc1ccc(N(C)C[C@H]2OCC[C@@H]2C)c(F)c1 2096112507 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CC[S@](C)(=O)=NCCN[C@H]1CCc2cccc(O)c21 2130749786 XICZMVSRBPUEFT-BUXKBTBVSA-N 282.409 2.087 10 10 CECE CNCc1ccc(OC)c(COCCCCOC)c1 2130886814 RTIQHKYWQUJOHC-UHFFFAOYSA-N 267.369 2.358 10 10 CECE C[C@@H](O)c1ccc(N2CCn3nncc3C2)c(Cl)c1 2130070530 BHJXKBKTOYIVGP-SECBINFHSA-N 278.743 2.005 10 10 CECE CO[C@@H]1CC[C@@H]1C[C@H](N)c1ccc2c(c1)CCN2C 2130363631 VVKUXJGWXCDFML-IJEWVQPXSA-N 260.381 2.494 10 10 CECE C[C@]1(C(=O)N2CCCC[C@H](CN=[N+]=[N-])C2)CCOC1 1912152151 PHAAEMVBISOHBP-YPMHNXCESA-N 266.345 2.352 10 10 CECE Cc1nn(C)c(Cl)c1C=CC(=O)N1CC[C@H](N=[N+]=[N-])C1 1912208687 VHXFLTCHWADPDA-VIFPVBQESA-N 294.746 2.306 10 10 CECE C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC(N=[N+]=[N-])CC1 1912205993 HUIDHYOXRFYHKF-YPMHNXCESA-N 279.388 2.456 10 10 CECE COc1ccc(N2CC[C@@H](OC)C[C@H]2CN)cc1Cl 2138247783 JHILCWZTTIKAIV-NWDGAFQWSA-N 284.787 2.291 10 10 CECE CO[C@@H]1CCN(CCCOc2ccc(N)cc2)[C@H]1C 1914236415 NFRQNCVWAKTQRX-SWLSCSKDSA-N 264.369 2.147 10 10 CECE COc1cc(N)c(N2CC[C@H](OC)C2(C)C)cc1OC 1914260067 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2.394 10 10 CECE C[C@H](c1cc(F)ccc1O)N(CC(=O)O)C1CC1 94622211 GPZSAGPAGUHSFM-MRVPVSSYSA-N 253.273 2.141 10 10 CECE CC(C)N1CCCN(Cc2cccc(F)c2O)CC1 272211339 AKCLXERWRSDRBR-UHFFFAOYSA-N 266.360 2.447 10 10 CECE COC(=O)C1(NCCN=[N+]=[N-])C[C@H]2CC[C@@H](C2)C1 704842243 RUYUTQQDJUMMSK-UWVGGRQHSA-N 252.318 2.008 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CCC3(C)C)ccc21 706778552 CSLDGRFUEHEATB-CYBMUJFWSA-N 259.353 2.278 10 10 CECE Cc1ccc(CNC(=O)Nc2ccc(N)cc2)cn1 62037768 WSRQPUWCJDEEDC-UHFFFAOYSA-N 256.309 2.294 10 10 CECE CCn1ccnc1Cn1ccc2ccc(CCN)cc21 692494917 ZNCHCMRSEWITSY-UHFFFAOYSA-N 268.364 2.407 10 10 CECE CCN1CC[C@@H](N(C)c2ccc(CNC)cc2F)C1 688446394 HWYBMVZBAZYQSF-CYBMUJFWSA-N 265.376 2.076 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H]3CNCC[C@@H]32)cc1 715021226 MQXZTVOSNXQPRH-WBVHZDCISA-N 273.424 2.327 10 10 CECE CCn1cc(CN[C@H](C)c2cc(O)ccc2O)cn1 688524107 NSEHRFJKRPARSI-SNVBAGLBSA-N 261.325 2.165 10 10 CECE C[C@H](NCCCOC1CC1)c1c(O)cccc1O 717369850 AIKVLOAYPXZFST-JTQLQIEISA-N 251.326 2.318 10 10 CECE O=C(NCc1cnc(Cl)s1)c1cccc(O)c1O 718803072 CSSJKGVEJHRIBW-UHFFFAOYSA-N 284.724 2.138 10 10 CECE C[C@H](O)C1CN(c2ccc(CN)c3ccccc23)C1 719831193 SUPBYLXMWGSUMZ-NSHDSACASA-N 256.349 2.116 10 10 CECE C[C@H](O)c1ccc(N2CCS[C@@H](CCO)C2)c(F)c1 720007667 ZMZOXZNPRMAWTC-JQWIXIFHSA-N 285.384 2.183 10 10 CECE COC[C@H](C)OCCCC(=O)Nc1ccc(N)cc1 70204504 HITDXPTWZDOAJU-NSHDSACASA-N 266.341 2.039 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H]3COC[C@@H]32)c(F)c1 690405696 WJTOOZGWXNZTPX-WBIUFABUSA-N 265.328 2.494 10 10 CECE CCS(=O)(=O)C1(CN[C@H](C)c2ccccc2O)CC1 693518305 YUIPZUQGVKLPJY-LLVKDONJSA-N 283.393 2.010 10 10 CECE CC1(C)[C@@H]2NCCC[C@H]2[C@H]1NCc1ccccc1O 693691432 WBSIZVZLSIFONP-BPLDGKMQSA-N 260.381 2.258 10 10 CECE CC(C)C[C@@H]1CN(c2ccc3c(c2)OCO3)CCN1 86126643 NGPQHSCGBQIWSB-GFCCVEGCSA-N 262.353 2.240 10 10 CECE C[C@@H](NC(=O)CCOc1ccc(N)cc1)c1cscn1 697937840 ZKEGBGRCKRBCHL-SNVBAGLBSA-N 291.376 2.372 10 10 CECE NCc1ccc(N2CCO[C@@H](C(F)(F)F)C2)cc1F 698755259 WDIHCXSXFLKYIM-LLVKDONJSA-N 278.249 2.052 10 10 CECE C[C@@H]1CN(Cc2ccc3c(c2)CCCN3C)CC[C@@H]1N 94338991 UUAUEHKKBLAVGO-CJNGLKHVSA-N 273.424 2.238 10 10 CECE COc1c(F)cc(N2CCN[C@@H](C)CC2)cc1F 2256173170 IRTVKWXJFBJNTG-VIFPVBQESA-N 256.296 2.162 10 10 CECE CCCNCc1ccc(N2CC([S@@](C)=O)C2)cc1C 2115312221 WFNSYEVXTFLRJP-LJQANCHMSA-N 280.437 2.062 10 10 CECE O=C(NCc1cc(O)ccc1O)C(C1CC1)C1CC1 1455357529 SITQAPLJGVLKQI-UHFFFAOYSA-N 261.321 2.150 10 10 CECE CCOc1cccc(CN(CC)C[C@H](N)CC)c1O 2116682857 VIUOQGCABOXLHI-CYBMUJFWSA-N 266.385 2.350 10 10 CECE C[C@]1(C(F)F)CCN(C(=O)Cc2ccc(N)cc2)C1 2117974796 RLQBWGMWFQTEHU-AWEZNQCLSA-N 268.307 2.315 10 10 CECE CCN(CCO)c1ccc(CNCC(C)C)cc1OC 212676127 BMWZZMVFQDHYPB-UHFFFAOYSA-N 280.412 2.259 10 10 CECE CCOCCCNCc1ccc(N(C)C)c(OC)c1 212690355 RJKXUAJGKQQGPB-UHFFFAOYSA-N 266.385 2.277 10 10 CECE CCOc1cccc([C@@H](C(N)=S)N(CC)CC)c1O 213185335 OTJJSBPYRVTOCX-LBPRGKRZSA-N 282.409 2.460 10 10 CECE CC[C@H](C(F)F)N(C)S(=O)(=O)Cc1ccc(N)cc1 2122245360 IHHYMUYPGURPKV-LLVKDONJSA-N 292.351 2.074 10 10 CECE 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CC(C)(C)OC(=O)N1CC(=O)C[C@@H]1c1ccc(N)cc1O 1952991979 ROTFHKCDIYMJAK-GFCCVEGCSA-N 292.335 2.225 10 10 CECE Cc1cccc(O)c1CN1C[C@@H](C(=O)O)C(C)(C)C1 1970620193 AABGNEUFZLAOGL-LBPRGKRZSA-N 263.337 2.243 10 10 CECE C[C@H]1OCC[C@@H]1CCNCc1cc(F)ccc1O 1972148918 XKNNPBPXEQNJTA-MNOVXSKESA-N 253.317 2.436 10 10 CECE CCc1noc(C)c1C(=O)N(C)Cc1ccc(N)cc1 2148893344 ZKVURBFBKFJXMX-UHFFFAOYSA-N 273.336 2.400 10 10 CECE Cc1ccc(C(=O)[C@H](O)c2ccc(N(C)C)cc2)cn1 2147006777 LBMMWQOHLXHYAE-OAHLLOKOSA-N 270.332 2.372 10 10 CECE CC1(C)C[C@H](NC(=O)COc2ccc(N)cc2)CCS1 2143742911 ARRVEFITOBFJSV-GFCCVEGCSA-N 294.420 2.438 10 10 CECE C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 2144472519 CRUTWYKKFAADQJ-OPQSFPLASA-N 294.420 2.123 10 10 CECE CCOc1cccc(CNCc2cccc(O)n2)c1O 2144606275 NHUXYJSZGJGQJO-UHFFFAOYSA-N 274.320 2.181 10 10 CECE C[C@]12CSC[C@@H]1CN(c1cc3c(cc1N)OCCO3)C2 2144750861 AFAMOBHESMIUEM-BONVTDFDSA-N 292.404 2.229 10 10 CECE CCN[C@@H](C)c1ccc2c(c1)CCN2CC[C@@H](C)O 162170103 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CCNCc1ccc(N2C[C@H]3C[C@@H](C2)N(C)C3)c(F)c1 2160692124 WVGMLCMCVVSKAZ-KBPBESRZSA-N 277.387 2.076 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H](CO)CC(C)(F)F)c1 2169534909 DHGPSXFCRLRTLG-UWVGGRQHSA-N 289.322 2.458 10 10 CECE N[C@]12CCCC[C@H]1CN(c1ccc3c(c1)OCCO3)C2 2169631473 FTIQRJMFYCJMCU-LRDDRELGSA-N 274.364 2.166 10 10 CECE C[C@@]12CNC[C@H]1CN(Cc1cc(Cl)ccc1O)C2 703557024 AHLYCXBZGKVNEH-FZMZJTMJSA-N 266.772 2.087 10 10 CECE CNCc1ccc(N2CC[C@H](O)CC23CCC3)c(F)c1 2169896256 PMOHYJOJADMDPE-ZDUSSCGKSA-N 278.371 2.429 10 10 CECE O=[N+]([O-])c1ccc(N2CCC3(CC2)CC3)cc1CO 706322355 KGHYMGSYKXFXLQ-UHFFFAOYSA-N 262.309 2.468 10 10 CECE CCCN(CCS(C)(=O)=O)[C@@H]1CCc2cccc(O)c21 2170129519 GSEDCKVDYUCDGQ-CYBMUJFWSA-N 297.420 2.136 10 10 CECE C[C@H](c1ccc(O)cc1O)N(C)[C@H]1C[C@H]2CN[C@@H](C2)C1 709062475 YALHKTVHWKVAHN-VOAKCMCISA-N 276.380 2.231 10 10 CECE NCc1ccc(N2CCC(n3cccn3)CC2)cc1F 2170669994 UBTRWRWMFKCCNV-UHFFFAOYSA-N 274.343 2.322 10 10 CECE Cn1cc([C@H]2CCCN2CCc2ccc(N)cc2)cn1 380654784 RICRTBYYMARRSW-MRXNPFEDSA-N 270.380 2.382 10 10 CECE CCNCc1ccc(N(CC)CC2CN(C)C2)c(F)c1 692246628 KWWOGSHLRGKVJM-UHFFFAOYSA-N 279.403 2.323 10 10 CECE Cc1ccc([C@H](C)NCC[C@H]2CCCS2(=O)=O)c(O)c1 714353665 ZOCXKACUGWGOKB-QWHCGFSZSA-N 297.420 2.319 10 10 CECE Cc1cc(N2C(=O)[C@H]3CC(C)(C)[C@@H]3C2=O)c(C)cc1N 2170879201 KCDPAYOYUSTNMD-GWCFXTLKSA-N 272.348 2.421 10 10 CECE Cc1ccc(O)c(CN2CCC[C@H]3CNCC[C@@H]32)c1 715034788 ZLHCXGWNUBFEDQ-ZFWWWQNUSA-N 260.381 2.275 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](C)[C@@](C)(CO)C2)cc1 694635777 MKRIHZMMRCTEKG-XJKCOSOUSA-N 262.397 2.422 10 10 CECE CCN(CC)C1[C@@H]2CN(Cc3cccc(C)c3O)C[C@@H]12 384558708 OTPQCDDWFKZVBV-HUUCEWRRSA-N 274.408 2.473 10 10 CECE Cc1nnc([C@@H](C)NCc2ccc(O)cc2O)s1 391794257 ZENAUIZMVXQVHP-SSDOTTSWSA-N 265.338 2.109 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2CC[C@@H]2OC)c1O 724201311 GOQCIKCYMVIDNK-MNOVXSKESA-N 271.744 2.321 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@@]3(CCOC3)C2)cc1O 2171163413 AGJLNCQDCMFRKU-MLGOLLRUSA-N 277.364 2.452 10 10 CECE COC[C@@H](N[C@@H](C)c1c(O)cccc1O)C1CC1 397459228 PXKIDWCYOQIYRT-GXSJLCMTSA-N 251.326 2.173 10 10 CECE CCC[C@](NCCCN=[N+]=[N-])(C(N)=O)[C@@H]1CC1(C)C 397635811 WDTHZHUDHVSZFZ-ZWNOBZJWSA-N 267.377 2.347 10 10 CECE CN[C@H]([C@@H]1C[C@@H]2C[C@@H]2C1)[C@H](O)c1ccc(N(C)C)cc1 2163922300 SIEJRWHDRZVCRK-NJNCZSALSA-N 274.408 2.420 10 10 CECE C[C@@H]1CCN[C@H]([C@H](N)c2ccc3c(c2)CCCN3C)C1 2164023313 GXYBIIJMCVHDEU-ISTRZQFTSA-N 273.424 2.457 10 10 CECE CCN[C@@H](c1ccc(N(C)C)cc1)c1cccnc1N 2164175667 YPGWGWFNDIHBFY-HNNXBMFYSA-N 270.380 2.429 10 10 CECE OCc1ccc(N2CC=CC[C@@H]2CO)cc1C(F)(F)F 2176378375 SAPIFBAMTMJKJE-GFCCVEGCSA-N 287.281 2.325 10 10 CECE NCc1ccc(N2CCC[C@]3(CO)CCC[C@@H]23)cc1F 2165238838 HTXJRLUVZAJBNU-CVEARBPZSA-N 278.371 2.416 10 10 CECE CCO[C@@H]1C[C@H](OC)CN(c2ccc(CN)cc2C)C1 2165449981 QIKGLXXYMBWIOJ-LSDHHAIUSA-N 278.396 2.084 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C[C@@H]1CCNC(=O)C1 2165517555 ZYCAHWYDUIFIJQ-CQSZACIVSA-N 275.396 2.005 10 10 CECE COC(=O)c1cc(C2CC2)nn1Cc1c(O)cccc1F 2069959473 ASCITORWMZEDBA-UHFFFAOYSA-N 290.294 2.440 10 10 CECE CN1CCc2cc([C@H](O)C[C@H]3N[C@H]4CC[C@H]3C4)ccc21 2176991997 NHAHCJQLVSUTEZ-ZYIUAKIQSA-N 272.392 2.243 10 10 CECE Cc1ccnc([C@H](N)c2ccc3c(c2)CCCN3C)n1 2174424500 CFAUFDMXSCYLBT-OAHLLOKOSA-N 268.364 2.216 10 10 CECE CN[C@H]1CCCc2cc(N(C)C[C@H]3CCN3C)ccc21 2186457935 OUDKYJIASOYQCQ-WBVHZDCISA-N 273.424 2.424 10 10 CECE CN(C)c1ccc([C@H](O)[C@H](N)c2ncccc2F)cc1 2191147542 NVMUPCRKMZAKHS-HIFRSBDPSA-N 275.327 2.020 10 10 CECE COc1cc(CN2CCC[C@H]2CN=[N+]=[N-])cc(OC)n1 2179618622 ZCFHLCJHPCHERU-NSHDSACASA-N 277.328 2.374 10 10 CECE CN(CCC1(C)CC1)CC(=O)N(C)c1ccc(N)cc1 2179767671 RNKWBCDSKAKVNR-UHFFFAOYSA-N 275.396 2.354 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@H](C4(O)CC4)C3)ccc21 2187050452 HJLKANSHEDWCAG-CJNGLKHVSA-N 272.392 2.245 10 10 CECE CCCNCc1ccc(N2[C@H]3C[C@H]2CN(C)C3)cc1C 2187618960 CSUOQAMMBCYGSI-IRXDYDNUSA-N 273.424 2.387 10 10 CECE Cc1nnc2ccc(CN3CCC[C@@H](N=[N+]=[N-])C3)cn12 2187798592 GNTLQWWIMFGSRH-GFCCVEGCSA-N 271.328 2.312 10 10 CECE CN(c1ccc(CO)cc1Cl)[C@H]1CC(=O)N2CCC[C@@H]12 2188482720 FPBRWXVULKXAFD-KBPBESRZSA-N 294.782 2.032 10 10 CECE Nc1cc2c(cc1N1CC[C@]13C[C@@H](CF)C3)OCCO2 2182281162 QJYOTTDEOJTWGD-LGZQZNNBSA-N 278.327 2.368 10 10 CECE C[C@@H](Nc1ncccc1S(C)(=O)=O)c1ccccc1O 2192619216 FFHPYLBADLJJFQ-SNVBAGLBSA-N 292.360 2.364 10 10 CECE COCc1nc([C@H](N)c2ccc3c(c2)CCN3C)cs1 2188773263 LIWKNMMEPKGWKU-OAHLLOKOSA-N 289.404 2.330 10 10 CECE C[C@H]1CC(NC(=O)c2cc(O)c(O)c(O)c2)C[C@H](C)C1 2188874645 JIQVEYGKNRRSIR-RKDXNWHRSA-N 279.336 2.358 10 10 CECE C[C@]12CCCC[C@@H]1CN2C(=O)c1cc(O)c(O)c(O)c1 2188868267 OEGZWEYUMQZHLR-BMIGLBTASA-N 277.320 2.208 10 10 CECE CC(F)(F)[C@H]1CCCN1C(=O)c1cc(O)c(O)c(O)c1 2188923405 KXEOFDDETGLNSW-SNVBAGLBSA-N 287.262 2.063 10 10 CECE CCCN[C@@H](C)c1cnc(Sc2nncn2C)s1 2041815238 RFCNFOIHQBQPML-QMMMGPOBSA-N 283.426 2.483 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ncoc1C(F)F 2042247957 VKLSYXDNZKOOEI-UHFFFAOYSA-N 259.216 2.433 10 10 CECE CCCN[C@@H](C(=O)OCC)c1c(O)cccc1F 2042596424 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RQOGLVXSSOBZEE-UHFFFAOYSA-N 254.761 2.087 10 10 CECE Cc1ccc(CNC[C@H]2CCNC2)c(O)c1Br 2307478933 CTXJEKRCTVOASL-JTQLQIEISA-N 299.212 2.162 10 10 CECE CS[C@H](C(=O)N(C)Cc1ccccc1O)C1CC1 2314314195 SGKCIHONBYNMHD-ZDUSSCGKSA-N 265.378 2.492 10 10 CECE CCN(CCN=[N+]=[N-])C[C@H](O)c1cccc(F)c1 2315992127 HQPZBCPMMYUQAH-LBPRGKRZSA-N 252.293 2.491 10 10 CECE CSc1cc(N2CC[C@H]([C@H](C)O)C2)ccc1CN 2328545300 XSZWYGUUOCFQGN-JQWIXIFHSA-N 266.410 2.074 10 10 CECE CNCc1ccc(OC)c(CN2C[C@@H]3CC[C@H]2C3)c1 2330087006 QVPFMYAUZDSCCP-HIFRSBDPSA-N 260.381 2.399 10 10 CECE C[C@H]1CCC[C@@H](C(=O)N[C@@H](C)c2ccccc2O)N1 2332172657 IQDVPCJIIBRPSN-GVXVVHGQSA-N 262.353 2.100 10 10 CECE C[C@@H](NCCN1CC[C@@H]2C[C@@H]21)c1ccc(F)cc1O 2334904839 ATHMUWSFGCMSER-GYSYKLTISA-N 264.344 2.276 10 10 CECE CC12CC(C1)[C@@H](C(=O)N1CCC[C@@H](N=[N+]=[N-])C1)CO2 2337659073 FTPKYDSNRPCNQH-ZUXSNHBTSA-N 264.329 2.103 10 10 CECE Cc1c([C@@H](C)O)ccc(N(C)[C@H]2CCN(C)C2)c1C 2340850487 HQMJJOSDJLTCTE-KGLIPLIRSA-N 262.397 2.497 10 10 CECE Nc1ccc(CNCc2ncc3ccccn23)cc1 2352563293 YIRSQTXTOIKWKD-UHFFFAOYSA-N 252.321 2.206 10 10 CECE CN(C)c1ccc(CNC[C@@H]2O[C@H]3CC[C@H]2C3)cc1 2352701218 PFWDYXLHVIILQD-BPUTZDHNSA-N 260.381 2.410 10 10 CECE CC(C)N[C@](CSc1nccs1)(C(N)=O)[C@H]1C[C@@H]1C 2353000789 GPJISDQQPTVJRM-KWBADKCTSA-N 299.465 2.113 10 10 CECE Nc1ccc(Nc2ccc(N[C@@H]3CCCO3)nn2)cc1 26444442 XCDWXNJIHJSFIX-AWEZNQCLSA-N 271.324 2.351 10 10 CECE CN[C@H](C)c1ccc(N2CC(OC)C2)c(Cl)c1 310329525 YAXLJYLRPFFJSR-SECBINFHSA-N 254.761 2.455 10 10 CECE CNC(=O)Nc1ccc(NCc2ccc(O)cc2O)cc1 37135598 HUTONQGHNOCMML-UHFFFAOYSA-N 287.319 2.461 10 10 CECE COc1cc(Br)c([C@@H](C)N)c(O)c1OC 218926188 KMWIMLKHQQCWHC-RXMQYKEDSA-N 276.130 2.192 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@]2(CCO)CCOC2)c1 185777045 IATOOUWEXZQOHM-BBRMVZONSA-N 279.380 2.140 10 10 CECE C[C@@H](NCC(C)(C)N(C)C)c1c(O)cccc1O 235206316 NEVWXZFYMTWGFV-SNVBAGLBSA-N 252.358 2.089 10 10 CECE CCN1C(=O)/C(=C/c2cccc(O)c2)C(C(=O)OC)=C1C 33286529 VOSXUWZXVGBMNR-UKTHLTGXSA-N 287.315 2.085 10 10 CECE CNC[C@H]1CCN(C2CC2)[C@@H]1c1ccc(N(C)C)cc1 70284095 DJMKJHBXPWSKQD-RHSMWYFYSA-N 273.424 2.497 10 10 CECE COC(=O)[C@H]1CCN1c1ccc(OC)c(Cl)c1 130882014 NPUPZWSIJAEAGB-SNVBAGLBSA-N 255.701 2.100 10 10 CECE C[C@@H](NCCNC(=O)c1ccccc1)c1ccccc1O 183462851 ABLBDVIBRBUZEC-CYBMUJFWSA-N 284.359 2.473 10 10 CECE COc1cc(F)ccc1NC(=O)COc1ccc(N)cc1 49562854 SRPOBIAHJUCCMO-UHFFFAOYSA-N 290.294 2.434 10 10 CECE CCN(C[C@H]1CCOC1)C(=O)CCc1ccc(N)cc1 40333067 REVSHZGBZSNRJQ-CQSZACIVSA-N 276.380 2.086 10 10 CECE Oc1cccc(Cl)c1CN1CCO[C@]2(CCCOC2)C1 289326758 GJEZELWNIZIPAE-OAHLLOKOSA-N 297.782 2.427 10 10 CECE CCCCOCCOC(=O)COc1ccc(N)cc1 48671461 MGAZQRGNYFTNRQ-UHFFFAOYSA-N 267.325 2.008 10 10 CECE Nc1ccc(OCCCn2nnc3c2CCCC3)cc1 62430383 CTSGKPOIPUTMQB-UHFFFAOYSA-N 272.352 2.208 10 10 CECE COc1ccc(O)c(CNCC(F)(F)C(F)F)c1 191774646 RKDQSBHKNHDPJI-UHFFFAOYSA-N 267.222 2.391 10 10 CECE CC(C)c1nc(NN)cc(Sc2nccs2)n1 87917154 MEUHIKULJOOKCR-UHFFFAOYSA-N 267.383 2.493 10 10 CECE CCOc1cccc(CN2CCCC[C@H]2CC(N)=O)c1O 92588615 DLOLYZLRYNPFNA-ZDUSSCGKSA-N 292.379 2.021 10 10 CECE CN(C)c1ccc([C@H](N)CCc2cnn(C)c2)cc1 231001121 ISNKOIQHFWJDST-OAHLLOKOSA-N 258.369 2.119 10 10 CECE CC(C)(CO)[C@H](N)c1c(O)cccc1Br 238122250 WIZMZMFXTWTGEM-SNVBAGLBSA-N 274.158 2.173 10 10 CECE CCN(Cc1cc(F)ccc1O)C[C@@H]1CCCN1 233511446 CRONPJKWYKWZMD-ZDUSSCGKSA-N 252.333 2.105 10 10 CECE NCC1(c2c(O)c(O)cc(Br)c2F)CCC1 258653346 VQFPGEIFHMZLAM-UHFFFAOYSA-N 290.132 2.380 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1CCCC[C@@H]1O 131908441 VWPMXEVSHUXUMJ-STQMWFEESA-N 263.341 2.036 10 10 CECE C[C@@H]1C[C@H]1N1C[C@@H](NCc2cccc(Cl)c2O)CC1=O 378455492 REFQNOTYXDPTPT-SUZMYJTESA-N 294.782 2.145 10 10 CECE CO[C@@H]1C[C@@H](OC)CN(c2ccc3c(c2)CCCN3)C1 2165497071 WHMKYMQYDXSOPC-HUUCEWRRSA-N 276.380 2.285 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@@H](C)N)cc2F)C1 2165505407 FACKDJRSJWLOQB-WXHSDQCUSA-N 282.359 2.086 10 10 CECE COc1cc(C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)ccn1 2166947934 GZIDNABXSGMCJM-SNVBAGLBSA-N 275.312 2.253 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@]1(C)CNC[C@@H]1C 702046520 VAYCUOBSGDRFQA-MKBNYLNASA-N 276.380 2.157 10 10 CECE C[C@@H]1CN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1C 292869469 AWHOCYBOBLMSSA-ZIAGYGMSSA-N 289.423 2.051 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2C[C@@H]3CCC[C@@H]3C2)cc1 2165089795 XZRCFOXNMTXTGK-IMRBUKKESA-N 274.364 2.343 10 10 CECE CCN(CC(=O)N(C)C)c1ccc([C@@H](C)N)cc1Cl 723195109 IRCVJCZMEZWURZ-SNVBAGLBSA-N 283.803 2.274 10 10 CECE Cc1cc(N2Cc3ccc(CO)cc3C2)ccc1CN 2167514612 YOCVYGGAFSBJNF-UHFFFAOYSA-N 268.360 2.466 10 10 CECE O=C(NCc1ccccc1O)[C@H]1CCc2cccc(O)c21 815833645 XPQMXVOPLXLZIG-ZDUSSCGKSA-N 283.327 2.444 10 10 CECE Oc1ccc(C(F)(F)F)cc1[C@@H](CF)N1CCNCC1 575285027 IHJJZHTVRFWXAP-LLVKDONJSA-N 292.276 2.327 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1C[C@H]2[C@@H]1[C@H]1CC[C@H]2O1 2132233758 UHDQETAXMVTWIM-BBIZWXPBSA-N 263.312 2.187 10 10 CECE CCCN[C@H](C)c1ccc(N(C)CCC(N)=O)cc1 723151209 VJJRRGNZIDWSEP-GFCCVEGCSA-N 263.385 2.059 10 10 CECE CCCN(CC(=O)NC)c1ccc([C@@H](C)NCC)cc1 723182674 KKIKTTRJAGDRMX-CYBMUJFWSA-N 277.412 2.320 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)C(F)(F)F)C1 725449267 PNVLONABNQIWNE-SSDOTTSWSA-N 250.224 2.488 10 10 CECE COc1ccc(O)c(CN2CCCC[C@]3(CCNC3)C2)c1 903959435 HYIHXOTYYICKGO-QGZVFWFLSA-N 290.407 2.366 10 10 CECE CN(C)c1ccc(/C=C\CN[C@H](CO)C2CC2)cc1 835039334 DIKSSRWORDNBSI-MJSXRHKHSA-N 260.381 2.126 10 10 CECE O=C(O)C1(C(=O)NCc2ccccc2O)CC2(CCC2)C1 911326923 ARVXNIOEXDREKJ-UHFFFAOYSA-N 289.331 2.044 10 10 CECE COCCCCC(=O)NCc1ccc2cccnc2c1O 843514733 ULILACVYJBYVNN-UHFFFAOYSA-N 288.347 2.373 10 10 CECE CO[C@@](C)(CO)CN[C@@H](C)c1cc(Cl)cc(C)c1O 848556434 XQOUSSMAVCHTFO-IINYFYTJSA-N 287.787 2.402 10 10 CECE CCN(C[C@H](COC)OC)c1ccc(OC)cc1 851827952 KKGDPTXLKRPFLK-CQSZACIVSA-N 253.342 2.183 10 10 CECE Nc1ccc(C[C@@H](O)c2cc(Cl)cnc2N)cc1 696556876 NARNFBQDGLHDQR-GFCCVEGCSA-N 263.728 2.176 10 10 CECE COC(=O)c1cc(OC[C@H]2CCCCO2)ccc1N(C)C 865396242 NGECFUUUBJZZPJ-CYBMUJFWSA-N 293.363 2.487 10 10 CECE CO[C@@H](C(=O)NCc1ccc2cccnc2c1O)C(C)C 862027549 WONHZOHMEUBMGL-OAHLLOKOSA-N 288.347 2.228 10 10 CECE COC/C(C)=C\C(=O)NCc1ccc2cccnc2c1O 862024851 IRWNSLSBZZDAPE-FLIBITNWSA-N 286.331 2.149 10 10 CECE C[C@H](NC(=O)c1cc(Cl)n(C)n1)c1ccccc1O 1171730203 LZMPTQVGHCUQLK-QMMMGPOBSA-N 279.727 2.270 10 10 CECE C[C@H]1OC2(C(=O)N3CCC[C@H](N=[N+]=[N-])CC3)CC1C2 1878416997 ZISIQJXKWOPFFU-JJOYANBFSA-N 264.329 2.245 10 10 CECE CN(C)c1ccc(CNc2nccn3ccnc23)cc1 891577958 HZGVWXUPKWIUHI-UHFFFAOYSA-N 267.336 2.407 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)CC2CN(C)C2)c(F)c1 1880478902 JBPFSEIXWHPCBD-SECBINFHSA-N 270.323 2.016 10 10 CECE O=C(N[C@@H](c1cccnc1)C1CC1)c1cccc(O)c1O 790904926 HXLIWRSTSDYPPM-CQSZACIVSA-N 284.315 2.374 10 10 CECE CC(=O)N1CCCN([C@H](C)c2ccc(C)cc2O)CC1 133274200 LCQBBGQDZWIMFQ-CYBMUJFWSA-N 276.380 2.316 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H]3COC[C@@H]32)c(F)c1 1899114483 ZTIZIKVJTUUXJB-ZDMBXUJBSA-N 268.307 2.210 10 10 CECE O=C(NCc1c(O)cccc1F)c1cccc2c1OCC2 1156178023 SGXYTTKNPPGZQC-UHFFFAOYSA-N 287.290 2.396 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CC[C@H](CCC(=O)O)C1 134705178 SOBAAPYAEVGROB-QWRGUYRKSA-N 279.336 2.346 10 10 CECE COc1ccc(CNC[C@H]2CN3CCC2CC3)cc1C 1963438454 JROMEVUOOJPRPW-INIZCTEOSA-N 274.408 2.435 10 10 CECE CNCc1nc2cc(O)ccc2n1Cc1ccc(N)cc1 76044929 XBCWGUXSNUWJEY-UHFFFAOYSA-N 282.347 2.092 10 10 CECE C[C@@H]1CC[C@H](C(=O)NCCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1885562995 NTQXHEZCIHSQIY-NXEZZACHSA-N 297.359 2.201 10 10 CECE O=C(O)[C@@H](NCc1ccccc1)c1ccccc1O 166113358 WCZOOBBOSNDONN-AWEZNQCLSA-N 257.289 2.308 10 10 CECE CC(C)[C@H]1C[C@H](NCc2cc(F)ccc2O)CO1 691462896 NJOCSFJXIAPRTK-GXTWGEPZSA-N 253.317 2.434 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@H]1CCCSC1 394058451 VRCYHSVADWCJOQ-QWRGUYRKSA-N 286.401 2.351 10 10 CECE C[C@H](NC[C@]1(C)CCCO1)c1cc(O)ccc1O 94797145 FYKVKNCSURQGBT-HZMBPMFUSA-N 251.326 2.318 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CCC12CCCC2 694382110 HNJFEJDGKFRNNG-LBPRGKRZSA-N 252.318 2.454 10 10 CECE O=C1Nc2cc(N3CCC[C@H]3C3CC3)c(F)cc2[C@H]1O 706449266 LTZAQIFGBSDCBI-GXTWGEPZSA-N 276.311 2.190 10 10 CECE C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963705054 YJDAOLLBVBEJPT-JTQLQIEISA-N 299.375 2.306 10 10 CECE O=C(NCc1cccc(O)c1O)c1cc2ncccc2o1 1176576255 IJQGRJBSDLSTNX-UHFFFAOYSA-N 284.271 2.169 10 10 CECE Nc1ccc(CCNC[C@@]23CCC[C@@H]2OCC3)cc1 687484050 RCWAHXXDEHPQFN-HOTGVXAUSA-N 260.381 2.360 10 10 CECE Nc1ccc(OCCNC(=O)C23CCC(CC2)C3)cc1 710885189 DQVLUYWKXYLSCS-UHFFFAOYSA-N 274.364 2.344 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](COC)C2)c(F)c1 83907379 GRCWXFBKDPJTQC-SNVBAGLBSA-N 270.323 2.157 10 10 CECE Oc1c(Cl)cccc1CNCC12CCN(CC1)C2 716126895 VMOPPVXGQQNCKI-UHFFFAOYSA-N 266.772 2.231 10 10 CECE CCC[C@@H](CCO)N[C@@H](C)c1ccc(O)cc1O 716884791 JSPDVPGHDCNLOH-QWRGUYRKSA-N 253.342 2.300 10 10 CECE CN[C@H](C)c1ccc(N2CC([C@H](C)O)C2)c(Cl)c1 719751591 CVFNOZCYDBPDBI-ZJUUUORDSA-N 268.788 2.437 10 10 CECE CCOc1cccc(CN2CCO[C@@H](C)CC2)c1O 720492030 AYIPTVIHCCBOQQ-LBPRGKRZSA-N 265.353 2.402 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2CC[C@@H]3CCC[C@H]32)cc1 722053844 AASYUQWXNYAOFF-NILFDRSVSA-N 274.364 2.343 10 10 CECE c1cc2c(cc1N1CC[C@@H](NC3CC3)C1)OCCCO2 71197821 BNTZLEHHHIJETM-CYBMUJFWSA-N 274.364 2.179 10 10 CECE CC[C@@H](C(=O)OC)N(Cc1ccc(N)cc1)C(C)C 695048088 IEJZBVLWZCUHOL-AWEZNQCLSA-N 264.369 2.431 10 10 CECE C[C@H](NCc1cnn2c1CCC2)c1ccccc1O 877758384 XGBNTKNCYPZDDY-NSHDSACASA-N 257.337 2.386 10 10 CECE CN(CCCC(=O)NCCCN=[N+]=[N-])C(=O)OC(C)(C)C 1885562300 DHNAGEJKPHDDKJ-UHFFFAOYSA-N 299.375 2.450 10 10 CECE O=C(CCc1ccc(O)cc1)NCc1cccc(O)c1O 1471642114 KPVSPAAELPIOSV-UHFFFAOYSA-N 287.315 2.052 10 10 CECE CCN1CCc2cc([C@@]3(O)C=C[C@H](OC)C3)ccc21 2119416405 FEQAYOMYOHBNOF-GOEBONIOSA-N 259.349 2.232 10 10 CECE Cc1ccc(N2NC(=O)/C(=C\c3ccco3)C2=O)cc1 440004 NFLVKABPPHCIKP-UKTHLTGXSA-N 268.272 2.049 10 10 CECE CCCC[C@@H](O)CCC(=O)NCCc1ccc(O)c(O)c1 1545669368 XILKWBMXVQPWAA-CYBMUJFWSA-N 295.379 2.088 10 10 CECE CCNCc1ccc(N2C[C@@H](F)[C@@H](CO)C2)c(Cl)c1 2120632396 VSZXBDAPNINARY-DGCLKSJQSA-N 286.778 2.216 10 10 CECE COc1ccc(N2CC[C@@H](CON)C2)cc1Cl 215574961 OVCYKLQHIBVGCH-SECBINFHSA-N 256.733 2.065 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)OCCO3)[C@H](C)CN1 216876056 XDAPXRPCPJHTAG-VXGBXAGGSA-N 262.353 2.035 10 10 CECE C[C@H](O)c1ccc(N(C)CCCCN(C)C)cc1O 2121433257 OZGUQDVHNLBHRZ-LBPRGKRZSA-N 266.385 2.224 10 10 CECE CC(C)N(Cc1cncnc1)c1ccc(CN)cc1 2122287894 FXRBUNYWGKTRJE-UHFFFAOYSA-N 256.353 2.350 10 10 CECE Oc1cc(Cl)ccc1CN[C@@H]1CO[C@]2(CCOC2)C1 2122450968 YLCOTOICDGLTIP-GXTWGEPZSA-N 283.755 2.083 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCOC[C@H]1CCCCO1 2123020981 YEQOKMPVWBXIBT-QWHCGFSZSA-N 268.361 2.347 10 10 CECE COCc1ccnc(N(C)Cc2ccc(N)cc2)c1 1909315898 DBHFGDABMFPAAB-UHFFFAOYSA-N 257.337 2.447 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1CC[C@@H]2[C@@H](C1)C2(F)F 1652628946 QDWUCNUKAZXXDC-FBIMIBRVSA-N 297.301 2.395 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@@H]2CC[C@H](C1)O2 2124898816 INVAKLMPWHKPPL-ZSBIGDGJSA-N 263.337 2.200 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C2C[C@@H]3CC[C@H](C2)O3)CC1 2124926287 LEUOVSVWQIYMAU-FGWVZKOKSA-N 264.329 2.151 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1N(C)Cc1ccc(F)cc1O 1964576503 XDFAPCWMWDQQQT-RISCZKNCSA-N 266.360 2.303 10 10 CECE C[C@H]1CN([C@@H](C)C(=O)Nc2ccc(N)cc2)CCS1 137111703 OPQUULIZYMHNGK-QWRGUYRKSA-N 279.409 2.033 10 10 CECE CN1CCc2cc(CN[C@H]3CCN4CCC[C@@H]4C3)ccc21 157433804 QYXGIRHKZFNVIR-DLBZAZTESA-N 285.435 2.395 10 10 CECE Cc1ccc([N+](=O)[O-])cc1/N=N/N1CCOCC1 1860484140 ZOSTXVLPIOTRCS-OUKQBFOZSA-N 250.258 2.234 10 10 CECE Nc1ccc(Cc2nc3ccccc3n2CCO)cc1 19734510 KKHGAJZUNOGADO-UHFFFAOYSA-N 267.332 2.202 10 10 CECE C[C@H]1C[C@@H](C)CN(CC(=O)Nc2ccc(N)cc2)C1 22178252 HOJDOBJURZCKKH-TXEJJXNPSA-N 261.369 2.185 10 10 CECE COc1cc(C)c(N(C)CC2(CO)CC2)cc1OC 258976915 UHPMXPLTIOGKPF-UHFFFAOYSA-N 265.353 2.221 10 10 CECE CCOC(=O)CN(C)c1c(C)cc(OC)cc1OC 259061041 KVFRXUUFRKEJED-UHFFFAOYSA-N 267.325 2.012 10 10 CECE CC1(C)C[C@@H](N)CCN1c1ccc2c(c1)OCCO2 259187312 BJRQLRQUUCNQIA-NSHDSACASA-N 262.353 2.164 10 10 CECE N[C@@H]1CCCc2cc(N3CCCC[C@@H]3CO)ccc21 2128268806 LGVDAZKRMQCQPS-GDBMZVCRSA-N 260.381 2.374 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3N)[C@H]1CO 2128269558 TVRPSSROJWGZBT-RLCCDNCMSA-N 260.381 2.230 10 10 CECE CC1(C)C[C@H](O)CCN1c1ccc2c(c1)CC[C@H]2O 2128315017 NESUZIBVPDAGHI-UKRRQHHQSA-N 261.365 2.406 10 10 CECE CN(C[C@H]1OCC[C@H]1F)c1ccc2c(c1)CC[C@H]2O 2128321565 JEZCJUAZDAZOCU-RBSFLKMASA-N 265.328 2.229 10 10 CECE CN(C)c1ccc(CN2CCC[C@@]23CCCNC3)cc1 1222237481 KYPKCEJKHZJBJH-QGZVFWFLSA-N 273.424 2.471 10 10 CECE CCOC12CC(C1)N(C(=O)Nc1ccc(N)cc1)C2 2129020918 KBTWZTKAEQYARF-UHFFFAOYSA-N 261.325 2.054 10 10 CECE NCc1cc(F)c(N2CC[C@@H](O)[C@H]2C2CC2)cc1Cl 2130612143 QCNZYMNACJLIHK-ZIAGYGMSSA-N 284.762 2.287 10 10 CECE Cc1cocc1CN(C)C(=O)Cc1ccc(N)cc1 2129918233 CTDDRCZMLZMBSE-UHFFFAOYSA-N 258.321 2.371 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3C[C@@H]3COC)ccc21 2133502280 UTUCZHODMQTHOZ-YCPHGPKFSA-N 260.381 2.351 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)N(C)CCCN=[N+]=[N-] 1912177670 KMIKWFYZAHLCEI-GRYCIOLGSA-N 267.377 2.407 10 10 CECE COC[C@@H]1C[C@H](O)[C@H](N2CCCC[C@@H](CN=[N+]=[N-])C2)C1 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CCOC(=O)C(C)(C)[C@@H](N)c1cc(C)ccc1O 1951844705 SADHBECVHJRRLS-LBPRGKRZSA-N 251.326 2.290 10 10 CECE CCOC(=O)[C@@H](COc1ccc(N)cc1)C(F)(F)F 1952371289 DTGOXALDDVTGHS-SNVBAGLBSA-N 277.242 2.389 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N3CCCC(C)(C)C3)cc21 131397538 WHSBXZAJADXFLG-CQSZACIVSA-N 273.380 2.289 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CCCC(C)(C)C3)cc21 131397757 WHSBXZAJADXFLG-AWEZNQCLSA-N 273.380 2.289 10 10 CECE CCc1cccc(CN2CCOC[C@@H]2C(F)F)c1O 1971847376 SKRLGADONJQGSZ-GFCCVEGCSA-N 271.307 2.421 10 10 CECE CCOCc1nc(CN(C)CCN=[N+]=[N-])cs1 2003715119 HZKYOHCFVDMFBR-UHFFFAOYSA-N 255.347 2.422 10 10 CECE C[C@@H](O)[C@@H]1CCN(c2ccc(CNC3CC3)cc2F)C1 167888231 PNHDIUGJOVCTDH-DGCLKSJQSA-N 278.371 2.285 10 10 CECE CCN(CC)C(=O)[C@H](C)N[C@@H](C)c1ccc(O)cc1O 37126648 PADKIHVENXUIMI-QWRGUYRKSA-N 280.368 2.005 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2CCCN(C)C 162130708 ULWCWJLQYOMGGV-ZDUSSCGKSA-N 261.413 2.281 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@@H](C)NCCCN)c1 37713334 ANWUMJUHLDUABE-LLVKDONJSA-N 279.384 2.130 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1ccccc1OC 2148153537 GKFGAXRRUOOLKD-HOTGVXAUSA-N 273.332 2.395 10 10 CECE CN[C@@H](c1ccccc1O)[C@@](C)(O)c1cncc(F)c1 2148166083 VIGFDUPEHKJNQT-GJZGRUSLSA-N 276.311 2.095 10 10 CECE C[C@H](CNCc1ccc(O)c(O)c1)N1CCCCC1 38028343 DPYBNXVTOHRODI-GFCCVEGCSA-N 264.369 2.062 10 10 CECE CCc1cccc(CN[C@H]2CC[C@H](S(C)(=O)=O)C2)c1O 2145410517 GARJWDLKXBPWJT-KBPBESRZSA-N 297.420 2.010 10 10 CECE N=c1nc(Sc2nccs2)c2c([nH]1)CCCC2 1996439104 HEKPTGVZLDSKIY-UHFFFAOYSA-N 264.379 2.376 10 10 CECE C[C@@]1(C(F)(F)F)C[C@H]1C(=O)NCCCN=[N+]=[N-] 1998660963 MAHHQQJUWMBWOF-POYBYMJQSA-N 250.224 2.392 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@](=O)c1cccs1 40968230 AMWVJENQQLOPRD-AYLIAGHASA-N 294.401 2.465 10 10 CECE CCN(CC)[S@](C)(=O)=NCc1ccc(N)cc1 2002254461 QTNZDYIQMRBCNF-QGZVFWFLSA-N 255.387 2.123 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1[C@H](N)[C@H](O)c1ccc2c(c1)CCCN2C 2150906488 JPTFOVAUWVQGSM-RSDOZLEWSA-N 274.408 2.332 10 10 CECE Oc1cccc(CN[C@H]2CCC[C@H]2n2ccnc2)c1O 41117436 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[N-]=[N+]=N[C@H]1CCCN(C(=O)c2c(O)cccc2O)CC1 2155555940 OYQNVLYJWACFON-VIFPVBQESA-N 276.296 2.403 10 10 CECE CN(CC1CCC1)C(=O)CCOc1ccc(N)cc1 61454321 CZDURVSSZAJEQT-UHFFFAOYSA-N 262.353 2.296 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@@H]1CCC(F)(F)C1 2156092974 HJSIBLLGASPITJ-SNVBAGLBSA-N 285.290 2.400 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2C[C@@H]3COC[C@@H]3C2)cc1O 2156141851 JLGIWUBVBQTVFJ-CIQGVGRVSA-N 277.364 2.307 10 10 CECE CC1(C)CN(CC(=O)Nc2ccc(N)cc2)CC1(F)F 2158380295 AIXMGFJMXRXZIM-UHFFFAOYSA-N 283.322 2.184 10 10 CECE Cc1cc(N2C[C@H](C)C[C@@H](O)C2)ccc1CNC1CC1 401495199 JOEGJVLSPVCNHE-SJKOYZFVSA-N 274.408 2.454 10 10 CECE Oc1cccc2c1[C@H](N1CCN(CCCF)CC1)CC2 402836715 JFGYNFOSUFUKDA-CQSZACIVSA-N 278.371 2.357 10 10 CECE CCOc1cccc(CN[C@@H]2CO[C@H](C)[C@@H]2C)c1O 405786570 RBPIMTMWCOSDOU-DMDPSCGWSA-N 265.353 2.304 10 10 CECE CC[C@H]1CN(CCOc2ccc(N)cc2)CCCO1 311259726 JNJBSEZSMHFVPH-AWEZNQCLSA-N 264.369 2.149 10 10 CECE CC(C)Oc1cnn(CCOc2ccc(N)cc2)c1 311469095 QLTZHDNDBLMYPY-UHFFFAOYSA-N 261.325 2.332 10 10 CECE COc1ccc(N2C[C@H](C)[C@](C)(CN)C2)c([N+](=O)[O-])c1 312293760 MIPFMGWBLQTCAT-IINYFYTJSA-N 279.340 2.025 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@@H]2C[C@H](CN)C3)cc1 2159211304 PWSMTRFHQDERFX-ACHSLPGTSA-N 273.424 2.454 10 10 CECE C[C@H](C1CCC1)N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 325520806 JWJMYLBHHWFZAY-MEBBXXQBSA-N 273.380 2.288 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2cn(C)cn2)c(F)c1 2160355061 PTASVYVBUCGOQR-NSHDSACASA-N 276.359 2.476 10 10 CECE CNCc1ccc(OC)c(CN(C)Cc2ccon2)c1 2160448950 XVSJMUQLBVRIHI-UHFFFAOYSA-N 275.352 2.035 10 10 CECE COc1cccc(O)c1CN1C[C@@H]2[C@@H](CC[C@H]2OC)C1 2160736912 TVVWODOSMKRFFX-HWWQOWPSSA-N 277.364 2.258 10 10 CECE Nc1ccc(CS(=O)(=O)NC2(C3CC3)CCCC2)cc1 2161138300 UPZSIPRZQXNMGQ-UHFFFAOYSA-N 294.420 2.411 10 10 CECE CC[C@@H](O)c1ccc(N2CCC[C@H](OCCO)C2)cc1 2170214348 TWXPOTNMUAWNDI-JKSUJKDBSA-N 279.380 2.108 10 10 CECE C[C@H](NCC(C)(C)S(C)(=O)=O)c1ccc(N(C)C)cc1 93520306 PYZQHVDUVUMQEE-LBPRGKRZSA-N 298.452 2.226 10 10 CECE CC(C)(CNCc1ccc(F)c(F)c1O)n1ccnc1 703327140 GMJATNWBYRLZMG-UHFFFAOYSA-N 281.306 2.392 10 10 CECE Cc1cccc(CN[C@H](C)CS(=O)(=O)C(C)(C)C)c1O 2170588229 KACDZXMFZPEAJW-GFCCVEGCSA-N 299.436 2.392 10 10 CECE CC[C@H]1CN(c2ccc(OC)cc2N)C[C@H](C)O1 689066005 GXMBHZQCZKHKQG-QWRGUYRKSA-N 250.342 2.281 10 10 CECE CN(C)Cc1ccc(C(=O)NCCCN=[N+]=[N-])cc1 706100893 GSIMHFLQDXDVDB-UHFFFAOYSA-N 261.329 2.178 10 10 CECE CC[C@@H](O)c1ccc(N2CCNC(=O)CC2(C)C)cc1 708164245 AVNDCTMLPARNHD-CQSZACIVSA-N 276.380 2.235 10 10 CECE CCN(Cc1ccoc1)c1ccc2c(c1)NC(=O)[C@@H]2N 708332576 KPWMWXCXSQLEME-CQSZACIVSA-N 271.320 2.258 10 10 CECE Oc1c(F)cc(F)cc1CNCc1cncc(F)c1 708555921 QBDPNSFOJCSBJP-UHFFFAOYSA-N 268.238 2.494 10 10 CECE CO[C@@H]1CC[C@H](C)N(c2ccc([C@@H](C)O)c(O)c2)C1 687191457 DDUKCWPMJJBMPL-DMDPSCGWSA-N 265.353 2.449 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Br)C[C@H]1CN 708825993 RZAOKLLCSRZLRR-NXEZZACHSA-N 299.212 2.181 10 10 CECE C[C@@H]1CC[C@H](N(C)C(=O)COc2ccc(N)cc2)CS1 709760602 VTORGVFAKOZJGK-YPMHNXCESA-N 294.420 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CCc1cccc(CNc2cccn(C)c2=O)c1O 2224784952 ZDIJBBQPBHPTTH-UHFFFAOYSA-N 258.321 2.265 10 10 CECE [N-]=[N+]=NCCCCNC(=O)C[C@H](CC(=O)O)C1CC1 2225795994 SLTUEHTTWNDVOF-SNVBAGLBSA-N 268.317 2.084 10 10 CECE COc1ccc(N(C)[C@@H](C)[C@H]2CCCOC2)c(CN)c1 2235971702 FDGUSRYYLYGECC-STQMWFEESA-N 278.396 2.405 10 10 CECE CCN(C[C@H]1CCOC1)c1ccc(OC)cc1C(=O)O 2235945212 CFXMLVFJYLCATO-LLVKDONJSA-N 279.336 2.256 10 10 CECE CN(CC1CC(O)C1)c1ccc2c(c1)CCCN2C 2226657061 LERXNPXKIGCRQX-UHFFFAOYSA-N 260.381 2.276 10 10 CECE OC[C@@H]1C[C@H]2CN(c3ccc4c(c3)CCCO4)C[C@H]12 2226672041 PVDABQYNPNHSAS-YDHLFZDLSA-N 259.349 2.076 10 10 CECE O[C@@H]1CC[C@H]2CCN(c3ccc4c(c3)CCO4)[C@H]1C2 2226753784 ZTVZHTMGZZITNJ-TUKIKUTGSA-N 259.349 2.361 10 10 CECE COc1ccc(N2CCO[C@@H](C(C)(C)O)C2)cc1Cl 2226928543 CQRMNTVQGAVQMU-CYBMUJFWSA-N 285.771 2.325 10 10 CECE CO[C@H]1C[C@H](OC)CN([C@H]2CCc3cccc(O)c32)C1 2238230686 PEDFMYHHFCTJMQ-IHRRRGAJSA-N 277.364 2.115 10 10 CECE C[C@H](N)c1cc(F)c(N2[C@H]3CC[C@@H](O)[C@H]2CC3)c(F)c1 2238208851 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C[C@H]1Cc2cc(N(C)[C@H]3CNCC3(C)C)ccc2O1 2274189648 UEZXYPSYRXWYMV-NHYWBVRUSA-N 260.381 2.444 10 10 CECE C[C@H](N)c1ccc(N(C)Cc2ccnnc2)c(F)c1 2274308158 OXJOIUPNNRMHCJ-JTQLQIEISA-N 260.316 2.272 10 10 CECE CCc1cccc(CNCCN2CC[C@H]3C[C@H]32)c1O 2274565828 PKJPEJKEAAGBFL-DZGCQCFKSA-N 260.381 2.138 10 10 CECE CNCc1cc(F)c(N(C)Cc2nncs2)c(F)c1 2266648234 URCVVJGASYWMAE-UHFFFAOYSA-N 284.335 2.172 10 10 CECE COC[C@@H]1CC[C@H](N)[C@H](N(C)c2ccc(OC)cc2)C1 2279044216 MAAKULZVXDWZBA-UHOFOFEASA-N 278.396 2.274 10 10 CECE Cc1cc(N2CCN(C)[C@H]3CC[C@H]32)ccc1[C@@H](C)O 2269682291 WJDOUFMJENPNNG-UHOFOFEASA-N 260.381 2.331 10 10 CECE COCCN(CCOC)c1ccc([C@H](C)N)c(C)c1 2269664791 BAJZTYNEHDRLES-ZDUSSCGKSA-N 266.385 2.114 10 10 CECE Cc1cc(N2CC3(CC(CO)C3)C2)ccc1[C@@H](C)N 2269661894 IZHJSXNNUBJVFA-GFCCVEGCSA-N 260.381 2.223 10 10 CECE CCN(CCN1CCCC1)c1ccc(CO)c(OC)c1 2279834363 PJEVGWARJVJJQP-UHFFFAOYSA-N 278.396 2.110 10 10 CECE CCN(c1ccc([C@H](C)O)c(C)c1)[C@@H]1CCS(=O)(=O)C1 2285173996 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2.370 10 10 CECE CN(C[C@@H]1CCCO1)c1ccc(/C=C/C(=O)O)cc1 48949710 YYMUKVQBTSLFJY-MRZGDXHCSA-N 261.321 2.400 10 10 CECE COc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCCC2)c(O)c1 228089643 IVVLQIXFKDDFEL-RYUDHWBXSA-N 292.379 2.062 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC[C@@H](C(N)=O)C2)c(F)c1 222114885 SAHVQXKAEADXMM-WCQYABFASA-N 293.386 2.198 10 10 CECE CC(=O)NC1=NN(c2cc(Cl)ccc2Cl)C(=O)C1 144461365 HDVNAMOPDIJSAM-UHFFFAOYSA-N 286.118 2.180 10 10 CECE CCC1CCC(NCCCN=[N+]=[N-])(C(N)=O)CC1 90260174 CMDVLCCOTOLBOK-UHFFFAOYSA-N 253.350 2.101 10 10 CECE CC(C)[C@@H](CCO)N[C@@H](C)c1cc(O)ccc1O 231072541 ODBSEWIAUZWHFK-GXFFZTMASA-N 253.342 2.155 10 10 CECE CCS[C@@H]1CC[C@H](Nc2c(N)cccc2C(N)=O)C1 233843875 TXDPLGBVJTWKLT-VHSXEESVSA-N 279.409 2.454 10 10 CECE CC1(C)OC[C@@H](CNCc2cccc(Cl)c2O)O1 230210388 SUBSGNBDZZSWJR-SNVBAGLBSA-N 271.744 2.287 10 10 CECE CC(C)N1C(N)=NC[C@@]1(C)c1ccc(N(C)C)cc1 93374048 LFOQRNGGZZFWNX-HNNXBMFYSA-N 260.385 2.007 10 10 CECE C[C@@H]1CN(C)CCCN1c1ccc(/C=C/C(=O)O)cc1 235416190 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160136017 CXVLEAADJCTPPP-DNGMOHDESA-N 276.380 2.043 10 10 CECE CCCN(CCN(C)C)Cc1cccc(F)c1O 160216874 RONONNBUCMMQRQ-UHFFFAOYSA-N 254.349 2.305 10 10 CECE C[C@H](O)[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3N)C1 2128276708 FDYLITNZRYPPOS-DETPVDSQSA-N 260.381 2.230 10 10 CECE CN[C@H]1CCc2cc(N3C[C@H](O)C(C)(C)C3)ccc21 2128312169 FAYYGGPZMIRZHP-GJZGRUSLSA-N 260.381 2.100 10 10 CECE C[C@H]1CC[C@@H](CO)N(c2ccc3c(c2)CC[C@H]3N)C1 2128309187 PGMJMFUTGOQTDW-HZUKXOBISA-N 260.381 2.230 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@H]4COC[C@H]4C3)ccc21 2128321888 LJLNTUUTBMWCNB-XJKCOSOUSA-N 259.349 2.139 10 10 CECE CC1(C)C[C@H](O)CN(c2ccc3c(c2)CC[C@@H]3O)C1 2128322830 QUIBNWCRCLLSNI-ZFWWWQNUSA-N 261.365 2.263 10 10 CECE CN(C)c1ccc(NN=NCCc2cnc[nH]2)cc1 1860486644 COROGRYFGVRLTP-UHFFFAOYSA-N 258.329 2.498 10 10 CECE COc1c(O)cc2c(c1OC)C(=O)c1ccccc1C2=O 14775068 HVGBWHWYZSXFQX-UHFFFAOYSA-N 284.267 2.185 10 10 CECE biogenic,in-vitro CC(C)CN1C(=O)Cc2cc(N(C)CCC(=O)O)ccc21 259588031 ZHNMAHCXBQJEIW-UHFFFAOYSA-N 290.363 2.143 10 10 CECE Nc1ccc(OCCN2C[C@H](c3ccccn3)OC2=O)cc1 585892266 SVAOYHKAQAEKMD-OAHLLOKOSA-N 299.330 2.236 10 10 CECE CCC[C@@H]1C[C@@H](NCc2cccc(OC)c2O)CO1 2129148598 URCIZCXXAUEZOF-CHWSQXEVSA-N 265.353 2.448 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2C[C@H]1CN2C(C)C 2131021933 AUONCYGUUGFTFH-UONOGXRCSA-N 260.381 2.368 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)C2COCCOC2)c1 2131480280 DBOWIIYRNABXSD-GFCCVEGCSA-N 265.353 2.109 10 10 CECE CC[C@H](O)c1ccc(N2CC(C)(C[S@](C)=O)C2)cc1 2129780717 ALANGCXZOAAGQR-LIRRHRJNSA-N 281.421 2.335 10 10 CECE OC[C@H](NCc1ccc(Cl)cc1O)C1CCC1 1560928472 UJUBQLJZFFFZDM-LBPRGKRZSA-N 255.745 2.296 10 10 CECE COc1nn(C)cc1CN[C@H](C)c1ccc(C)cc1O 903338620 SHMJZSFIUZTLKV-LLVKDONJSA-N 275.352 2.294 10 10 CECE CCN[C@@H](c1ncc(CC)cn1)c1ccccc1O 2130556605 ZOWLPKQYHLSNAX-CQSZACIVSA-N 257.337 2.444 10 10 CECE O=C(N[C@@H]1CC12CC(F)(F)C2)c1ccc(O)c(O)c1 2132883382 MPIBBCCZMOZCJH-SNVBAGLBSA-N 269.247 2.015 10 10 CECE COC[C@@H]1C[C@H]1CNCc1ccc2c(c1)CCCO2 2133504502 MVCMKKIJFVAJPT-GJZGRUSLSA-N 261.365 2.384 10 10 CECE C[C@H](NCc1ccncc1F)c1cc(O)ccc1O 2138229742 HWCDIOJOYKUGHI-VIFPVBQESA-N 262.284 2.483 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CC(=O)N2CCCCC2)C1 1912181765 RUHVHXUKXFBNGT-CYBMUJFWSA-N 279.388 2.411 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2ccc3n[nH]cc3c2)C1 1912179531 VFNUHWHEKXVWJR-JTQLQIEISA-N 256.269 2.088 10 10 CECE CN(CCN=[N+]=[N-])C(=O)COC1(C)CCCCC1 1912167086 GMBNZZKHQIBDFT-UHFFFAOYSA-N 254.334 2.495 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2C(F)(F)C23CC3)C1 1912197104 OZFOTCUNPBIISC-SFYZADRCSA-N 256.256 2.333 10 10 CECE CSc1nc(C)nc(C)c1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 1912161600 LDYYGYARAOUZGF-SECBINFHSA-N 292.368 2.340 10 10 CECE Nc1ccc(NC(=O)NCC(F)(F)C2CC2)cc1 1912529474 AHZNZCFWJUOWES-UHFFFAOYSA-N 255.268 2.436 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CC(C)(C)CN1 1912643322 ODVJZUUVXUVQDK-DGCLKSJQSA-N 276.380 2.300 10 10 CECE Nc1ccc(CNC(=O)Cc2ccc(Cl)nc2)cc1 2138576116 KVTJCPQIWRVXFH-UHFFFAOYSA-N 275.739 2.176 10 10 CECE Cc1c(CN2CC(CCN)C2)n(C)c2ccccc12 2134809975 XPNRNIBPKBFICX-UHFFFAOYSA-N 257.381 2.267 10 10 CECE O=C(O)C=Cc1ccc(N2CC3(CCOC3)C2)c(F)c1 1915359397 AYQQLLFOFFOQRA-UHFFFAOYSA-N 277.295 2.150 10 10 CECE CCNCc1cc(F)c(N2CCC3(COC3)C2)c(F)c1 1915796042 ZVUMGARJVTXWJD-UHFFFAOYSA-N 282.334 2.301 10 10 CECE CCOc1cccc(NCc2cc(N)ccc2O)n1 110545135 CHHAJVZPUGTHNW-UHFFFAOYSA-N 259.309 2.380 10 10 CECE COCC1CN(c2ccc(C=CC(=O)O)cc2F)C1 1916883873 ZJPMWJJNXTUULV-UHFFFAOYSA-N 265.284 2.006 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1cc(O)cc(F)c1 223466581 ALXLYNIKIVUKQC-LLVKDONJSA-N 282.275 2.035 10 10 CECE Cc1cccc(O)c1CNC[C@@H]1CCS(=O)(=O)C1(C)C 1967875674 FDQKQQMLGJPIAF-LBPRGKRZSA-N 297.420 2.004 10 10 CECE Cc1cc(CN)ccc1N1CC[C@@]2(CCC[C@H]2O)C1 1918933862 JFPMBQRQFINNDY-CVEARBPZSA-N 260.381 2.195 10 10 CECE Cc1c(N(C)c2cccnc2)ccnc1C[C@@H](C)N 2140750101 BKKXDBVYAYPLIY-LLVKDONJSA-N 256.353 2.443 10 10 CECE CC(=O)c1ccc(O)c(CN(C)CCCCCO)c1 227082279 DMIVXYLYPRHMJI-UHFFFAOYSA-N 265.353 2.189 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CC[C@@H](CCC(=O)O)C1 227346728 SOBAAPYAEVGROB-GHMZBOCLSA-N 279.336 2.346 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H](F)C[C@H]1CN 1923578240 FSZHUZLDZCEJMH-GMXVVIOVSA-N 252.333 2.214 10 10 CECE CCNCc1ccc(N2C[C@H]3[C@H](O)CC[C@H]3C2)cc1 228064421 BNBSCYNKNUAGSM-NUEKZKHPSA-N 260.381 2.003 10 10 CECE Nc1ccc(CS(=O)(=O)Nc2ccc(F)c(F)c2)cc1 21519143 IHJWYCLBSGWWDB-UHFFFAOYSA-N 298.314 2.489 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC=C[C@@H]1C(=O)O 2136395268 YLMPJQSTKVBVSE-SMDDNHRTSA-N 260.337 2.139 10 10 CECE CN1CCc2cc(CN[C@H]3CCO[C@@H]3C3CC3)ccc21 230313371 KJQBIHGNFLGNFL-DOTOQJQBSA-N 272.392 2.336 10 10 CECE CC1(C)CC[C@@](O)(CNCc2cccc(O)c2O)C1 2136895705 XDTZOYLMIOVZQD-HNNXBMFYSA-N 265.353 2.129 10 10 CECE CSCCCN1CCN(c2ccc(N)cc2)C1=O 122474669 ATJMRLASFPDGAL-UHFFFAOYSA-N 265.382 2.264 10 10 CECE CNCc1ccc(N(C)[C@@H]2CC[C@H]2OC)cc1OC 2139702026 FXQCIXSPLSITJZ-ZIAGYGMSSA-N 264.369 2.028 10 10 CECE CN(C)c1ccc(CN2CC[C@@H](C(C)(C)N)C2)cc1 2139888406 WVIYAJKRNXFEHQ-CQSZACIVSA-N 261.413 2.312 10 10 CECE Cc1ccc(CN2CC[C@@H]3CN(C)CC[C@@H]32)c(O)c1 2139804626 OKPBFVRSHWKQBA-HIFRSBDPSA-N 260.381 2.227 10 10 CECE CCCN(CC(=O)NC)c1ccc(CNCC)c(Cl)c1 233038846 QBFFROILZJIQSL-UHFFFAOYSA-N 297.830 2.412 10 10 CECE CN(Cc1ncc(Cl)n1C)c1ccc(CN)cc1 1967634296 GRVNMGMLADBNTL-UHFFFAOYSA-N 264.760 2.169 10 10 CECE CN1CCc2cc([C@@H](O)[C@]34CO[C@](C)(C3)C4)ccc21 2137914688 LTSXLAXCIGHXLP-BZUAXINKSA-N 259.349 2.281 10 10 CECE Oc1cc(Br)ccc1CN[C@@H]1C[C@H]2COC[C@H]21 1940427223 WPKYYCKSCJHDJG-MVWJERBFSA-N 298.180 2.279 10 10 CECE CSc1cc(NCCOc2ccc(N)cc2)ncn1 235123057 GHCYGQJJBGFGPO-UHFFFAOYSA-N 276.365 2.272 10 10 CECE C[C@@H](NC[C@@H]1CCN(C2CC2)C1)c1c(O)cccc1O 235217394 UGONQXNJKCKMIX-NEPJUHHUSA-N 276.380 2.233 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@@H]3CCCCN3C2)cc1 1969661047 LQZMHJBLVAJHDZ-WBVHZDCISA-N 273.424 2.469 10 10 CECE COC[C@@H]1CC[C@H]1N(C)c1ccc(CN)c(OC)c1 2142413253 MONLSMRYUMECRN-GXTWGEPZSA-N 264.369 2.015 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@@H]2C(CO)[C@H]2C1 2146874231 FLQISTWNLNJYDF-GJZGRUSLSA-N 274.408 2.168 10 10 CECE CC[C@@](O)(CN(C)CCCN=[N+]=[N-])C(F)(F)F 1949780663 WVLCVXCMFYQZKE-MRVPVSSYSA-N 254.256 2.322 10 10 CECE COC(=O)CCC[C@H](N)c1cc(Cl)cc(OC)c1O 1952141847 UZQJHQUOXRCQGA-JTQLQIEISA-N 287.743 2.397 10 10 CECE CC(C)(C)OC(=O)N1CCN[C@H](c2c(O)cccc2F)C1 1952236734 PQEBHABQQARLBH-NSHDSACASA-N 296.342 2.413 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H]3[C@H](CO)[C@@H]3C2)cc1 2149509101 LNIGXJJXNQZJOV-BBWFWOEESA-N 274.408 2.249 10 10 CECE CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-] 1971514810 TXROGENAIPRNIO-JTQLQIEISA-N 299.375 2.210 10 10 CECE N[C@@H]1CCCC[C@@H]1CCC(=O)NCc1ccccc1O 2143786990 SPGFAVYHSBJNHB-TZMCWYRMSA-N 276.380 2.306 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H]3C[C@H]32)c(Cl)c1 2004410659 ATKFTIPUPMWKKO-BZHVJNSISA-N 252.745 2.337 10 10 CECE Nc1ccc(OCCC(=O)NC[C@@H]2CC[C@H]3C[C@@H]32)cc1 2144066917 YKPIRMDUNILSTF-HUBLWGQQSA-N 274.364 2.200 10 10 CECE CN[C@@H]1C[C@@H]2CC[C@H](C1)N2[C@@H](C)c1cc(O)ccc1O 2151264428 YRRYIKNNXNEHIJ-RVMXOQNASA-N 276.380 2.374 10 10 CECE CON(C)C1CN(c2ccc(C=CC(=O)O)c(Cl)c2)C1 2144620647 QBCYULJWOAKXLD-UHFFFAOYSA-N 296.754 2.120 10 10 CECE Oc1ccc(CCNCc2cc(F)ccc2O)cc1O 2148013400 VKOPUGOOFQOLOH-UHFFFAOYSA-N 277.295 2.275 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CC(C)(C)OC1(C)C 2148146220 CCPNWSXHWKAWJG-CZUORRHYSA-N 279.380 2.361 10 10 CECE CCOC(=O)c1cccc(O)c1CN(CC)CC 261065065 NRHBHRLPOAYBOA-UHFFFAOYSA-N 251.326 2.411 10 10 CECE CN1CCC(N(C)c2ccc(CNC3CC3)cc2)CC1 34823853 RZSNHRKNXYERLW-UHFFFAOYSA-N 273.424 2.469 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1ocnc1C 159284606 AANGVLRDKRLGTG-UHFFFAOYSA-N 259.309 2.228 10 10 CECE Nc1cccc(Br)c1N[C@@H]1C[C@H]2CNC[C@H]21 1989322692 INWABJLUXCGFTG-VAOFZXAKSA-N 282.185 2.051 10 10 CECE Nc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)cc1 36283946 BWZZDIYYDKSONX-UHFFFAOYSA-N 284.287 2.348 10 10 CECE C[C@@H]([C@@H]1CCCO1)S(=O)(=O)CCCc1ccc(N)cc1 2145513412 JSSVHZYGOKMULS-WFASDCNBSA-N 297.420 2.184 10 10 CECE CC(=O)c1cc(F)cc(CN(C)Cc2csnn2)c1O 2150281798 MSEXXUIEEAKQSZ-UHFFFAOYSA-N 295.339 2.217 10 10 CECE NCc1ccc(N2CC3(CC(O)C3)C2)cc1C(F)(F)F 2146324887 ZVZGOQXMACQZBR-UHFFFAOYSA-N 286.297 2.125 10 10 CECE CO[C@H]1CN(Cc2ccc(Cl)cc2O)[C@@](C)(C(=O)O)C1 2146320326 JYRQROYUYPNONV-BXUZGUMPSA-N 299.754 2.110 10 10 CECE Oc1ccc(-c2noc([C@@H]3CCCNCC3)n2)cc1O 2146584282 AUFWYGCZJYLYHV-SECBINFHSA-N 275.308 2.005 10 10 CECE C[C@@H](NCc1cccc(F)c1O)C(=O)N1CCCCC1 165028441 TUVXXKJNZLMQRV-LLVKDONJSA-N 280.343 2.022 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCC[C@@H]4CC[C@@H]43)cc21 2151783189 ILOWFNZILFJIJZ-RIEGTJTDSA-N 272.348 2.075 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)Cc1cscn1 42856924 MIRFCWTWXBPAGT-JTQLQIEISA-N 290.392 2.184 10 10 CECE COc1cccc(CNCc2cncn2C2CC2)c1O 2153016503 BYMUFGKSROFXKQ-UHFFFAOYSA-N 273.336 2.222 10 10 CECE COc1cncc([C@H](N)c2ccc3c(c2)CCN3C)c1 2154612175 NHMYBQISDTUETR-MRXNPFEDSA-N 269.348 2.131 10 10 CECE CN(C[C@@]1(C)CCCN1C)C(=O)Nc1ccc(N)cc1 2154954936 XLTFAWFVOAHILJ-OAHLLOKOSA-N 276.384 2.217 10 10 CECE CN[C@H](C)c1ccc(N2CC3(CC3)C[C@H]2CO)c(F)c1 2155343947 CRJFQDCOUFFQLT-YPMHNXCESA-N 278.371 2.457 10 10 CECE CCNCc1ccc(N2C[C@H](O)CC23CCC3)c(F)c1 2155604494 BOZSIIFRKLBEHI-CYBMUJFWSA-N 278.371 2.429 10 10 CECE Oc1cc(F)ccc1CN[C@@H]1CCN2CCCC[C@@H]12 294305497 QGIKGASASPEWSN-KGLIPLIRSA-N 264.344 2.248 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@@H](O)[C@@H](F)C2)cc1 2027972825 NBICJDMMWRLTOT-BFHYXJOUSA-N 252.333 2.006 10 10 CECE CC(C)[C@]1(O)CCN(c2ccc(CN)cc2Cl)C1 2033349254 QFKVQDWLXFMGJY-AWEZNQCLSA-N 268.788 2.396 10 10 CECE C[C@H]1CC[C@@H](C2OCCO2)N(CCc2ccc(N)cc2)C1 2034583412 HRYFCPHHXVJTCV-BBRMVZONSA-N 290.407 2.285 10 10 CECE CC[C@@H]1CN(c2ccc(CNCCOC)cc2)CCO1 62735925 WMBZIOUXARAFSF-MRXNPFEDSA-N 278.396 2.038 10 10 CECE COc1ncsc1[C@@H](O)CCc1ccc(N)cc1 2036505879 PWVUIKUNDODGGC-NSHDSACASA-N 264.350 2.400 10 10 CECE CC[C@H](N)c1ccc(N2CCN3CCC[C@H]3C2)cc1 300508537 VKNVSIDGYIRDSK-HOTGVXAUSA-N 259.397 2.381 10 10 CECE C[C@@H]1CC[C@H](N(C)c2ccc(CN)c(F)c2F)CO1 401579455 PNGGADZSRKTBFK-KOLCDFICSA-N 270.323 2.427 10 10 CECE O=C1C(=Cc2ccc(O)c(O)c2)N=C2CCCCCN12 2042434445 BEWNXCQREHNWDR-UHFFFAOYSA-N 272.304 2.253 10 10 CECE CCN1CCCN(Cc2cc(F)ccc2O)CC1 307889413 BVXZFYANIFOSFV-UHFFFAOYSA-N 252.333 2.059 10 10 CECE C[C@@H](NCc1cccc(Br)c1O)C(C)(C)O 309814589 VAALDRBTRGLHPX-MRVPVSSYSA-N 288.185 2.404 10 10 CECE CC1(C)[C@@H](O)CCN1c1ccc(CN)cc1Br 310490664 OHCIOLGSMZYNAZ-LBPRGKRZSA-N 299.212 2.257 10 10 CECE CC[C@](C)(C(=O)NCc1ccc(N(C)C)cc1)C(N)=S 2160466647 XPSYBCPLPOWDAY-HNNXBMFYSA-N 293.436 2.071 10 10 CECE OC[C@@H]1CCC[C@H](CNCc2cccc(F)c2O)C1 312001646 RQNSLSGTBBBEIF-NWDGAFQWSA-N 267.344 2.420 10 10 CECE CCOC1(CNC(=O)c2ccc(O)c(O)c2)CCCC1 312473035 IFUSQDOGOAEJED-UHFFFAOYSA-N 279.336 2.177 10 10 CECE Nc1ccc(OCCN2CCCC23CCOCC3)cc1 2158426851 WFNUZEPKBRGILT-UHFFFAOYSA-N 276.380 2.293 10 10 CECE COCCO[C@@H]1CCCN(c2ccc([C@H](C)N)cc2)C1 2158832811 LAMMCOHNXGJSRT-XJKSGUPXSA-N 278.396 2.338 10 10 CECE COc1cccc(O)c1CN(C)[C@@H]1CCCC[C@@H]1CN 2160725049 QISUXGVIUIHAQK-TZMCWYRMSA-N 278.396 2.350 10 10 CECE COc1cccc(O)c1CNC[C@@H](CC(C)C)N(C)C 2160700941 KJFLVOBLEUZCBP-CYBMUJFWSA-N 280.412 2.467 10 10 CECE CCOC(CCCNCc1cccc(O)c1O)OCC 2161090935 BONKNPDQRXOGTM-UHFFFAOYSA-N 283.368 2.367 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCO[C@H](CCF)C1 700591459 GHMCWZGMJQFLAK-GHMZBOCLSA-N 269.316 2.219 10 10 CECE CCN(CC)CCSC[C@@H](O)COc1ccc(N)cc1 88733798 HTUMBUYBIIMGMX-AWEZNQCLSA-N 298.452 2.084 10 10 CECE NCc1ccc2c(c1)CCCN2CCO[C@H]1CC1(F)F 700869158 XYQSSNQWRVGLGZ-AWEZNQCLSA-N 282.334 2.322 10 10 CECE CC[C@@]1(NCc2ccc(F)c(F)c2O)CCOC1 703341872 QTEKUTZIRXJNTD-CYBMUJFWSA-N 257.280 2.329 10 10 CECE Cc1cc(N2CC[S@@](=O)C[C@@H]2C)ccc1CNC1CC1 2171972856 RQBRJUFLUMOHRO-RNODOKPDSA-N 292.448 2.204 10 10 CECE CN1C[C@H]2CC[C@H]1[C@H]1CN(c3ccc(N)cc3)C[C@@H]21 707791580 DDXAVVMLJBJYNL-MEYUZBJRSA-N 257.381 2.045 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@H]1CCN 2162672600 YPZWBTLNYUAKMN-VHSXEESVSA-N 284.306 2.429 10 10 CECE C[C@@H]1CN(C(=O)C=Cc2ccc(N(C)C)cc2)C[C@@H](C)O1 2053589046 MBXGTLPJLSGQJD-ZIAGYGMSSA-N 288.391 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250.346 2.434 10 10 CECE C[C@]12C[C@H](C1)[C@H](C(=O)NCCCCN=[N+]=[N-])CO2 2315919163 VQSPHYXDOYZJJK-FOGDFJRCSA-N 252.318 2.008 10 10 CECE CC(C)[C@H](O)C(C)(C)NCc1cccc(F)c1O 2318071289 CPSAEOLORYWYIP-ZDUSSCGKSA-N 255.333 2.416 10 10 CECE COc1ccc(N2CC[C@H]3C[C@]2(CN)C3)cc1F 2318342597 ATFBSYDGBQSEAW-WJONMLJTSA-N 250.317 2.152 10 10 CECE CCOC(=O)CCN(CC)N=Nc1ccc(C(N)=O)cc1 2330154782 JPQSSQAVSGVZHK-UHFFFAOYSA-N 292.339 2.059 10 10 CECE COCCN(CCOC)N=Nc1cccc(C(C)=O)c1 2330203006 RRLMBUOHOARFKW-UHFFFAOYSA-N 279.340 2.483 10 10 CECE Nc1ccc(CCNC(=O)C[C@H]2CC[C@@H]3C[C@H]23)cc1 2328639829 MFIKDASEFSVNNO-NFAWXSAZSA-N 258.365 2.364 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@@H]2COC[C@@H]2C1 2328712041 DQPXGLPPWXWXCX-TUAOUCFPSA-N 263.337 2.127 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])C[C@@H]2CC[C@H]1C2 2329108189 YQCBEXLGGQHKQU-MDZLAQPJSA-N 266.345 2.398 10 10 CECE O=C(O)[C@H]1[C@@H]2CC[C@H]1N(Cc1c(O)cccc1Cl)C2 2329525110 CMRPIRMQINIEJP-DYLAAIIWSA-N 281.739 2.341 10 10 CECE 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COc1ccc(N2C[C@@H](O)C[C@H]2C(C)C)c(C=O)c1 2344692149 JTFFIYGYIOVHDU-WFASDCNBSA-N 263.337 2.103 10 10 CECE Cc1nc(CCCN2CCC(CN=[N+]=[N-])CC2)n[nH]1 2351856604 UHNUKGJVBYSBFU-UHFFFAOYSA-N 263.349 2.068 10 10 CECE Cc1cc(N(C)CCO)ccc1CNC(C)(C)C 50582703 XXYCGRSQONXGNJ-UHFFFAOYSA-N 250.386 2.312 10 10 CECE COc1ccc(N2CCC(N[C@H](C)[C@H](C)CO)CC2)cc1 305131948 NETHOEQIAHHIMV-ZIAGYGMSSA-N 292.423 2.271 10 10 CECE CC(C)CN[C@H](C(=O)O)c1ccc(N(C)C)cc1 211863923 NCOQKXIEEGUZJA-ZDUSSCGKSA-N 250.342 2.124 10 10 CECE CS(=O)(=O)c1cccc(OCCCN=[N+]=[N-])c1 42416325 SGZFKGJHDLWPJH-UHFFFAOYSA-N 255.299 2.169 10 10 CECE CN(Cc1ccc(N)cc1)c1nccn(C(C)(C)C)c1=O 61768684 XOMIZKFLZJXANE-UHFFFAOYSA-N 286.379 2.217 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@@H](N(C)C)C2)cc1 124347275 MXADKIFAUMMYRL-ZENOOKHLSA-N 261.413 2.353 10 10 CECE OC[C@@H]1[C@@H]2C[C@H]1N(c1ccc(CNC3CC3)cc1Cl)C2 2358070705 GMLCBSRTFJEHRA-AXAPSJFSSA-N 292.810 2.409 10 10 CECE OC[C@H]1[C@@H]2C[C@H]1CN2c1ccc(CNC2CC2)c(Cl)c1 2358071218 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291.532 2.162 10 10 CECE CC1(C)CCC[C@@](NCCN=[N+]=[N-])(C(N)=O)CC1 90258158 IXCNKKREOVHNCS-LBPRGKRZSA-N 253.350 2.101 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@@H](C)[C@H]1C(=O)O 299949836 CVKXHJLFYGKEQM-ZDMBXUJBSA-N 267.300 2.387 10 10 CECE Cn1cccc1-c1[nH]c2ccccc2c1[C@@H](O)CN 606597323 VRWNKNXCMUWDHL-ZDUSSCGKSA-N 255.321 2.166 10 10 CECE C[C@H](N[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)O)c1cc(O)ccc1O 251424118 HVDLJLMIPBBOEL-WIVWZLNMSA-N 291.347 2.248 10 10 CECE Oc1ccccc1CN[C@H](c1ccccc1)c1nc[nH]n1 368620547 ANFCAGIVILOPSY-OAHLLOKOSA-N 280.331 2.390 10 10 CECE OCCCCCNCc1cc(Cl)c(F)cc1O 294739753 QSKDURNFZLYZQL-UHFFFAOYSA-N 261.724 2.437 10 10 CECE CC[C@H](N[C@H]1CCC(=O)NC1(C)C)c1ccccc1O 802313016 DTXYONVFOSDFSA-JSGCOSHPSA-N 276.380 2.490 10 10 CECE FC1(F)Oc2ccc(N3CC[C@@H]4NCC[C@@H]4C3)cc2O1 2162633486 YWBJNSMZUNHHFT-KOLCDFICSA-N 282.290 2.196 10 10 CECE N[C@@H]1CN(c2ccc3c(c2)COCC3)CC2(CCC2)C1 2162664617 QPYIFXSZVJQAPT-HNNXBMFYSA-N 272.392 2.467 10 10 CECE CN1CCc2cc(N3CC[C@]4(CCCNC4)C3)ccc21 2163070296 HHZSGCBXNIODNB-KRWDZBQOSA-N 271.408 2.259 10 10 CECE CN1CCc2cc([C@@H](O)C3(CN)CC(F)(F)C3)ccc21 2163075796 IBVFMJNURMXIEX-CYBMUJFWSA-N 282.334 2.087 10 10 CECE Cn1ccnc1[C@@H](N)c1ccc(N2CCCCC2)cc1 2163105435 JGIQLCPIGDZXOS-HNNXBMFYSA-N 270.380 2.459 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)c1cc(Cl)n(C)n1 2163145252 PNOHLYDTFCPEKT-HNNXBMFYSA-N 290.798 2.375 10 10 CECE CNCc1ccc(OC)c(CN(C)[C@@H]2CC[C@H]2OC)c1 724207741 BCHNNFHVQJUTPP-GDBMZVCRSA-N 278.396 2.024 10 10 CECE Oc1cccc(Br)c1CNCCOC1CC1 715017040 KEQKBAAMQHYUKO-UHFFFAOYSA-N 286.169 2.423 10 10 CECE CCNCc1ccc(N2CCS[C@H](CO)C2)cc1C 719990792 PPVJEYPSVSLJPT-HNNXBMFYSA-N 280.437 2.019 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CC23CC3)c1 817549877 OGRSOHFFANOQFG-SKDRFNHKSA-N 261.321 2.378 10 10 CECE C[C@@H]1CC(CNCc2ccc(O)cc2O)C[C@@H](C)O1 724293254 SJYYFZIIPSYARS-GHMZBOCLSA-N 265.353 2.391 10 10 CECE N[C@@H](CCF)c1cc(Br)cc([N+](=O)[O-])c1O 575439716 UZZALJKJALVISE-ZETCQYMHSA-N 293.092 2.422 10 10 CECE 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290.407 2.180 10 10 CECE Oc1ccc(Cl)cc1CNC[C@]1(O)C[C@H]2C=C[C@H]1C2 850374549 LXPSEQFTQVRCGC-ITDIGPHOSA-N 279.767 2.462 10 10 CECE CN(C[C@H]1C[C@H]1C1CC1)S(=O)(=O)Cc1ccc(N)cc1 698323559 JUZQPJWRECPHIL-HIFRSBDPSA-N 294.420 2.077 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@@H](C)C(=O)[C@H](C)C2)c1O 852474853 VEBCOGMSSFAYOK-NXEZZACHSA-N 293.338 2.391 10 10 CECE CCN(Cc1ccc(N)cc1)c1nnc(C)c(C)n1 165394482 MAVVUEJBRPRCLZ-UHFFFAOYSA-N 257.341 2.097 10 10 CECE COc1ccc2c(c1)CCCN2C[C@H](C)CS(C)(=O)=O 757800536 DWOACZQZCXSXKG-LBPRGKRZSA-N 297.420 2.129 10 10 CECE CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(N)cc1 867965536 DTVSWWYSYDNXNG-OWYJLGKBSA-N 260.337 2.413 10 10 CECE CN1C(=O)C2(CCCC2)N[C@H]1c1ccc(F)c(F)c1O 864386218 WAEJAAHWZYDNMN-GFCCVEGCSA-N 282.290 2.043 10 10 CECE Cc1cc(N(C)C)ccc1CNCc1ccn(C)n1 776173873 BZIMFKCKGVIQNB-UHFFFAOYSA-N 258.369 2.084 10 10 CECE CCCOc1cc(N2C[C@@H](C)C[C@@H](N)C2)ccc1N 1876388913 ICIZNDNDIDARFZ-NWDGAFQWSA-N 263.385 2.231 10 10 CECE CCC[C@H](C(=O)N(C)Cc1ccccc1O)C(N)=S 1877528961 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10 10 CECE C[C@H](N)c1ccc(N(C)C2(CO)CCSCC2)cc1O 2171173338 VBOONXOAYXNYTB-NSHDSACASA-N 296.436 2.106 10 10 CECE C[C@@H](N(C)C(=O)[C@H]1CNc2ccccc2N1)C(C)(F)F 2178854114 IULAZTMBVNVRJB-BXKDBHETSA-N 283.322 2.395 10 10 CECE C[C@@H]1CN(c2ccc(CO)cc2F)CC[C@H]1N(C)C 710392333 CMOXZHLQNIIPDC-BXUZGUMPSA-N 266.360 2.094 10 10 CECE C[C@H](N[C@@H]1CCc2nccn2C1)c1cc(F)ccc1O 368327794 MPCGCMGMONRWOZ-CMPLNLGQSA-N 275.327 2.393 10 10 CECE C[C@H](NC[C@H]1[C@@H]2COC[C@H]12)c1ccc(N(C)C)cc1 368608681 QWSKNXWBMNCYCG-VCOSZWKGSA-N 260.381 2.296 10 10 CECE C[C@@H]1O[C@H](C)C[C@H]1c1noc(-c2ccc(O)c(O)c2)n1 686415425 QQTUMHSPTHKHEP-KHQFGBGNSA-N 276.292 2.429 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1OC2CCC1CC2 687261633 CZGMHOYKGRZWSU-FNBIGBAISA-N 275.352 2.154 10 10 CECE Cn1cc([C@@H]2CCN(c3ccc(CN)c(F)c3)C2)cn1 2171788312 VIKJAUDGSCRCNK-GFCCVEGCSA-N 274.343 2.012 10 10 CECE C[C@@H](N)c1ccc(N2CCC3(CCOCC3)C2)cc1O 380185765 DCCURDFRJCEXGI-GFCCVEGCSA-N 276.380 2.419 10 10 CECE CC(C)Oc1ccc(N2CCC[C@@H](NCCO)C2)cc1 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COc1nn(C)cc1N[C@H](C)c1cc([N+](=O)[O-])ccc1O 788983642 DTOYZYSYSSFMLZ-MRVPVSSYSA-N 292.295 2.216 10 10 CECE COc1cccc(O)c1CN1CCC(C)(N2CCC2)CC1 895671957 RTRCZUVYSLYCAR-UHFFFAOYSA-N 290.407 2.461 10 10 CECE CO[C@@H](C)[C@H](C)NC(=O)NCc1ccc(N(C)C)cc1C 786152526 ULJNMKUXQDNQBR-STQMWFEESA-N 293.411 2.284 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCN3CC[C@H]2C3)cc1 1877797859 IMVXRSWHPNPTPF-IVMMDQJWSA-N 259.397 2.237 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)on2)C1 1878101222 XGODPDJRRVXGCR-YFKPBYRVSA-N 275.190 2.218 10 10 CECE C[C@H](NCC12CC(C1)[C@H](C)O2)c1cc(O)ccc1O 1878453423 DJEGRIPLBWSGAJ-ZNPWSYNXSA-N 263.337 2.316 10 10 CECE Oc1ccc(Cl)c(F)c1CNC[C@H]1CCC[C@@H]1O 790972824 JZYSLWUSWGXCQJ-KCJUWKMLSA-N 273.735 2.435 10 10 CECE COc1ccc(CNC(=O)/C=C\c2ccncc2C)c(O)c1 1139032502 LMMKBFYELLQVPF-XQRVVYSFSA-N 298.342 2.434 10 10 CECE Oc1cc(Cl)ccc1CN1CCO[C@]2(CCCOC2)C1 1308758014 KJOXPCQQMBWACC-OAHLLOKOSA-N 297.782 2.427 10 10 CECE Cc1cc(CN)ccc1N(C)C[C@]12C[C@H](CCO1)C2 1879433803 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2.361 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@H]2CCCCS2(=O)=O)cc1 694135639 FEWOHIFZZKZLFX-SWLSCSKDSA-N 296.436 2.110 10 10 CECE CCCN(Cc1ccc(N)cc1)c1cncc(OC)n1 71176445 AEDRYZINXPWFKO-UHFFFAOYSA-N 272.352 2.484 10 10 CECE COc1ccc(O)c(CN2CCC[C@](C)(C(=O)O)C2)c1 86783690 ONEMLAAUWQIJLL-HNNXBMFYSA-N 279.336 2.088 10 10 CECE CC(C)(C)[C@@H]1C[C@@H]1CNS(=O)(=O)Cc1ccc(N)cc1 699818800 SBARPMQTGIULCG-TZMCWYRMSA-N 296.436 2.370 10 10 CECE CC(C)NCc1ccc(N2CCO[C@H]3C[C@@H]32)c(F)c1 2115159936 XWKKHCHLQRUPJG-GJZGRUSLSA-N 264.344 2.301 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC23COC3)cc1O 2115158272 JFDUWNMOVXLFAW-NSHDSACASA-N 262.353 2.042 10 10 CECE Cc1ccc(C(=O)NCc2c(O)cccc2F)c(O)c1O 1456028544 JFKPETKOAAZOCC-UHFFFAOYSA-N 291.278 2.181 10 10 CECE CC[C@@H](O)c1ccc(N2CC(N(C)C3CC3)C2)cc1 2116379388 FPXWNKWKUUIDAG-MRXNPFEDSA-N 260.381 2.413 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@H]1CCOc2ccccc21 1469159802 NUZQLFQIWTUOGX-AWEZNQCLSA-N 299.326 2.280 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CC[C@@H](C)N1 2119509985 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C[C@@H](c1ccc2ccccc2c1O)N1CCO[C@H](CN)C1 165474404 CJZQTVDIUNSKTM-GXTWGEPZSA-N 286.375 2.266 10 10 CECE CC1(C)[C@H](O)CCN1c1ccc2c(c1)CCC[C@@H]2O 2128275934 XOPFWFZQZXWFIS-LSDHHAIUSA-N 261.365 2.406 10 10 CECE CCN[C@H]1CCc2cc(N3CCC[C@@H](O)C3)ccc21 2128297992 YZFGVFWVLLEALO-ZBFHGGJFSA-N 260.381 2.245 10 10 CECE CC(C)OCCSCC(=O)N(C)c1ccc(N)cc1 2128313824 YEHDDJTXWHGSBE-UHFFFAOYSA-N 282.409 2.390 10 10 CECE CCN[C@@H]1CCc2cc(N(C)[C@@H](C)CCO)ccc21 2128313841 YJCCLDTZMQEHOV-BLLLJJGKSA-N 262.397 2.491 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](CO)[C@H]3C)ccc21 2128311660 XNJNLWPYGLQYLT-AXAPSJFSSA-N 260.381 2.100 10 10 CECE CC(C)(O)[C@H]1CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128322030 LUAYVJQKQLRGLK-SWLSCSKDSA-N 261.365 2.263 10 10 CECE Cc1cc(CN)ccc1N1CC[C@H](O)[C@H]1C(C)(C)C 2128685916 DVWVSOCLUQKMIR-GJZGRUSLSA-N 262.397 2.439 10 10 CECE COc1ccc(N(C)[C@H]2CCC[C@@H]2N)c(OC)c1C 259019105 OBHBPYVUOVFHGJ-RYUDHWBXSA-N 264.369 2.328 10 10 CECE CC1(C)C[C@H](CN)CN1c1ccc2c(c1)OCCO2 259212722 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1912154854 JJZYMAGEDKTWBR-NQBHXWOUSA-N 264.329 2.247 10 10 CECE CC(C)Cn1ncnc1CN1CCC[C@H](N=[N+]=[N-])C1 1912182790 GXKDPLCAPDVFKJ-NSHDSACASA-N 263.349 2.209 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)Cc2ccccn2)C1 1912172381 UBXOHIPGOWAOED-NSHDSACASA-N 259.313 2.173 10 10 CECE CN1CCC[C@@H](N(C)c2ccc(C=CC(=O)O)cc2)C1 1912105274 DYVBZFKMAKGOAC-OAHLLOKOSA-N 274.364 2.315 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCC[C@@H]1C(C)C 1912156439 MFSVWIGJFPXABH-PWSUYJOCSA-N 254.334 2.254 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC[C@H](O)[C@H]2C)c1O 1914253263 ATSBHQFTHVERKS-OQPBUACISA-N 283.755 2.203 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)C2CC(C(F)F)C2)C1 1912206970 LXOIDBVPTICDKZ-MGURRDGZSA-N 294.327 2.135 10 10 CECE CCN1CCO[C@@H](CN2CCCC[C@H](CN=[N+]=[N-])C2)C1 1912201320 SGPQBHIIVNKJIF-ZIAGYGMSSA-N 281.404 2.120 10 10 CECE C[C@@H]1CN([C@H](CN)c2ccc(N(C)C)cc2)C[C@@H]1C 219625134 JPXRPSAPWYPMSM-DVOMOZLQSA-N 261.413 2.340 10 10 CECE CN(C)CC1CC(NCc2ccc(F)c(F)c2O)C1 1913699876 HYYJNSLCPFKTMJ-UHFFFAOYSA-N 270.323 2.100 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)CN1CCCC1 1968790745 NDGPYNGLDBKIEA-LBPRGKRZSA-N 262.353 2.007 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2C[C@H]2C2CCC2)cc1 2135215922 ZYSDTADJOCZCRX-HIFRSBDPSA-N 258.365 2.364 10 10 CECE CN1CCc2cc(CN[C@H](CCO)C(F)(F)F)ccc21 1918557388 GBMVDOOWQUSQFI-CYBMUJFWSA-N 288.313 2.082 10 10 CECE Nc1ccc(NC(=O)[C@H]2C[C@H]2C2CCOCC2)cc1 2135343421 QKQAKQSRZPHKIT-KBPBESRZSA-N 260.337 2.270 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2C[C@H]1C[C@H](O)C1 2140469881 VOIYXXAGIWVCLW-LALPHHSUSA-N 260.381 2.230 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CCCC23CCC3)cc1 1921505725 ZHRXJOIVUSXVFL-AWEZNQCLSA-N 274.364 2.487 10 10 CECE Nc1ccc(CCC(=O)Nc2cccc(F)n2)cc1 228287852 UVJWUNFPHYKNCS-UHFFFAOYSA-N 259.284 2.374 10 10 CECE CCCN(Cc1cc(Cl)cc(OC)c1O)C1CNC1 229104212 BDINTFZPGLGOLK-UHFFFAOYSA-N 284.787 2.238 10 10 CECE CN(CC(C)(C)C)C(=O)[C@H]1CNc2ccccc2N1 229880032 LRHFLJTVJWSNQU-CYBMUJFWSA-N 261.369 2.397 10 10 CECE NC(=O)CCCCNCc1c(O)ccc2ccccc12 230039405 UHSUOMDKYINOTR-UHFFFAOYSA-N 272.348 2.291 10 10 CECE [N-]=[N+]=NCCN[C@]1(C(N)=O)CCC[C@@H]2CCCC[C@H]21 2136414485 ZVECGNDVJLEJEQ-DMDPSCGWSA-N 265.361 2.101 10 10 CECE COc1ccc([C@@H](C)NCc2csc(=O)[nH]2)c(O)c1 231700540 HUDSKUMPVRVCJR-MRVPVSSYSA-N 280.349 2.001 10 10 CECE CC(C)(C)[C@@H](CO)CNCc1cc(F)ccc1O 1967699942 SJCBPPDLBPLWNO-LLVKDONJSA-N 255.333 2.276 10 10 CECE CC[C@H](CSC)N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 124109812 UYXINGOTKRAZQF-QMTHXVAHSA-N 293.436 2.241 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(C)[C@@H](C)CSC)ccc21 124119310 DMCNJODFBRHVMQ-HZMBPMFUSA-N 293.436 2.477 10 10 CECE CC(C)N(Cc1ccc(O)cc1O)C[C@@H]1CCCN1 232627743 VPAKGIHMXJJUMU-ZDUSSCGKSA-N 264.369 2.060 10 10 CECE CNCCC1CCN(Cc2ccc(F)cc2O)CC1 2139756110 OSWFWBNKGDBHQC-UHFFFAOYSA-N 266.360 2.353 10 10 CECE Cc1cccc(CNC(=O)c2ccc(F)nc2)c1O 2139744488 XYSJISWBAYKWGG-UHFFFAOYSA-N 260.268 2.165 10 10 CECE CCCC(=O)NCCCNCc1ccc(C)cc1O 2139769694 XDVZKOCHRURUQF-UHFFFAOYSA-N 264.369 2.097 10 10 CECE CCN(Cc1ccc(F)cc1O)C1CCN(C)CC1 2139784674 CKYAPTAFEAYDBW-UHFFFAOYSA-N 266.360 2.447 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2COC(C)(C)C2)c1O 2139757533 IYLLIYYEVALAQI-LBPRGKRZSA-N 263.337 2.132 10 10 CECE Cc1cc2nc(C3=C[C@@H](O)[C@@H](N)C3)n(C)c2cc1Cl 2141649180 OKPYKWLEYXVOED-GXFFZTMASA-N 277.755 2.010 10 10 CECE CN[C@@H](c1ccccc1O)c1ccc(OC)nc1OC 2146242066 SDSYVDAXFHTIOS-AWEZNQCLSA-N 274.320 2.113 10 10 CECE C[C@H]1OCC[C@@H]1SCC(=O)N(C)c1ccc(N)cc1 235618349 HTDJUAFOXSXJDI-MFKMUULPSA-N 280.393 2.142 10 10 CECE CO[C@@H]1CN(c2ccc(CNC3CC3)c(C)c2)C[C@H]1F 2146485169 UALJVHMXVUJUAN-HZPDHXFCSA-N 278.371 2.420 10 10 CECE Nc1ccc(OCCC(=O)O[C@@H]2CC[C@H]3C[C@@H]32)cc1 2142004653 JBUDLIRFZDIVDZ-LEWSCRJBSA-N 261.321 2.379 10 10 CECE CC(C)[C@@](O)(CN(C)CCN=[N+]=[N-])C(F)(F)F 1949778361 HLYMFVBVEYKMBQ-QMMMGPOBSA-N 254.256 2.178 10 10 CECE CO[C@H](CN(C)Cc1ccc(N)cc1)C1CCOCC1 2150286681 KIYMBJPRNZRFCU-MRXNPFEDSA-N 278.396 2.142 10 10 CECE CC(C)(C)OC(=O)C[C@H](CCN)c1cccc(O)c1O 1951966041 IHMDPKSHUVZCLV-JTQLQIEISA-N 281.352 2.262 10 10 CECE Cc1ccc(O)c([C@@H](C)NC2CC(CS(C)(=O)=O)C2)c1 1974458375 IQONGHSWLORQQE-PNESKVBLSA-N 297.420 2.174 10 10 CECE COc1cc(Cl)cc(CN2CCC[C@@H]3NCC[C@@H]32)c1O 2143701364 VJMAXUQJJSLSRD-STQMWFEESA-N 296.798 2.381 10 10 CECE CN(C)Cc1cc(F)cc(C(C)(C)CC(=O)O)c1O 258573406 NKHZRNZQRQVSAB-UHFFFAOYSA-N 269.316 2.345 10 10 CECE CCOC(=O)C[C@H](N)c1c(C(F)(F)F)ccc(O)c1O 260271572 CEZRMTDNNSUFME-ZETCQYMHSA-N 293.241 2.070 10 10 CECE CCOC(=O)C[C@@H](N)c1cccc(C(F)(F)F)c1O 260506639 WDPPSSCIZMJMNG-SECBINFHSA-N 277.242 2.364 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CC[C@H]3CC[C@H]32)cc1 2144552400 LPHCPUFUVZHGFQ-KCPJHIHWSA-N 274.364 2.343 10 10 CECE O=C(CN1CCC(CCF)CC1)c1ccc(O)c(O)c1 2144649063 SMWFLUQZLYTPBD-UHFFFAOYSA-N 281.327 2.352 10 10 CECE COc1ccc([C@@H](C)NC2CCN(C)CC2)c(O)c1 37267006 QUIDXVYEJYHIKL-LLVKDONJSA-N 264.369 2.146 10 10 CECE Oc1ccc(CNC[C@@H]2Cc3ccccc3O2)c(O)c1 38009491 SBPBVWBAINSHOD-AWEZNQCLSA-N 271.316 2.191 10 10 CECE Cc1cc(NC(=O)c2ccc(O)c(O)c2)sn1 1997473004 ZOJVKAOSUVNCMF-UHFFFAOYSA-N 250.279 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CO[C@@H]1CCN(c2ccc(CN)c(F)c2F)[C@H](C)C1 381417506 OOZZPWZEZVPYEY-MWLCHTKSSA-N 270.323 2.427 10 10 CECE NCc1ccc(N2CCN3CC[C@H]2C3)cc1C(F)(F)F 381705783 QEMULQDBNGYYKX-LBPRGKRZSA-N 285.313 2.058 10 10 CECE CCN(Cc1cccc(F)c1O)[C@@H]1CCN(C)C1 693470789 QRXPJHVOBYJRNG-GFCCVEGCSA-N 252.333 2.057 10 10 CECE C[C@H]1CCCC[C@@H]1C(=O)NCc1cc(N)ccc1O 714436714 LOLGHMYCYVWVHV-GWCFXTLKSA-N 262.353 2.417 10 10 CECE COc1ccc(N2CC[C@H](C)O[C@@H](C)C2)c(N)c1 694935800 ULXLXJMGTRIXQT-QWRGUYRKSA-N 250.342 2.281 10 10 CECE CCC1(O)CN(c2ccc(CN)cc2C(F)(F)F)C1 384075266 WBZFHQFCMXYDAJ-UHFFFAOYSA-N 274.286 2.125 10 10 CECE CNCc1ccc(N2CC(O)(C(C)C)C2)cc1Cl 384152977 PTHDEFKCOOIXPW-UHFFFAOYSA-N 268.788 2.267 10 10 CECE Cc1coc([C@@H](O)[C@@H](N)c2ccc3c(c2)CCN3C)c1 2163133751 PDNKMIWGSGGPFZ-JKSUJKDBSA-N 272.348 2.314 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)C1(SC)CC1 2163140909 ONUUPLFYAKDIQI-HUUCEWRRSA-N 292.448 2.196 10 10 CECE CNCc1ccc(N2C[C@H]3COC[C@@H]3C2)cc1Cl 718237705 XYCGBGBLBCCOAI-RYUDHWBXSA-N 266.772 2.142 10 10 CECE CCCNCc1ccc(N2C[C@H](O)C(C)(C)C2)cc1 388340192 HVADYCGCOQTQLD-HNNXBMFYSA-N 262.397 2.393 10 10 CECE CN1CCC[C@@H]2[C@H]1CCN2CCCc1ccc(N)cc1 720898809 XGEGBMZBZKFANQ-IAGOWNOFSA-N 273.424 2.370 10 10 CECE CN1CCCc2cc([C@]3(O)C[C@@H](CN)C3(C)C)ccc21 2173218018 RDOWCPBFXCFKPH-WMLDXEAASA-N 274.408 2.261 10 10 CECE CC(C)[C@H](C)CN(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 399466821 SDJJIUJIKIKHEF-ABAIWWIYSA-N 275.396 2.391 10 10 CECE Cc1cc(O)n2ncc(C(=O)NCC(C)(C)C(C)C)c2n1 2063289524 MVONBRWDGYFQSS-UHFFFAOYSA-N 290.367 2.155 10 10 CECE O=C(C[C@@H]1CC=CCC1)NCc1c(O)cc(O)cc1O 2064435809 QKRRIAHZDOCYQW-SNVBAGLBSA-N 277.320 2.166 10 10 CECE CCN(CC)c1ccc([C@H](O)c2ncnn2CC)cc1 2168018080 AONAJAVSXSAGDL-AWEZNQCLSA-N 274.368 2.226 10 10 CECE CN(c1cccc(F)c1)c1ncnc2c1CCNCC2 2169061713 ORWPTLXQPLKJNJ-UHFFFAOYSA-N 272.327 2.072 10 10 CECE Oc1cccc(CNCC2(O)CCC(F)(F)CC2)c1O 2179639313 UVFALGDACYPIME-UHFFFAOYSA-N 287.306 2.128 10 10 CECE NCc1ccc(N2C[C@]3(F)CCC[C@]3(CO)C2)cc1Cl 2176648411 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Oc1cccc(F)c1CN[C@H]1C[C@@H](Cn2cccn2)C1 2184781860 XDGPKWVMVVTOML-TXEJJXNPSA-N 275.327 2.296 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3N)C[C@@H]1N(C)C 2184736781 XYNHLAAUTTYUBA-DQYPLSBCSA-N 273.424 2.409 10 10 CECE Cc1ncc(CN(C)c2ccc3c(c2)CC[C@@H]3N)n1C 2184739351 FSVJDYKAWDWTLC-INIZCTEOSA-N 270.380 2.311 10 10 CECE N[C@H]1CCc2cc(N3C[C@H]4[C@H]5CC[C@@H](O5)[C@H]4C3)ccc21 2184739015 ASXNXNZKRYELMR-DMRKSPOLSA-N 270.376 2.246 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3CCNC34CCC4)ccc21 2190325529 UZKMHQKUMVXRNW-ZBFHGGJFSA-N 272.392 2.245 10 10 CECE COc1cccc(O)c1CN(C)[C@@H]1CCO[C@@H]1C 2042570174 NVSAKKICELYFKS-ZYHUDNBSSA-N 251.326 2.010 10 10 CECE CNC[C@H]1CCCCN1c1ccc(OC)c(F)c1 2044288309 DIZRGVNYGSYHBY-GFCCVEGCSA-N 252.333 2.413 10 10 CECE COc1ccc(N2C[C@H]3C[C@@H](N)C[C@H]2C3)cc1F 2044342153 JGBCROZANQNTKD-HOSYDEDBSA-N 250.317 2.150 10 10 CECE CN[C@@H](C[C@@H](O)c1ccc(N(C)C)cc1)C(F)F 2044715840 WWSSDULUOYTIDE-NWDGAFQWSA-N 258.312 2.029 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCN3CCC2CC3)c(F)c1 2194686740 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Cc1cccc(O)c1CNC[C@]1(CO)C[C@@H]1C(F)(F)F 2192581037 OQGADGWUHFTKBJ-STQMWFEESA-N 289.297 2.351 10 10 CECE CCN(C[C@H](C)O)c1c(F)cc([C@@H](C)O)cc1F 2074077993 QVNKFPWZYHQTLU-DTWKUNHWSA-N 259.296 2.225 10 10 CECE C[C@@H](N[C@H]1C[C@@H](CCO)C1)c1cc(F)ccc1O 2078421486 CFJQIQFPLPXIFC-FOGDFJRCSA-N 253.317 2.343 10 10 CECE CC(C)(C)[C@@H]1C[C@H]1[C@@H](NCCCN=[N+]=[N-])C(=O)O 2079991392 UPJRYIHRTRASOI-OPRDCNLKSA-N 254.334 2.412 10 10 CECE CON(CCC(=O)O)[C@@H](C)c1ccc(N(C)C)cc1 2102174956 IHNDRJMGJBGAAA-NSHDSACASA-N 266.341 2.152 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H]2[C@H]1CCCN2C 2104477518 LNTWADIASBBDCJ-HUUCEWRRSA-N 260.381 2.369 10 10 CECE CC1CC([C@H](C)NC(=O)COc2ccc(N)cc2)C1 2105476156 BDSGPBXRNUMIKK-CXQJBGSLSA-N 262.353 2.198 10 10 CECE CNCCN(c1ccc2c(c1)OC(F)(F)O2)C(C)C 2106392684 QDSNTXWJUPDNTF-UHFFFAOYSA-N 272.295 2.442 10 10 CECE COc1ccc([C@H](N)c2ccc(N(C)C)cc2)nc1 2106797465 AZSWTYWMEBYKKE-OAHLLOKOSA-N 257.337 2.204 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H]1CCCOC1 2106798042 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2095534303 DPWLCIWRGDRZEP-AWEZNQCLSA-N 257.337 2.466 10 10 CECE Cc1cc(CN)ccc1N(C[C@H]1CCOC1)C1CC1 2113738346 GICKKJRKQGPIIS-CQSZACIVSA-N 260.381 2.459 10 10 CECE CC[C@H]1CN(c2ccc(CO)cc2C)C[C@H]1N(C)C 2114125205 SFMIUGYLQXTJSM-GOEBONIOSA-N 262.397 2.264 10 10 CECE C[C@H]1CCN(c2cc(Cl)c(CN)cc2F)C[C@H]1CO 2120886236 XXYSWHCEBKHCHC-ONGXEEELSA-N 286.778 2.393 10 10 CECE COc1cc(N2CCO[C@@H]3C[C@@H]32)ccc1CNC(C)C 2204542818 FVANNRJQWSXEME-GOEBONIOSA-N 276.380 2.171 10 10 CECE COc1cc(N(C)C[C@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)ccc1CN 2204558149 YRQYRAYSDGZSQT-QNOGJNQQSA-N 272.392 2.492 10 10 CECE CCNCc1ccc(N2CC=C[C@@H](OC)C2)cc1OC 2204548829 HADSVADXCRQBMI-OAHLLOKOSA-N 276.380 2.196 10 10 CECE CCN(CC)C(=O)[C@H](C)NCc1cnc(SC)s1 2208455293 IQHJZSBPWMGOEP-VIFPVBQESA-N 287.454 2.212 10 10 CECE Cc1ccc(O)c(CN[C@H](C(F)F)[C@@H]2CCOC2)c1 2231044660 MAOMNNIQYMUQLS-MFKMUULPSA-N 271.307 2.460 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC[C@H](CO)C2)cc1 2231476778 RUXRDHPKWHWWNS-HIFRSBDPSA-N 262.397 2.393 10 10 CECE Cc1ncsc1[C@](C)(O)[C@H](N)c1ccccc1O 2222085423 HZPLSXKZFVSTCO-DGCLKSJQSA-N 264.350 2.065 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC(C)(C[S@](C)=O)C1 2232096076 MQXBCTWQVGWWDL-BLVKFPJESA-N 280.437 2.220 10 10 CECE C[C@@H](N)c1ccc(N(C)CCc2cnn(C)c2)c(F)c1 2234097045 MUNLGEXQDHGQRG-LLVKDONJSA-N 276.359 2.258 10 10 CECE C[C@]1(C(=O)O)CC[C@]1(C)C(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2234246661 NSKNAZZDRCUWFW-HIAZDOBYSA-N 280.328 2.225 10 10 CECE CCNCc1ccc(N2CC[C@H]3[C@H](C[C@H]3O)C2)cc1 2224670595 RRVRDKJBHJHRFC-VNQPRFMTSA-N 260.381 2.003 10 10 CECE CN1CCc2cc(N3CCC4(CC[C@H]4O)CC3)ccc21 2235125962 BQMWFEYBXXFZTP-MRXNPFEDSA-N 272.392 2.420 10 10 CECE C[C@@H](O)[C@@H]1CCCN(c2ccc3c(c2)OCCCO3)C1 2235119498 HYUHCODJYCCSME-CHWSQXEVSA-N 277.364 2.445 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@H](O)CC[C@@H]3O)cc1Cl 2235229359 WWGFWVAMALFJNU-XDQVBPFNSA-N 297.782 2.202 10 10 CECE C[C@@H]1OC2(C)CC1(C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-])C2 2225794360 FJANGWGUJNJMPP-KTHBZUIVSA-N 264.329 2.292 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@H](OC)C1(C)C 2235961398 BQSOBMDWXZOCOA-OAHLLOKOSA-N 278.396 2.418 10 10 CECE CCN1CCN(c2ccc(OC)cc2CN)C(C)(C)C1 2235965686 HXGLKYSUNRGQRM-UHFFFAOYSA-N 277.412 2.074 10 10 CECE COc1ccc(N(C)C[C@H]2CC[C@H](OC)C2)c(CN)c1 2235965993 LUWGIJQOKWHYEK-JSGCOSHPSA-N 278.396 2.405 10 10 CECE COCCCN(C)c1ccc(OC)cc1CNC1CC1 2235966601 VKWDGPUOLNZCSE-UHFFFAOYSA-N 278.396 2.420 10 10 CECE CCO[C@@H]1C[C@H]2CN(CCc3ccc(N)cc3)C[C@@H]21 2225942166 XWORYWGEOBYAMF-CWRNSKLLSA-N 260.381 2.168 10 10 CECE COc1ccc(N2CCO[C@](C)(C3CC3)C2)c(CO)c1 2236001062 YCABACBNQISDMU-INIZCTEOSA-N 277.364 2.193 10 10 CECE OC[C@]1(F)CCN(c2ccc(OC(F)(F)F)cc2)C1 2226541812 SDDDCSPDHYZJKI-NSHDSACASA-N 279.233 2.496 10 10 CECE COc1ccc(N2CCC3(CC2)C[C@@H]3CO)c(F)c1 2226783421 JPHDGRCDNAYYOS-LLVKDONJSA-N 265.328 2.433 10 10 CECE CC1=CC[C@@H](CNC(=O)c2cc(O)c(O)c(O)c2)CC1 2237357257 FMINRPHOUWZIJP-SNVBAGLBSA-N 277.320 2.280 10 10 CECE C[C@H](NCCOc1ccc(N(C)C)cc1)[C@H]1CCCO1 2237690188 UPLAQXGGJSVHNZ-XJKSGUPXSA-N 278.396 2.289 10 10 CECE CO[C@H]1CC[C@H]1CN(C)CCOc1ccc(N)cc1 2227846932 JBWZTOIJPXFBOJ-WFASDCNBSA-N 264.369 2.004 10 10 CECE O[C@H]1CC[C@H]2CC[C@H]1N2c1ccc2c(c1)OCCCO2 2238212020 OLENHOQUQXPQHJ-BNOWGMLFSA-N 275.348 2.340 10 10 CECE C[C@H](N)c1ccc(N2CC[C@]3(O)C[C@H]3C2)c(Cl)c1 2254116565 QMWWCTAQTGKHNI-CHIMOYNISA-N 266.772 2.321 10 10 CECE CP(C)(=O)C1CN(c2ccc3c(c2)CC[C@@H]3O)C1 2258276815 VGQMVJOCUOUKNS-AWEZNQCLSA-N 265.293 2.478 10 10 CECE CSc1ncc(CNC[C@]2(C)C=CCCN2)s1 2248741356 GDQVMPQUOSIGCX-LBPRGKRZSA-N 269.439 2.263 10 10 CECE O[C@@H]1[C@H]2C[C@@H]1CN(c1ccc(OC3CCC3)cc1)C2 2270703717 XTSSHCKXDNNSBU-ATCWAGBWSA-N 259.349 2.435 10 10 CECE CC(=O)NCCN(C)[C@@H](C)c1cc(Cl)c(C)cc1O 2270973834 PIHFNCOZDILGLQ-JTQLQIEISA-N 284.787 2.483 10 10 CECE Cc1ccc(N)c(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])c1 2271351259 VLQXCIQLXOMUTI-SNVBAGLBSA-N 259.313 2.492 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C[C@@]23CC[C@@](CF)(C2)OC3)C1 2261556371 HODFGKUKKLIICW-TUAOUCFPSA-N 254.309 2.280 10 10 CECE C[C@H](O)CN(C(=O)Nc1ccc(N)cc1)C(C)(C)C 2272458758 AQKVIJNLAOCLKB-JTQLQIEISA-N 265.357 2.282 10 10 CECE CN(CC[C@@H]1CCO1)c1c(F)cc(CO)cc1F 2263966123 NUDSBQRNKCBRKY-SNVBAGLBSA-N 257.280 2.072 10 10 CECE CCO[C@H]1C[C@@H](NC(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2265438064 CPMAFLWIPOJWSE-LMLFDSFASA-N 267.333 2.085 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@@H](C)C2)c(OC)c1C 2277994544 NPLAQODBLLJMLZ-GXFFZTMASA-N 265.353 2.219 10 10 CECE CCCc1ccc([C@H](NCCN=[N+]=[N-])C(N)=O)cc1 2268217493 XQYYMXHYTBAFPP-LBPRGKRZSA-N 261.329 2.065 10 10 CECE CSc1ncc(CNC(=O)c2ccc(O)c(O)c2)s1 2269118308 HBPWGRJGRROHMM-UHFFFAOYSA-N 296.373 2.206 10 10 CECE COc1ccc(N2CC(CCCN)C2)c2c1CCC2 2269110851 QGHZVZCGYYGYPK-UHFFFAOYSA-N 260.381 2.359 10 10 CECE CSc1ncc(CNC[C@]23C[C@@H]2[C@H]2CC[C@H](C3)N2)s1 2269316190 XGFPXSCDKJRSQA-LHMODEAPSA-N 295.477 2.485 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@](F)(C(=O)O)C1 2280521554 VPOYUGDYMPIERB-YMTOWFKASA-N 283.299 2.048 10 10 CECE Cc1cc(N(C)C[C@]2(C)COCCO2)ccc1[C@@H](C)N 2285143377 HDPQOLYWBIJFNS-CZUORRHYSA-N 278.396 2.256 10 10 CECE COc1ccc(N2C[C@H](N)CC23CCC3)c(OC)c1C 2295435876 XYXLTYNUQJSBPS-GFCCVEGCSA-N 276.380 2.472 10 10 CECE C[C@@H](O)C[C@@H]1COCCN1c1ccc(OC(F)F)cc1 2295985728 ITSMZRCSBWTALY-ZYHUDNBSSA-N 287.306 2.264 10 10 CECE COc1ccc(N(CC(=O)O)C2CCC2)c([N+](=O)[O-])c1 2288013337 KNVYIRKOAVZXHG-UHFFFAOYSA-N 280.280 2.047 10 10 CECE CC(C)[C@@H](NCCc1ccc(O)c(O)c1)c1cn[nH]c1 2288004461 CYOICKPWMFXYGV-OAHLLOKOSA-N 275.352 2.350 10 10 CECE Cc1ccc(CN[C@@H]2[C@H]3CCO[C@H]32)c(O)c1Br 2307473451 HTWXGHPOQOCFGN-IRUJWGPZSA-N 298.180 2.340 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@]12CC[C@@H](C1)[C@H](C)O2 2315992827 SBCMUGBNMQIOMT-JBLDHEPKSA-N 252.318 2.103 10 10 CECE COc1ccc(N(C)[C@@H](CO)C(C)C)c(F)c1F 2318853276 HFNLJAIYCGHTGJ-JTQLQIEISA-N 259.296 2.427 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3[C@H]4CCCO[C@@H]34)ccc21 2330690865 FYIAEALIPSYUBA-SLBVQIDZSA-N 258.365 2.104 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2C[C@H]2CC(=O)O)c1 2335894171 JCVNGAMYOHGMJY-SRVKXCTJSA-N 263.337 2.462 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@](C)(O)C3)cc1 2339637000 WMZFEIHQQOJAOI-GUYJKWIASA-N 260.381 2.317 10 10 CECE CNCc1ccc(N2C[C@@H](O)C[C@@H]2C(C)C)c(C)c1 2344615232 PFWYXSZTCIWWRS-GOEBONIOSA-N 262.397 2.310 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]32)cc1O 2353892338 DBXIKJAWDJVOTQ-ZSEWYUTFSA-N 276.380 2.152 10 10 CECE C[C@H](N[C@H](C)[C@@H]1CCCO1)c1ccc(O)cc1O 20206778 JJIHQFBGCMKOGY-RBZYPMLTSA-N 251.326 2.316 10 10 CECE Cc1cc(N(C)[C@@H]2C[C@@H]3[C@H]4CC[C@H](O4)[C@H]32)ccc1CO 2356928356 ZJYRDRIQQXUKST-OVYGPGRDSA-N 273.376 2.489 10 10 CECE Oc1c(F)cc(Br)c(F)c1[C@@H]1COCCN1 309177913 AOSXISFGIJBTDA-ZETCQYMHSA-N 294.095 2.094 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2[C@H]3CC[C@H](C3)[C@@H]21 2357251912 ZFPLLKSZORCADQ-FOPDLYMNSA-N 273.376 2.450 10 10 CECE COc1c(Br)cc([C@@H](C)N)c(O)c1C 213305930 NVYIAWFCHJMHNA-ZCFIWIBFSA-N 260.131 2.491 10 10 CECE CN1CCc2cc([C@H]3[C@H](CN)CCCN3C)ccc21 70277832 FHEKMBRQAZFTRM-HOCLYGCPSA-N 259.397 2.021 10 10 CECE CO[C@@H]1CCC[C@H](Oc2ccc(N3CCNCC3)cc2)C1 70325170 MYZUSZHKXJMFJY-SJORKVTESA-N 290.407 2.433 10 10 CECE Cc1cccc(CNC[C@@H](C)Cn2ccnc2)c1O 181164411 DJXLFQHECXKYMF-GFCCVEGCSA-N 259.353 2.323 10 10 CECE Nc1ccc(NC(=O)CCCOCC(F)F)cc1 122404772 LBDCBMIOELUQIA-UHFFFAOYSA-N 258.268 2.269 10 10 CECE CCN(c1ccc(/C=C\C(=O)O)cc1)[C@H]1CCOC1 311423018 AXYRCPLGCPTGME-PODYEWJSSA-N 261.321 2.400 10 10 CECE CN1CC[C@@H](N(C)Cc2cc(Cl)ccc2O)CC1=O 2131933121 AHNKLIITEHSOED-GFCCVEGCSA-N 282.771 2.098 10 10 CECE Cc1ccc(C(=O)Nc2ccc(O)cc2C(=O)O)cc1N 48847263 WUEIYQJVSHTMIL-UHFFFAOYSA-N 286.287 2.233 10 10 CECE CCN[C@]1(CO)CC[C@@H](Sc2nccs2)C1 86636361 VGJGJMRMYKYPSX-MWLCHTKSSA-N 258.412 2.128 10 10 CECE Nc1ccc(CCNC(=O)c2ccoc2Cl)cc1 236352468 MFLLPAFIPWFCNR-UHFFFAOYSA-N 264.712 2.488 10 10 CECE C[C@@H](NCC1(O)CCCC1)c1c(O)cccc1O 235200000 CEYTXUYZZGEQQC-SNVBAGLBSA-N 251.326 2.054 10 10 CECE [N-]=[N+]=NC[C@H]1CNC(=N)N1c1ccccc1Cl 93378794 JPDZWCZIYFIRLB-SSDOTTSWSA-N 250.693 2.363 10 10 CECE N[C@@H](c1ccc(Br)c(F)c1O)[C@H](O)C1CC1 95804051 QJKHDPILLOVBQO-VHSXEESVSA-N 290.132 2.065 10 10 CECE CNCc1ccc(N(C)CCCN(C)C)cc1Cl 234402701 HZRKAFQUXFILFO-UHFFFAOYSA-N 269.820 2.447 10 10 CECE O=[N+]([O-])c1cc(N2CCCC[C@H](F)C2)ccc1CO 2132058075 LWOFYDILDVHSFU-NSHDSACASA-N 268.288 2.416 10 10 CECE CN1CCCc2cc(CNC[C@@H]3CCCO3)ccc21 50286017 QBXHWDOQFKVCJR-HNNXBMFYSA-N 260.381 2.338 10 10 CECE CCCN[C@H](C)c1ccc(N(C)[C@H](C)CO)cc1O 252814451 SZHNSIXQDKZQMU-VXGBXAGGSA-N 266.385 2.270 10 10 CECE Oc1cc(Br)c(C2CCNCC2)c(F)c1O 258640196 UXFQMTLOENPIJR-UHFFFAOYSA-N 290.132 2.466 10 10 CECE O[C@@H]1CC[C@@H]2CN(c3ccc(CNC4CC4)cc3F)C[C@@H]21 252844014 BOWNVOIGMKAIFX-HACGYAERSA-N 290.382 2.285 10 10 CECE Cc1cc(/C=C/C(=O)O)ccc1N1C[C@H]2C[C@H]1CO2 388773677 GNYIOLYKMQWEKC-ZTGIWPAFSA-N 259.305 2.070 10 10 CECE CCOC(OCC)[C@@H](N)c1ccc2c(c1)CCN2CC 2163071264 MXQYIEJYDQIQDU-HNNXBMFYSA-N 278.396 2.468 10 10 CECE CCCn1cc([C@@](C)(O)c2ccc(N(C)C)cc2)nn1 2163077989 YPGYJVSNEMTPTI-HNNXBMFYSA-N 274.368 2.010 10 10 CECE CN1CCCc2cc([C@@]3(O)CCCC34CNC4)ccc21 2163092861 WLXBQIAGEMKOOQ-KRWDZBQOSA-N 272.392 2.030 10 10 CECE N[C@]1(c2ccc(N3CCCCC3)cc2)C[C@H]2COC[C@H]21 2163108601 XXCRCQCBWOHKNK-XKQJLSEDSA-N 272.392 2.497 10 10 CECE CCN1CCc2cc([C@@H](CC[C@@H](C)OC)NN)ccc21 2163155795 IRIBVYRCKUIRSA-IUODEOHRSA-N 277.412 2.389 10 10 CECE CCN(CC)c1ccc([C@@H](NN)c2cnc(C)o2)cc1 2163158913 UROONOVEOUPMPU-OAHLLOKOSA-N 274.368 2.382 10 10 CECE CCc1noc(C)c1CNCc1cc2c(cc1O)OCO2 292930681 JAICFMQNYOVWIY-UHFFFAOYSA-N 290.319 2.270 10 10 CECE CNCc1ccc(N2CC(OC)(C(F)(F)F)C2)c(F)c1 724133993 WPVKJTQOFJBTRH-UHFFFAOYSA-N 292.276 2.313 10 10 CECE CCN(CC)c1ccc(CN2CC(=O)N(C)[C@H](C)C2)cc1 800538000 ILJHTPRADWPDIS-CQSZACIVSA-N 289.423 2.195 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)C[C@H]3CC34CC4)ccc21 2165873246 XYZPDQFZBAGDMU-QMTHXVAHSA-N 271.364 2.136 10 10 CECE CNCc1ccc(N2CC[C@H]3OCC[C@@H]3C2)c(C)c1 724839431 WHVXNOIDTPUVOA-GDBMZVCRSA-N 260.381 2.330 10 10 CECE CCCNCc1ccc(N2CC(C[S@@](C)=O)C2)c(F)c1 2166649121 FKTBIBAJZGYBDG-HXUWFJFHSA-N 298.427 2.140 10 10 CECE COc1ccc(N2CC[C@@H](CNCc3cocn3)C2)cc1 818220140 FVHHSBLPBSNFIJ-ZDUSSCGKSA-N 287.363 2.299 10 10 CECE C[C@H](c1cc(C(F)(F)F)ccc1O)N1CCNCC1 575284811 FANLYEMWHLIWNU-SECBINFHSA-N 274.286 2.377 10 10 CECE CC[C@@H](N[C@H]1CNCCC1(F)F)c1ccccc1O 817979623 CATUTYKTUNFHNL-YPMHNXCESA-N 270.323 2.430 10 10 CECE CN(C)c1ccc(CNC(=O)/C=C\[C@H]2CCCO2)cc1 819021715 UWIPDCZJINZQMT-FJVVXJACSA-N 274.364 2.104 10 10 CECE C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccncc1 588403381 FTZZAKBQTQGHHD-USEMIUTHSA-N 284.315 2.383 10 10 CECE O=C(c1cc(O)cs1)N1CC[C@]2(C1)CC2(F)F 846662081 KHTGRQWIVMYRFJ-SNVBAGLBSA-N 259.277 2.325 10 10 CECE CC[C@@H](C(=O)O)N(C)Cc1ccc(N(C)C)c(F)c1 844938487 UYOAUNISJSGXPH-LBPRGKRZSA-N 268.332 2.187 10 10 CECE COc1cccc([C@@H](C)NCC[C@H]2CCOC2)c1O 846162716 JDDOXGMMWQPCBP-NEPJUHHUSA-N 265.353 2.478 10 10 CECE CCCCN(Cc1ccccc1O)C(=O)N[C@H](C)[C@@H](C)N 842008140 WBDVXOVJNQKVSR-CHWSQXEVSA-N 293.411 2.440 10 10 CECE COCCN(CCF)Cc1cc(C)cc(OC)c1O 853548460 CWOHHAWOZZIJRA-UHFFFAOYSA-N 271.332 2.127 10 10 CECE CC[C@H](COCC1CC1)NC(=O)c1cc(O)cs1 855284580 VMDCIWUZIRQYLY-SNVBAGLBSA-N 269.366 2.389 10 10 CECE Cc1ccc(O)c(CN[C@@H](C)CN(C)CCCN(C)C)c1 850353742 LKXOKDAJTCPCOA-HNNXBMFYSA-N 293.455 2.062 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@H]1C[C@@H](C(=O)O)C1 693013590 JTCXYHKNNVBEKB-KKZNHRDASA-N 267.300 2.387 10 10 CECE CC[C@H](C[C@H](C)O)N[C@@H](C)c1cc(C(=O)OC)ccc1O 866634753 UHULHARCYHHBKV-GMXVVIOVSA-N 295.379 2.379 10 10 CECE CC[C@H](NC[C@]1(CO)CCCOC1)c1ccccc1O 700936366 QHTNEYMUFLHANX-HOCLYGCPSA-N 279.380 2.222 10 10 CECE CN(C)CC[C@@H]1CCCN(c2ccc(CN)c(F)c2)C1 700976436 OXMJUASNRDBXFM-ZDUSSCGKSA-N 279.403 2.453 10 10 CECE CO[C@H]1C[C@@H](NCc2cc(Cl)ccc2O)C[C@H]1OC 1875526953 QAGDSIUEXVHNQO-UBSAEIQESA-N 285.771 2.328 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cnc(N)c(O)c1 1877545202 MUJYEUDKCZRAPT-VIFPVBQESA-N 259.309 2.272 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)C12CC(CO1)C2 1878419328 RYZPNDNFRFXCFP-DSSZZKGTSA-N 259.349 2.499 10 10 CECE 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COC(=O)[C@H]1CC[C@@](F)(CN2CC[C@H](N=[N+]=[N-])C2)CC1 2178574748 SQXOXVQNNYGWCL-GVXVVHGQSA-N 284.335 2.443 10 10 CECE Cc1ccc2c(c1)N(C(=O)C=C1CCNCC1)CC2 852825216 HQOFFXUHBYALAF-UHFFFAOYSA-N 256.349 2.194 10 10 CECE CC(C)c1nnc(C(=O)NCCc2ccc(N)cc2)s1 857764798 AYKPGNDVXWVQCI-UHFFFAOYSA-N 290.392 2.216 10 10 CECE CCC(F)(F)CNCc1cc([N+](=O)[O-])ccc1O 858259615 WCLFRSXBUJYMFO-UHFFFAOYSA-N 260.240 2.435 10 10 CECE Cc1cc(CC(=O)NC/C=C\CO)c(C)n1-c1ccccc1 855400314 AHZIXQRMPPEMMK-SREVYHEPSA-N 298.386 2.301 10 10 CECE COc1cccc([C@H](C)N[C@@H]2C[C@H](C)n3ncnc32)c1O 850499455 PYBYDRZKWWWHLW-JBLDHEPKSA-N 288.351 2.349 10 10 CECE C[C@@H]1C[C@H](N[C@H]2CCC(=O)N(C)C2)c2c(O)ccc(F)c21 756595494 WCEWIJUZSCBAFR-SCVCMEIPSA-N 292.354 2.290 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H]3CCCOC3)C2)cc1 850489934 YGBJYHXMYPOVDD-UONOGXRCSA-N 276.380 2.043 10 10 CECE COC[C@@H](O)CN[C@@H](C)c1ccc(Cl)c(Cl)c1O 756589583 MGNVKELTJZUHIL-YUMQZZPRSA-N 294.178 2.357 10 10 CECE Cc1cc(O)c(CNCCc2cncn2C)c(Cl)c1 857782909 JGUJCTJAEURORE-UHFFFAOYSA-N 279.771 2.420 10 10 CECE Cc1ccc(O)c(CN(C)[C@H]2CCN(C3CC3)C2)c1 769325846 BSBDCIFWFFJABZ-HNNXBMFYSA-N 260.381 2.369 10 10 CECE C[C@H](NCc1ccc(F)c(F)c1O)[C@H](O)C(F)(F)F 877693553 KAFNWSKXQCVJTO-RRAGMBSWSA-N 285.212 2.072 10 10 CECE CN(C[C@@H]1C[C@@H]1CF)c1ccc(CO)cc1[N+](=O)[O-] 1875814202 LZYXJKZEBBTEIY-MNOVXSKESA-N 268.288 2.129 10 10 CECE Cc1cc(CO)ccc1N(C)CC12CC(C1)[C@@H](C)O2 1878453362 CXWCAGLSBVPRQW-XEBKBJJBSA-N 261.365 2.491 10 10 CECE C[C@H]1[C@@H](C)SCCN1CC(=O)Nc1ccc(N)cc1 132179871 UKRWJRKHQNIUGG-WDEREUQCSA-N 279.409 2.033 10 10 CECE C[C@H]1SCCN(CC(=O)Nc2ccc(N)cc2)[C@@H]1C 132179693 UKRWJRKHQNIUGG-GHMZBOCLSA-N 279.409 2.033 10 10 CECE CC(C)NC(=O)[C@H](C)N(C)[C@@H](C)c1ccccc1O 1877537280 FIEBYYUQTOYSRK-RYUDHWBXSA-N 264.369 2.298 10 10 CECE COC(=O)[C@@H]1C[C@H]1CN(C)[C@@H](C)c1ccccc1O 1877532474 GLXSUPUQWNBABF-GMXVVIOVSA-N 263.337 2.194 10 10 CECE COc1c(O)ncnc1N[C@H](C)c1ccccc1O 1877585541 GGYSURSFRGJFGH-MRVPVSSYSA-N 261.281 2.070 10 10 CECE COc1cnccc1[C@@H](C)NC(=O)c1cc(O)cs1 783962660 YMXQPIYLXHUPJT-MRVPVSSYSA-N 278.333 2.348 10 10 CECE CCC[C@H](COC)C(=O)N(C)Cc1ccccc1O 1879013342 JSOFAPIVKZYLQN-CYBMUJFWSA-N 265.353 2.413 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@H](CO)C2)c(F)c1 1880926494 FSLDEAVMVJUAEO-UWVGGRQHSA-N 270.323 2.193 10 10 CECE C[C@H]1CN(c2ccc(OCC(F)F)cc2)C[C@H]1CN 1879916124 ZARVEFDXOFZJQL-WDEREUQCSA-N 270.323 2.362 10 10 CECE FC(F)(F)COc1ccc(N2C[C@@H]3C[C@H]2CN3)cc1 1879917136 GRILXOMCNBBOII-ONGXEEELSA-N 272.270 2.178 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H]3OCC[C@@H]3C2)c(F)c1 1880490589 PWPBPWIYQHOULL-IGJMFERPSA-N 269.291 2.243 10 10 CECE COC[C@@H]1C=CCN1c1c(F)cc([C@@H](C)O)cc1F 1880479490 NVUIGPPYYGUVCN-KOLCDFICSA-N 269.291 2.409 10 10 CECE COC(=O)Cc1ccccc1NC(=O)c1cc(O)cs1 1149322219 WRNLIQSBRHLCNW-UHFFFAOYSA-N 291.328 2.422 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1CCc2ccccc2CC1 1146876854 MMHRWAYAWRSHQT-UHFFFAOYSA-N 297.354 2.268 10 10 CECE CCN[C@H](C)c1ccc(N2[C@H]3COC[C@H]2C3)cc1O 1899635759 RPIFLNAHVPHIKA-RAIGVLPGSA-N 262.353 2.040 10 10 CECE C[C@H](N[C@@H]([C@@H](C)O)C(F)(F)F)c1ccc(F)cc1O 1882717410 SDIDWXOFAXGCGZ-CVJICSNFSA-N 281.249 2.494 10 10 CECE O=C(NCc1c(O)cccc1O)c1cc2ccccn2c1 1156881232 VJRLSMOZIWUJLN-UHFFFAOYSA-N 282.299 2.281 10 10 CECE COc1cc2c(cc1OC)N(CC(=O)O)CC[C@H]2C 84802053 JAYRZXZSJUHPLA-SECBINFHSA-N 265.309 2.102 10 10 CECE COc1ccc(CN[C@](C)(CN)C(C)C)cc1C 1963436142 AMZGVZFWESRSTB-OAHLLOKOSA-N 250.386 2.467 10 10 CECE OC[C@@H](NCc1c(O)cccc1F)[C@H]1CC=CCC1 1885066539 BSFVZRSIBTWEOL-SMDDNHRTSA-N 265.328 2.338 10 10 CECE COC[C@@H]1C[C@@H]1Nc1c(N)cccc1Br 1962218773 PGOGERWZJFDSLV-XVKPBYJWSA-N 271.158 2.478 10 10 CECE CC(C)(N)c1nc2cc(N)ccc2n1-c1ccc(N)cc1 76014619 IYMOTENKLSJBRY-UHFFFAOYSA-N 281.363 2.384 10 10 CECE Nc1ccc(CN[C@H]2c3ccccc3C[C@H]2O)cc1 83399468 BCXCWDYXQHPDQO-CVEARBPZSA-N 254.333 2.017 10 10 CECE N[C@@H](c1ccc(O)c(O)c1)c1nnc(C2CCCC2)o1 83543738 JLYDNHIQIDWREI-LBPRGKRZSA-N 275.308 2.187 10 10 CECE C[C@H](c1ccc2c(c1)CCCN2C)N1CCNCC1 84895932 RRCOGXOPLBBEQI-CYBMUJFWSA-N 259.397 2.035 10 10 CECE COCCN(Cc1ccccc1O)[C@H]1CCCOC1 1888785094 HNSATCCUHYWDGG-AWEZNQCLSA-N 265.353 2.020 10 10 CECE COc1cc(Cl)cc(CN[C@H]2CC23CC(O)C3)c1O 724975606 OGDOGWFAMOBEBQ-KHJSKFAYSA-N 283.755 2.057 10 10 CECE Oc1c(F)cccc1CNC[C@]1(O)C[C@H]2CCC[C@@H]21 1890989772 ZWNUXHDGBJJXGF-IFUGULHKSA-N 265.328 2.172 10 10 CECE Nc1ccc(CCNc2nc[nH]c3nccc2-3)cc1 705210471 OCUBFYHSOXVTIY-UHFFFAOYSA-N 253.309 2.146 10 10 CECE Oc1cccc(Br)c1CN[C@H]1CCCOC1 706868365 KCZFONAXSIXZSO-VIFPVBQESA-N 286.169 2.423 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@H]2CN(C)CCO2)cc1Cl 707791368 RDJOUPVXTYAQTE-DGCLKSJQSA-N 298.814 2.160 10 10 CECE Nc1ccc(C[C@@H](O)c2nccc(C(F)F)n2)cc1 1892563612 UQDOUWFJSIUXPH-LLVKDONJSA-N 265.263 2.273 10 10 CECE CN(C)c1ccc(CN2C[C@]3(C)CNC[C@@]3(C)C2)cc1 707859904 VMLHMVBDINKZLW-IRXDYDNUSA-N 273.424 2.184 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H](C)[C@@H](CO)C2)cc1 709223905 NHBVINYIBIPSJQ-XPKDYRNWSA-N 262.397 2.422 10 10 CECE CN1CCc2cc(CN[C@H]3COC4(CCC4)C3)ccc21 688285166 WUDZTRZJAKPMMH-OAHLLOKOSA-N 272.392 2.480 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H]1C[C@H]2CCCN(C2)C1 717453588 MDCBHJQTURKVSP-IUODEOHRSA-N 277.387 2.205 10 10 CECE CC[C@@H]1CN(c2ccc(CN(C)C)cc2)[C@@H](C)CN1 689490168 CUXPHXCHEDHYLY-DZGCQCFKSA-N 261.413 2.325 10 10 CECE CN(C[C@H]1CCCCS1)C(=O)c1ccc(O)c(O)c1 718203031 FCVIJECMRRPPJS-LLVKDONJSA-N 281.377 2.456 10 10 CECE C[C@@H](O)c1ccc(N2CCS[C@H](CO)C2)c(Cl)c1 720033931 VRMRJGBXXFOVSE-KOLCDFICSA-N 287.812 2.307 10 10 CECE COc1cc(N)c(N(C)[C@@H](CO)C(C)(C)C)cc1OC 690114915 LOGPJKQBKVWDGV-AWEZNQCLSA-N 282.384 2.129 10 10 CECE C[C@H](NCC[C@@H]1CC(=O)N(C)C1)c1ccc(F)cc1O 723544684 BJQMSBLNNKVWGS-WDEREUQCSA-N 280.343 2.050 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCCC4(CC4)C3)ccc21 695074551 VCWGTPLSASHWQD-AWEZNQCLSA-N 271.364 2.280 10 10 CECE COc1ccc(CNCC2(O)CCC(C)CC2)c(O)c1 87044514 HBQZDKWVDQSKGL-UHFFFAOYSA-N 279.380 2.432 10 10 CECE COC(=O)c1cc(OCCOCC2CC2)ccc1N(C)C 1335496958 FEZPGKLNIIKWNA-UHFFFAOYSA-N 293.363 2.345 10 10 CECE Nc1cc2c(cc1N1CCCC[C@H]1CF)OCCO2 2115158526 KXQFLOLKSPKMAX-JTQLQIEISA-N 266.316 2.368 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC[C@H]2C(F)F)cc1 2115233302 QMJLZPVKYHQPKN-QWHCGFSZSA-N 269.339 2.092 10 10 CECE C[S@](=O)C1CN(c2ccc(CNC(C)(C)C)cc2)C1 2115313424 HFFHEEXXYCKCQM-IBGZPJMESA-N 280.437 2.142 10 10 CECE COC1(OC)CC[C@H]1CN[C@H](C)c1ccccc1O 2116760885 ISJYDPWOEIAEAX-NEPJUHHUSA-N 265.353 2.442 10 10 CECE CN(c1cc2c(cc1N)OCCO2)[C@@H]1CCC[C@H]1F 2118950694 LMQUULQZAKOBFO-MWLCHTKSSA-N 266.316 2.367 10 10 CECE C[C@H](C(=O)NCc1cc(Cl)ccc1O)c1cnccn1 1628679900 CSCVLIRVMBQYJW-VIFPVBQESA-N 291.738 2.256 10 10 CECE CCc1cc(C(=O)NCc2cc(O)ccc2O)ccc1O 1637125942 IJRRHTWFUTUOCH-UHFFFAOYSA-N 287.315 2.296 10 10 CECE O=C1/C(=C/c2ccc(O)c(O)c2)N=C2CCCCCN12 5072380 BEWNXCQREHNWDR-FLIBITNWSA-N 272.304 2.253 10 10 CECE Cc1cn2ccc(C(=O)NCc3ccccc3O)cc2n1 1636058128 RFDWFUVUAORTSN-UHFFFAOYSA-N 281.315 2.278 10 10 CECE C[C@H]1CN(C(=O)c2cc(O)cs2)Cc2cncnc21 1633007503 IUBHNTHAPLNVKD-QMMMGPOBSA-N 275.333 2.003 10 10 CECE COc1ccc(C(=O)NCc2cc(C)ccc2O)o1 1641733331 RGQSAEYJDIXKQB-UHFFFAOYSA-N 261.277 2.232 10 10 CECE CCc1cc(NCc2c(O)cccc2O)nc(C)n1 1651449678 LUHLQZODWUPJIR-UHFFFAOYSA-N 259.309 2.371 10 10 CECE COc1cccc(O)c1CNCc1cc(C2CC2)n[nH]1 1964569233 FSKUGXGRSZMUGW-UHFFFAOYSA-N 273.336 2.291 10 10 CECE C[C@H]1C[C@@H](CNCc2ccc(F)cc2O)CCO1 1964600260 HQJBYSNTNVASQZ-QWRGUYRKSA-N 253.317 2.436 10 10 CECE CC1(C)CCN(Cc2ccccc2O)[C@H](C(=O)O)C1 1964723339 LQPILXGUHOCXPY-LBPRGKRZSA-N 263.337 2.467 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(N)=O)c1cccc(Cl)c1F 166896167 GPAZOPOQNLOBTG-SNVBAGLBSA-N 285.710 2.296 10 10 CECE Cc1cc(/C=C/C(=O)OCC(N)=O)c(C)n1-c1ccccc1 7308638 ZRIXCSRMUKHVHC-CMDGGOBGSA-N 298.342 2.136 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1ccc(CCN)cc1 2132771060 QPMVBLJCSGVPPI-UHFFFAOYSA-N 258.321 2.294 10 10 CECE C[C@H]1CN(/N=N/c2ccc(CC(=O)O)cc2)C[C@H](C)O1 1860480831 HEKSCWXLFZBOIG-NRRXASIESA-N 277.324 2.422 10 10 CECE C[C@@H](CNC(=O)Cc1ccc(N)cc1)c1cccnc1 1865956744 GUZBJRDEABDICF-LBPRGKRZSA-N 269.348 2.126 10 10 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10 10 CECE CC[C@@H](N)c1ccc(N(C)CCS(=O)(=O)C(C)C)cc1 2170456156 XPFSXWSZQSKKIZ-OAHLLOKOSA-N 298.452 2.356 10 10 CECE CCCN1CC[C@@H](N(C)c2ccc(CNC)cc2F)C1 2160082537 IMDKKQYRVVXNAG-CQSZACIVSA-N 279.403 2.466 10 10 CECE CCCc1noc(CN(C)c2ccc(CN)cc2F)n1 2160394716 JQFHXKXIUPRVLS-UHFFFAOYSA-N 278.331 2.256 10 10 CECE O=C1CCN(Cc2c(O)cccc2F)CCCCCN1 2160781483 GIRUIDQIQLKPGY-UHFFFAOYSA-N 280.343 2.024 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CC[C@@]23CCCO3)cc1 2160707703 HFPDYEABADKHIN-CVEARBPZSA-N 276.380 2.172 10 10 CECE Nc1ccc(CCC(=O)NCC[C@@H]2CC2(F)F)cc1 701972194 QBVJWDKLIDJJNJ-LLVKDONJSA-N 268.307 2.363 10 10 CECE CN(CC(=O)N1CCCCCCC1)c1ccc(N)cc1 702069684 PRQOKUQPBKHTFR-UHFFFAOYSA-N 275.396 2.498 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3CN(C)CC[C@H]32)c(F)c1 2170942734 QBLWQMZOIDFHIZ-OSAQELSMSA-N 278.371 2.409 10 10 CECE CCNCc1ccc(N2C[C@@H]3CN(C)C[C@H]3C2)cc1C 706984736 ZYQJJAACIHZHFS-HOTGVXAUSA-N 273.424 2.102 10 10 CECE CN(C)c1ccc([C@H](NN)c2cnc(C3CC3)o2)cc1 707638822 YMAFIIMGYRNQBV-AWEZNQCLSA-N 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260.381 2.422 10 10 CECE C[C@@H]1CC[C@@](O)([C@@H](N)c2ccc3c(c2)CCN3C)C1 2106848055 CKUSUFUWASNJHH-RLCCDNCMSA-N 260.381 2.230 10 10 CECE CCC[C@H](O)[C@H](NC)c1ccc2c(c1)CCCN2C 2106946271 WEQVWOZJQVELTP-JKSUJKDBSA-N 262.397 2.491 10 10 CECE CCN1CC[C@H](N(C)[C@H](C)c2ccccc2O)C1=O 2087192465 AWCCNTGARYVZEG-YPMHNXCESA-N 262.353 2.006 10 10 CECE CN1CCc2cc([C@H](N)c3sccc3CN)ccc21 2107782417 PMCMREBBEOUFHE-AWEZNQCLSA-N 273.405 2.247 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)c1nncs1 2107990380 LWVINMRDUTTXLC-CYBMUJFWSA-N 274.393 2.229 10 10 CECE NCc1ccc(N2[C@H](CO)C[C@H]3CCC[C@@H]32)c(F)c1 2108592674 UCQFHCDYVYRYQG-DYEKYZERSA-N 264.344 2.024 10 10 CECE COc1cccc(CN[C@H]2CCOCC[C@@H]2C)c1O 2109096213 NEUBDBIWDAZXHE-AAEUAGOBSA-N 265.353 2.306 10 10 CECE C[C@H](NC[C@H]1CC2(CC2)CO1)c1c(O)cccc1O 2110095634 DMRMBKIDQRAHII-WDEREUQCSA-N 263.337 2.318 10 10 CECE CC(C)c1noc(CN(C)Cc2ccc(N)cc2)n1 2092478930 RSFBRKXBTITXOM-UHFFFAOYSA-N 260.341 2.407 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3[C@@H](CO)[C@@H]3C2)c(Cl)c1 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CCN1CC[C@H](N(CC)c2ccc(CN)c(OC)c2)C1 2204540407 XVKOVJLDQWMVIS-HNNXBMFYSA-N 277.412 2.074 10 10 CECE COc1cc(N2CCC[C@@H]3COCC[C@H]32)ccc1CN 2204557241 NMNXCIHZHIHHGX-UKRRQHHQSA-N 276.380 2.159 10 10 CECE Cc1cccc(CNC(=O)c2ccc(C(=O)O)s2)c1O 2204625249 RGBCHRBBBBTVPU-UHFFFAOYSA-N 291.328 2.390 10 10 CECE COc1ccc(N2CCCC[C@H](CO)C2)c(F)c1 2219607867 FPSROGOIQCSYGF-NSHDSACASA-N 253.317 2.433 10 10 CECE COc1cc(C)c(N2C[C@@H](O)C[C@H](F)C2)cc1C 2219602157 OKVGQPWPCUPXFM-RYUDHWBXSA-N 253.317 2.221 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@]2(F)CCOC2)cc1 2222365634 DOGMKPPJQOJATI-RISCZKNCSA-N 253.317 2.305 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1ccccc1C(=O)O 2234171794 OQBNACTXMRHWRF-GHMZBOCLSA-N 274.280 2.346 10 10 CECE OC[C@@H]1CN(c2ccc(OCC(F)(F)F)cc2)C[C@@H]1F 2235087048 GAROTDRFIPJLBE-CABZTGNLSA-N 293.260 2.394 10 10 CECE C[C@H]1CCC[C@@H](COC(=O)COc2ccc(N)cc2)O1 2235172092 NREIUMWJCSJTOQ-FZMZJTMJSA-N 279.336 2.148 10 10 CECE OC1CC2(CCCN(c3ccc4c(c3)OCCO4)C2)C1 2235103422 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OCc1ccc(N2CC[C@H](OC(F)(F)CF)C2)c(F)c1 2239154440 AYJPDCDLLQEJOY-JTQLQIEISA-N 293.260 2.476 10 10 CECE Fc1cc(CNC2CCC2)ccc1N1CC2(COC2)C1 2240080073 VVVWKSUVKNPYDU-UHFFFAOYSA-N 276.355 2.304 10 10 CECE CC[C@H](C)NCc1ccc(N2CCC[C@@H]2C(N)=O)cc1 2240027370 XIJZRPVFASGQKC-SWLSCSKDSA-N 275.396 2.029 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1ccc(CN)cc1Br 2251030507 JQYVNJWPEHDCGH-DGCLKSJQSA-N 299.212 2.257 10 10 CECE Cc1nsc(CN[C@H](C)c2c(O)cccc2O)n1 2254078064 UIZPAJDNGAKINS-SSDOTTSWSA-N 265.338 2.109 10 10 CECE COc1c(F)cc(N2C[C@@H](C)NC[C@H]2C)cc1F 2256196644 MMKZMKYTFKAONR-RKDXNWHRSA-N 256.296 2.160 10 10 CECE CNCc1cnc(Sc2nc3nccnc3s2)s1 2256524064 FUVDYFVCSVTBSZ-UHFFFAOYSA-N 295.418 2.413 10 10 CECE CSC1CC(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2248491092 DRYYRPQUCYLRCI-UHFFFAOYSA-N 254.359 2.429 10 10 CECE CSc1ncc(CNC[C@]2(N)C[C@@H]3CCC[C@@H]32)s1 2259949443 QKQJFMAMWGXODP-XHVZSJERSA-N 283.466 2.472 10 10 CECE COc1cc(OC)c(N(C)C[C@H]2CCNC2)cc1Cl 2270363329 ZECDXGVMGNSNMR-JTQLQIEISA-N 284.787 2.403 10 10 CECE 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COc1ccc(CNCCCc2cnn(C)c2)cc1C 237134663 QXMOYNGMJSRHFX-UHFFFAOYSA-N 273.380 2.460 10 10 CECE CCCN1CCC(NC(=O)CCc2ccc(N)cc2)CC1 49550887 KZMVGPDVJAOMCJ-UHFFFAOYSA-N 289.423 2.192 10 10 CECE CCCNCc1ccc(N2CCCC[C@H]2C(=O)NC)cc1 42423984 KDBNPFYTNHKWCF-INIZCTEOSA-N 289.423 2.291 10 10 CECE Nc1ccc(N=c2c(Cl)c[nH]cc2[N+](=O)[O-])cc1 381124825 ZDGDYZVNWSTQDC-UHFFFAOYSA-N 264.672 2.391 10 10 CECE CCN([C@@H](C)CC(=O)O)[C@@H](C)c1ccc(O)cc1O 86763348 BBLNGVUMJVETLA-UWVGGRQHSA-N 267.325 2.344 10 10 CECE COc1cc(Cl)cc(CN(C)[C@@H]2CCOC2)c1O 228660241 PEDBFOPQOTXOQR-LLVKDONJSA-N 271.744 2.275 10 10 CECE CCOC(=O)CCCNCc1cc(Cl)ccc1O 81545280 PAIJMEWNBAAITQ-UHFFFAOYSA-N 271.744 2.479 10 10 CECE CNCc1ccc(N2CCC[C@@](C)(O)CC2)c(C)c1 230360081 OSCQJVAWILSCRR-MRXNPFEDSA-N 262.397 2.456 10 10 CECE O[C@H](CNCc1ccc2c(c1)CCO2)Cc1ccccc1 237968948 ANRPYWIHTDKVRW-KRWDZBQOSA-N 283.371 2.315 10 10 CECE Nc1ccc(CCS(=O)(=O)c2cccc(F)c2)cc1 94623406 GXQZOGKJBJBAGQ-UHFFFAOYSA-N 279.336 2.424 10 10 CECE 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2.031 10 10 CECE C[C@H](CCN(C)C(=O)COc1ccc(N)cc1)C(F)F 2166582478 ZYTGHJLRURVMOL-SNVBAGLBSA-N 286.322 2.397 10 10 CECE Oc1ccc(CNC[C@H]2C[C@H]3[C@@H](C2)C3(F)F)c(O)c1O 2164002358 OZBKUMAYDAMVOO-SLGCYQGISA-N 285.290 2.184 10 10 CECE CCN1CCc2cc([C@@H](NC)C3CCNCC3)ccc21 2164084666 YLKFESBMDJNMKV-KRWDZBQOSA-N 273.424 2.329 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CC[C@H]4CC[C@H]3C4)cc21 2168814736 WVWSBFNCSKMMPQ-ZETOZRRWSA-N 271.364 2.042 10 10 CECE CCO[C@H]1C=CCN(c2ccc([C@@H](C)NC)c(O)c2)C1 2165077143 ZNXBGRCNPZFIDQ-OCCSQVGLSA-N 276.380 2.454 10 10 CECE COc1ccc(CNC(=O)[C@@H]2CCCC[C@@H]2OC)c(O)c1 816551020 LRTQMNPOVODJMY-HIFRSBDPSA-N 293.363 2.222 10 10 CECE CCCN(Cc1ccccc1O)C(=O)COCCOCC 727168646 SYEINRSDJNVCFR-UHFFFAOYSA-N 295.379 2.184 10 10 CECE Cc1cn(C)nc1C[C@@H](O)c1ccc(N(C)C)cc1 723996407 KKVHLUCEMUPXHR-OAHLLOKOSA-N 259.353 2.071 10 10 CECE COC(=O)c1ccc2c(O)c([N+](=O)[O-])sc2c1 725307547 BZPWDCUJPAFSSY-UHFFFAOYSA-N 253.235 2.302 10 10 CECE C[C@@H](CCC(=O)O)Sc1ncc([N+](=O)[O-])s1 386290351 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C[C@H](NC[C@@]12CC[C@@H](CO1)C2)c1c(O)cccc1O 1878830396 YOAAMTSXJIYFCU-RWSFTLGLSA-N 263.337 2.318 10 10 CECE CN[C@H](C)c1cc(F)c(N2CCC[C@@H](O)C2)c(F)c1 1880960075 GDRPGDBPZXNPAK-MWLCHTKSSA-N 270.323 2.206 10 10 CECE [N-]=[N+]=NCCCN1CC(n2cc(Br)cn2)C1 1900017123 OHBTZWZOEIUCTC-UHFFFAOYSA-N 285.149 2.203 10 10 CECE CSc1ncc(CNC2CC3(CC(N)C3)C2)s1 2248698744 CNBMIGNGIWSKRZ-UHFFFAOYSA-N 269.439 2.225 10 10 CECE COc1ccc(N2CC[C@H](c3nncs3)C2)c(N)c1 1886543153 YBIAJQLHRHTADE-VIFPVBQESA-N 276.365 2.123 10 10 CECE C[C@@H](CCNC(=O)OC(C)(C)C)C(=O)N(C)CCN=[N+]=[N-] 1885562855 LSNQNHUJEMJCCS-JTQLQIEISA-N 299.375 2.306 10 10 CECE CC[C@H]1NC[C@]1(O)c1ccc(N2CCCCC2)cc1 1887979087 DGJMBRMKFSEYCU-CVEARBPZSA-N 260.381 2.246 10 10 CECE Cc1nc(C)c([C@H]2NCCc3cc(O)c(O)cc32)s1 83724083 LVCSXFINPZAQFF-ZDUSSCGKSA-N 276.361 2.406 10 10 CECE CC(=O)N(C)c1ccccc1C(=O)NCCCN=[N+]=[N-] 701292198 WQWKPNQLBIFFNB-UHFFFAOYSA-N 275.312 2.100 10 10 CECE COC[C@@H](N1CCCC[C@H](CN=[N+]=[N-])C1)C(C)(C)O 1888985126 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CCN1CC[C@@H](N(C)[C@@H]2CCc3cccc(O)c32)C1 688551442 PLLJLGNBIVMRHH-ZIAGYGMSSA-N 260.381 2.406 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCC(F)CC2)cc1 689455663 ANUMMYKKRNIGEJ-HNNXBMFYSA-N 265.376 2.186 10 10 CECE C[C@H]1CN(CCC(=O)Nc2ccc(N)cc2)C[C@@H](C)S1 70382075 RMTINVQEOGBCOK-TXEJJXNPSA-N 293.436 2.423 10 10 CECE Oc1c(F)cccc1CN1CCO[C@@H](C(F)(F)F)C1 698952724 FEEQJIXEBQIXCA-SNVBAGLBSA-N 279.233 2.294 10 10 CECE CN(C(=O)OCc1ccccc1)[C@@H](CN=[N+]=[N-])C(=O)O 91314551 OCMUGGPAXGNBTP-JTQLQIEISA-N 278.268 2.019 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H](CCO)C(F)F)c1 1918555377 XWMKXXQBRHRCSX-GZMMTYOYSA-N 275.295 2.068 10 10 CECE C/C(=C\C(=O)N1CCSc2ccncc21)c1cnccn1 1435391588 NUDKAJDLTRUKET-DHZHZOJOSA-N 298.371 2.414 10 10 CECE COc1ccc(CNOCC(F)(F)C(F)F)c(O)c1 2117449917 GRLMFCMPGGKJGK-UHFFFAOYSA-N 283.221 2.322 10 10 CECE Oc1cc(Cl)ccc1CN[C@@H]1CCCC12OCCO2 1474750235 YMCQCZCWAVNYLM-CYBMUJFWSA-N 283.755 2.431 10 10 CECE CN(c1cc2c(cc1N)OCCO2)[C@H]1CCC[C@H]1F 2118950692 LMQUULQZAKOBFO-KOLCDFICSA-N 266.316 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2.230 10 10 CECE CN1CC[C@@H](N(C)c2ccc(CN)cc2C(F)(F)F)C1 313024131 PJLHBJFMKVUTJU-LLVKDONJSA-N 287.329 2.304 10 10 CECE COc1ccc(C)cc1[C@H](NCCCN=[N+]=[N-])C(=O)O 2157905053 VYHPKVKPFQOJMM-LBPRGKRZSA-N 278.312 2.419 10 10 CECE CCN([C@H](C)C1CC1)S(=O)(=O)Cc1ccc(N)cc1 324215932 OXRUMPFKANCJSI-LLVKDONJSA-N 282.409 2.219 10 10 CECE COCCNCc1ccc(N2CC(CCF)C2)c(F)c1 2159106439 CBFMHTYIRBRRPR-UHFFFAOYSA-N 284.350 2.358 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC12CC(C(=O)O)C2 2160910300 XTHOMTULXJNXOB-YLTRJXTNSA-N 277.320 2.098 10 10 CECE CS[C@H]1CC[C@H]1NC(=O)CCc1ccc(N)cc1 702017342 QCBJUXWCLPKOTJ-OLZOCXBDSA-N 264.394 2.212 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@@H](CCO)C2)cc1Cl 2172871525 NDANRUQPKMCYNA-AAEUAGOBSA-N 298.814 2.208 10 10 CECE COc1ccc([C@@H](C)NCc2ncccn2)c(O)c1 702342754 VYFZBRKOHQULIT-SNVBAGLBSA-N 259.309 2.042 10 10 CECE CC(C)[C@@]1(O)CCCN(c2ccc([C@H](C)N)c(O)c2)C1 710211231 JSRBWMJJIYYQFB-BLLLJJGKSA-N 278.396 2.399 10 10 CECE CC[C@H]1CCN(c2ccc3c(c2)OCCO3)[C@@H](CN)C1 2162625153 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C[C@@H]1[C@H](N(C)C)CCN1Cc1cc(F)ccc1O 380990548 FKAFQCFYLDNQPQ-ZWNOBZJWSA-N 252.333 2.056 10 10 CECE CN(Cc1c(O)cccc1Cl)C1CC(C(=O)O)C1 693008479 OZPHKYCTNKAVDI-UHFFFAOYSA-N 269.728 2.341 10 10 CECE CCN[C@H](C)c1ccc(N2CCN3CC[C@H]2C3)c(F)c1 381772444 JRNIOUYMVWFCCV-OCCSQVGLSA-N 277.387 2.391 10 10 CECE CN(CCc1ccc(N)cc1)C[C@H]1CCSC1 718284761 YBNUZNZETBMJSF-CYBMUJFWSA-N 250.411 2.496 10 10 CECE CC(C)(O)[C@@H]1CCN(c2ccc(CN)c(Cl)c2)C1 721841406 ZRILXZIYZABKQQ-LLVKDONJSA-N 268.788 2.396 10 10 CECE Nc1ncc(F)cc1OCc1ncccc1Cl 723417689 PNZINUHVFLXPIZ-UHFFFAOYSA-N 253.664 2.430 10 10 CECE CCNCc1ccc(N2C[C@@H]3[C@@H](CO)C[C@H]3C2)cc1C 2174310988 UDIYNTVVUSXQNU-UXLLHSPISA-N 274.408 2.169 10 10 CECE C[C@@]1(NS(=O)(=O)Cc2ccc(N)cc2)CC=CCC1 398467653 LYKPFSKWGZEASA-CQSZACIVSA-N 280.393 2.187 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H](C)C[S@](C)=O)cc1 398883276 JDQNBGNJGSHNAJ-FMTVUPSXSA-N 268.426 2.170 10 10 CECE CNCc1cc(F)c(N(C)C[C@@H]2CCOC2)c(F)c1 399276700 VWTWOFVSKRODNX-JTQLQIEISA-N 270.323 2.157 10 10 CECE 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1860486297 WQNFQTVVOMILMJ-CCEZHUSRSA-N 267.329 2.289 10 10 CECE O=C(NCc1cccc(O)c1O)c1ccccc1F 1455314083 BVHMUHWTRBGCTK-UHFFFAOYSA-N 261.252 2.167 10 10 CECE CO[C@H]1COC[C@H]1N(C)c1ccc([C@H](C)N)cc1Cl 2120774963 IPCPZXUWXGNCIM-FZZIBODNSA-N 284.787 2.210 10 10 CECE CC(C)(F)C1CN(C(=O)CCc2ccc(N)cc2)C1 2122384051 DZBFFFYHBCUVKM-UHFFFAOYSA-N 264.344 2.408 10 10 CECE CC(C)(F)C1CN(c2ccc([N+](=O)[O-])c(CO)c2)C1 2122385095 ITDCOYNPIMLJCR-UHFFFAOYSA-N 268.288 2.271 10 10 CECE COC[C@H](CC(C)(C)C)NC(=O)Cc1ccc(O)c(O)c1 1639244320 OQYPXLHVTREILZ-LBPRGKRZSA-N 295.379 2.208 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NC[C@H]2CCCOC2)cc1 1568433415 TVZJRGGNPDOKMF-SNVBAGLBSA-N 290.323 2.005 10 10 CECE COc1cccc(F)c1C(=O)NCc1cccc(O)c1O 1633507389 HRIDJIRGBVULNU-UHFFFAOYSA-N 291.278 2.176 10 10 CECE O=C(NCc1c(O)cccc1F)c1cnn2ccccc12 1645047909 CIQPCXNVJRFTFA-UHFFFAOYSA-N 285.278 2.109 10 10 CECE CC(C)[C@@]1(C)C[C@@H]1C(=O)NCc1cc(O)ccc1O 1593873737 ZAQZEFHNOIZABJ-IUODEOHRSA-N 263.337 2.396 10 10 CECE COc1cccc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])n1 2125337498 SVIMGQXXXVIDTG-SECBINFHSA-N 261.285 2.005 10 10 CECE C[C@H]1CN(C)CC[C@H]1N(C)Cc1ccc(F)cc1O 1964576504 XDFAPCWMWDQQQT-SMDDNHRTSA-N 266.360 2.303 10 10 CECE Cc1c(CN[C@@H]2C[C@@H]2[C@@H](C)O)n(C)c2ccccc12 2125867547 NDMOCZJMLADSJV-MRVWCRGKSA-N 258.365 2.346 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@@H]1COC2CC1C2 2126702542 FBLTUWNUDPIZRT-SRHKJQAYSA-N 268.307 2.037 10 10 CECE COCCNCc1ccc(N(C)CC2(O)CCCC2)cc1 161869446 OPXHFHRGJURBDZ-UHFFFAOYSA-N 292.423 2.164 10 10 CECE CC[C@@H](O)CN(c1ccc2c(c1)CC[C@H]2O)C1CC1 2128322870 RFUTULZPJRTHQG-GDBMZVCRSA-N 261.365 2.406 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3O)C[C@H]1F 2128268957 MUZFOLLVINHDCA-RBSFLKMASA-N 265.328 2.229 10 10 CECE O[C@H]1CCC12CN(c1ccc3c(c1)CCC[C@H]3O)C2 2128278958 JFFDLFOZMHKMHQ-CABCVRRESA-N 259.349 2.017 10 10 CECE C[C@@H]1C[C@@H]1N(CCO)c1ccc2c(c1)CCC[C@H]2N 2128268718 KNDUUHJKFUFXCS-LYRGGWFBSA-N 260.381 2.230 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCC[C@@H]3O)[C@@H]1CO 2128273151 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[N-]=[N+]=NC1CN(Cc2nc(O)c3cc(Cl)ccc3n2)C1 1912144626 WJWMIIVZPYKTAU-UHFFFAOYSA-N 290.714 2.483 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(Cc2nc(O)c3ccccc3n2)C1 1912171229 IAQFSVXCIHUQGK-SECBINFHSA-N 270.296 2.220 10 10 CECE [N-]=[N+]=NC1CN(Cc2ccc(F)cc2[N+](=O)[O-])C1 1912195818 HHKWCABULJFECZ-UHFFFAOYSA-N 251.221 2.228 10 10 CECE Cc1nn(C(C)C)cc1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912177290 DHZQZICAWWUUQR-JTQLQIEISA-N 262.317 2.297 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(OC(F)F)cc2)C1 1912162877 BUJCTMJNJGSAAP-UHFFFAOYSA-N 268.223 2.423 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)[C@@H]2CCSC2)C1 1912149542 HXHUUSIIRIDXRV-NXEZZACHSA-N 254.359 2.288 10 10 CECE COc1ccc(N(C)[C@H]2C[C@H]3CC[C@@H](N3)[C@@H]2F)cc1 2134077726 FPBCQVHAXRYACM-RABLLNBGSA-N 264.344 2.362 10 10 CECE NCc1ccc(N2[C@H]3CC[C@@H]2[C@H]2CC[C@@H]3O2)c(F)c1 1900504604 ZHIXFZYHEXEUFE-NMWPEEMBSA-N 262.328 2.183 10 10 CECE COC1CC(N(C)c2ccc(CN)c(F)c2F)C1 1914764835 IREXYSYYUYDXNM-UHFFFAOYSA-N 256.296 2.037 10 10 CECE CC(C)[C@@H]1C[C@@H]1CN(C)C(=O)c1ccc(O)c(O)c1 2135382856 LVDNAJHWSASESG-NEPJUHHUSA-N 263.337 2.462 10 10 CECE CNCc1ccc(N2CCN(C)C(C)(C)C2)c(C)c1 110731338 BRWFVUWNMZFLBF-UHFFFAOYSA-N 261.413 2.245 10 10 CECE CC(C)[C@@H](Sc1ncc([N+](=O)[O-])s1)C(=O)O 226766501 JSPPXVSLXVBYNC-ZCFIWIBFSA-N 262.312 2.253 10 10 CECE CN1CCCc2cc(CN3CC[C@]4(CCN4)C3)ccc21 1922998747 BBAIVVJMYIYVLF-QGZVFWFLSA-N 271.408 2.007 10 10 CECE CC1(C)CCCO[C@H]1CNCc1ccc(O)cc1O 1923780972 ANLYULCBJOQRMV-AWEZNQCLSA-N 265.353 2.393 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3[C@H](O)CC[C@H]3C2)c(F)c1 228048127 HQMYSIDSIUKWBW-APAOZMKASA-N 264.344 2.053 10 10 CECE CC(C)C[C@H](C)NC(=O)[C@@H]1CNc2ccccc2N1 229877176 AHTUAZYRLVLKIR-FZMZJTMJSA-N 261.369 2.443 10 10 CECE COc1ccc(N(C)[C@H]2CCNC[C@@H]2C)c(F)c1F 2136986718 IZDLEPOQXKHVQV-UWVGGRQHSA-N 270.323 2.408 10 10 CECE COc1cc(N(C)[C@H]2CCOC[C@@H]2C)ccc1CO 2139701745 XBEVRICVDFTJOA-FZMZJTMJSA-N 265.353 2.049 10 10 CECE Cc1cccc(CNC(=O)[C@](C)(N)C(C)(C)C)c1O 2139763323 FXSXXNOAMMRHLR-HNNXBMFYSA-N 264.369 2.080 10 10 CECE COc1cc(N2CC[C@H](OC)[C@@H](C)C2)ccc1CO 2139701768 XFNVPJLFZQLGNW-FZMZJTMJSA-N 265.353 2.049 10 10 CECE CCN(CC)C[C@H](C)N[C@H](C)c1c(O)cccc1O 233424015 HDOIVEWJSJSHRR-NWDGAFQWSA-N 266.385 2.479 10 10 CECE CCN[C@@H](CC)c1ccc(N2CCNC(=O)CC2)cc1 233528981 VWTQTRYXNHLBPP-HNNXBMFYSA-N 275.396 2.074 10 10 CECE COCCN(Cc1ccc(Cl)cc1O)C[C@@H]1CCCN1 2146318611 BAWVXQFTNXYIHP-AWEZNQCLSA-N 298.814 2.246 10 10 CECE Oc1ccc(CN(C[C@H]2CCCCN2)C2CC2)c(O)c1 236589663 OXWNLCLRTVDHRU-CYBMUJFWSA-N 276.380 2.204 10 10 CECE CN(Cc1cc(Br)ccc1O)C[C@@H]1CCNC1 1948869538 PJCBOOOWHFLCHV-SNVBAGLBSA-N 299.212 2.196 10 10 CECE CC(C)(C)OC(=O)Nc1ccc(O)c([C@@H]2NCC[C@H]2O)c1 1952344783 UZLQXCYITJDEBR-OLZOCXBDSA-N 294.351 2.135 10 10 CECE COC(=O)[C@@H]1CCN[C@@H]1c1c(C)n(C)c2ccccc12 1952856739 BRXGKARCVCKCIT-DOMZBBRYSA-N 272.348 2.310 10 10 CECE C[S@](=N)(=O)Cc1cc(O)c(O)c(Br)c1 1953078267 XZPVZZXQYSHDRX-AWEZNQCLSA-N 280.143 2.037 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CCCC[C@H]2O)cc1O 252932037 UZHUYTYOMJBWQS-ZLKJLUDKSA-N 264.369 2.152 10 10 CECE OC[C@H](CNCc1c(O)cccc1F)C1CCC1 1972471684 LSZCIVXFCBSWMU-NSHDSACASA-N 253.317 2.030 10 10 CECE Cc1cc(OCCOC(F)F)ccc1N1CCNCC1 2150249019 LMUWCFIQDHJPDX-UHFFFAOYSA-N 286.322 2.023 10 10 CECE NCc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]32)c(F)c1F 2143968172 OZHXAHIFWUCPFJ-USWWRNFRSA-N 282.334 2.163 10 10 CECE CC(C)(CO)c1ccc(C(F)(F)F)c(O)c1O 258331275 IVJRCRBVRWGMDX-UHFFFAOYSA-N 250.216 2.387 10 10 CECE CCCCNC(=O)[C@@H](C)N(CC)Cc1ccc(N)cc1 35364044 OPRKYGBNIMAWSN-CYBMUJFWSA-N 277.412 2.396 10 10 CECE COc1cc(NCCc2ccc(O)c(O)c2)ccc1N 2148013457 VUWAWTZAOGCZNM-UHFFFAOYSA-N 274.320 2.343 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@H]2CCCS2)cc1 1999526756 DYACRARQIVAHDZ-STQMWFEESA-N 251.399 2.153 10 10 CECE Nc1ccc(OCC(=O)NCc2cccc(F)c2)cc1 40302176 KILUBUNLBGUIHN-UHFFFAOYSA-N 274.295 2.103 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCc2nccn2C)c1 40639061 VBDFGPNXMMAPEI-GFCCVEGCSA-N 259.353 2.327 10 10 CECE C[C@@H]1CC[C@@H](CN(C)c2ccc3c(c2)NC(=O)[C@@H]3N)S1 2151685042 ZIEGVLXRTGSCMF-OLUVUFQESA-N 291.420 2.359 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3OCCO[C@@H]3C2)cc1Cl 2151742188 ZONFMXWFHIIMDJ-VCTAVGKDSA-N 296.798 2.354 10 10 CECE Nc1ccc(OCCC(=O)N2CCS[C@@H]3CC[C@H]32)cc1 2152188986 KSRODPQYWSSDFZ-ZIAGYGMSSA-N 292.404 2.144 10 10 CECE C[C@@H](CCO)N(C)c1cc(Cl)c(CN)cc1F 2008208117 ZEUUIXCYXHQBFD-QMMMGPOBSA-N 260.740 2.145 10 10 CECE Nc1ccc(NC(=O)N2CC[C@H]([C@@H]3CCOC3)C2)cc1 2153039011 POLVMANCHXHFCA-NWDGAFQWSA-N 275.352 2.159 10 10 CECE Nc1ccc(OCCC(=O)NCC[C@H]2C[C@H](F)C2)cc1 2153212527 WUOYYCUGJTVHFQ-HAQNSBGRSA-N 280.343 2.292 10 10 CECE COc1cc(N(C)[C@H](C)CSC)ccc1CO 2024763291 QINCRRDYCCTLBL-SNVBAGLBSA-N 255.383 2.375 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)C[C@H](C)C1CC1 2027626763 SAXPHYMZFNWUQC-JTQLQIEISA-N 269.366 2.488 10 10 CECE C[C@H](Nc1c(N)cccc1Cl)[C@H]1CCS(=O)(=O)C1 2029396179 FVUXEZKQHLOEAR-IUCAKERBSA-N 288.800 2.157 10 10 CECE CC(C)n1cc(NC(=O)COc2ccc(N)cc2)cn1 61682300 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CECE CC1(C)CCCN(c2c(F)cc(CN)cc2F)[C@@H]1CO 2185813360 SWUGTSXTWTUTJR-CYBMUJFWSA-N 284.350 2.411 10 10 CECE CN(c1ccc2c(c1)OCCO2)[C@H]1CCNCC12CC2 2185906898 GVMRNDRLPGGKOR-HNNXBMFYSA-N 274.364 2.036 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@@H](N3CCC3)C2)c(F)c1 2194689625 LOZAMDPOCPEROZ-ZYHUDNBSSA-N 281.350 2.269 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@](C)(O)[C@@](C)(O)C2)c(Cl)c1 2194617626 HBDQSOSAQXLTMM-KMUNFCNLSA-N 299.798 2.105 10 10 CECE CC[C@@H](CN(C)c1ccc(CNC)cc1F)OC 2068252473 BWDKLLLDGPGXIW-LBPRGKRZSA-N 254.349 2.406 10 10 CECE CN1CCCc2cc([C@H](N)[C@H](O)[C@@H]3CCCS3)ccc21 2191435601 YKEZYWXZAJCZTE-HRCADAONSA-N 292.448 2.325 10 10 CECE C[C@@H](NC[C@@H]1CC(C)(C)O1)c1ccc(O)cc1O 2069136446 SWSKJWBCUJXAGT-KOLCDFICSA-N 251.326 2.316 10 10 CECE COC[C@H]1C[C@H]1CN(C)c1ccc(CN)cc1F 2069575906 PALRYMNNHAZTTE-NWDGAFQWSA-N 252.333 2.003 10 10 CECE CN[C@H](C)c1cc(F)c(N(C)CC(F)(F)CO)c(F)c1 2194702960 QOUWULOZODDTIY-MRVPVSSYSA-N 294.292 2.309 10 10 CECE COC(=O)[C@@H](C)CN(C)[C@@H](C)c1ccccc1O 2072460966 LPZDQDSDZLIYMW-QWRGUYRKSA-N 251.326 2.194 10 10 CECE CCC[C@H](COC)C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 2073171564 BAJWPOYFHVRNIY-GHMZBOCLSA-N 254.334 2.350 10 10 CECE CN(CC[C@@H]1CCOC1)Cc1cc(F)ccc1O 2075511603 PEQPZMJZQHMQED-LLVKDONJSA-N 253.317 2.390 10 10 CECE COCC(CNCc1cccc(Cl)c1O)COC 2078673063 QWSHOLGTXDHCKF-UHFFFAOYSA-N 273.760 2.044 10 10 CECE C[C@@H]1CCO[C@H]1CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2101083932 MRENZHXMTBHNLF-WOPDTQHZSA-N 266.345 2.350 10 10 CECE C[C@]1(NC(=O)c2ccc(O)c(O)c2)C[C@H]1C(F)(F)F 2102401627 KSUZFAIEIPTAOM-KOLCDFICSA-N 275.226 2.169 10 10 CECE CN[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1C 2104183786 SCFKOOSFTWDGHY-CZUORRHYSA-N 261.413 2.182 10 10 CECE COc1cccc(O)c1CN1[C@H](C)CCC[C@@H]1CN 2104438112 MBOUJQMKELRGDR-VXGBXAGGSA-N 264.369 2.103 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H]2CN(C)C)cc1 2104576028 WDHVXOGXHXANGP-CZUORRHYSA-N 261.413 2.497 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3COC[C@@H]3C)ccc21 2106795518 HRXSRSSIZUESAO-PJODQICGSA-N 260.381 2.351 10 10 CECE CNC[C@@](O)(c1ccc2c(c1)CCN2C)C(C)(C)C 2106797773 DRHFYFRZGCZYDP-MRXNPFEDSA-N 262.397 2.132 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1CCCCN1 2106826623 VFAWSHWULMCOEO-JKSUJKDBSA-N 260.381 2.462 10 10 CECE CCC[C@@H](O)[C@@H](NCC)c1ccc2c(c1)CCN2C 2106859256 HFKSJGCACGJMDN-CVEARBPZSA-N 262.397 2.491 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H](N)CCSC)ccc21 2106805103 JJRXQBSJCOZTLR-ZFWWWQNUSA-N 280.437 2.183 10 10 CECE CCNCc1ccc(N2CC=C[C@@H](OC)C2)c(C)c1 2108772519 HPQYRVOBJGCEAZ-OAHLLOKOSA-N 260.381 2.496 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2CC[C@H](CO)C2)c1O 2090019447 VGSOGLDBISVCGD-JOYOIKCWSA-N 285.771 2.305 10 10 CECE COc1ccc(N2CCC[C@H]3OCC[C@@H]3C2)c(N)c1 2095533269 WICTZOOACKBERP-IAQYHMDHSA-N 262.353 2.283 10 10 CECE C[C@]12CCO[C@H]1[C@@H](NCc1ccc3c(c1)CCO3)C2 2097844076 XGKYIXRNXNRQSJ-CWRNSKLLSA-N 259.349 2.279 10 10 CECE COc1cc([C@@H](N)c2ccc3c(c2)CCN3C)sn1 2098415913 GSJNLDFDILKQDK-AWEZNQCLSA-N 275.377 2.192 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@]2(C)CSCCO2)cc1O 2201255326 RHWRDXNVJRLSSW-NHYWBVRUSA-N 296.436 2.370 10 10 CECE CN(Cc1cc(F)cc(F)c1O)[C@H]1CCCCNC1 2112846109 BNIAVJFRIASRGP-LBPRGKRZSA-N 270.323 2.244 10 10 CECE COc1ccc(N2CC[C@H]2C(=O)O)c(Br)c1 2211845895 PCQFWXQFKCUBBT-JTQLQIEISA-N 286.125 2.121 10 10 CECE COc1ccc(N2CCN[C@@H](C)C2)c(Br)c1 2211844852 FKGXCOHOCHCWCH-VIFPVBQESA-N 285.185 2.256 10 10 CECE COc1ccc(N2C[C@@H](N)C[C@]23CCCOC3)cc1Cl 2203009800 JAAPWXCASBTOMB-NHYWBVRUSA-N 296.798 2.435 10 10 CECE C[C@]1(C2CCCC2)NC(=O)N(c2ccc(N)cc2)C1=O 2203933519 PGWBGJGXVNKUEU-OAHLLOKOSA-N 273.336 2.274 10 10 CECE COc1cc(N2CCC3(CCOCC3)C2)ccc1CO 2204543208 KHJIKIPBWYWJKK-UHFFFAOYSA-N 277.364 2.194 10 10 CECE COc1cc(N(C)[C@H]2COCCC2(F)F)ccc1CO 2204536447 NBANIMCYYFQSOC-ZDUSSCGKSA-N 287.306 2.048 10 10 CECE COC[C@]12C[C@](CNCc3cc(Cl)ccc3O)(CO1)C2 2206066615 VFDFFRPDRCLFJW-GASCZTMLSA-N 297.782 2.331 10 10 CECE Cc1nc([C@H](O)Cc2ccc(N)cc2)cn1C(F)F 2269400465 YSUVGNHXEAUABP-GFCCVEGCSA-N 267.279 2.445 10 10 CECE C[C@@H]1C[C@@H]2CN([C@@H](CN)c3ccc(N(C)C)cc3)C[C@@H]21 2206539411 QNASDTKMLYJQJS-WNOSKKOXSA-N 273.424 2.340 10 10 CECE COC[C@H]1CC[C@H]1N(C)c1cc(OC)c(OC)cc1N 2207395363 CEGRTGAGMGLQQQ-ZYHUDNBSSA-N 280.368 2.147 10 10 CECE CSc1ncc(CNCc2cccnc2O)s1 2208531482 ALIVECLULWFPDZ-UHFFFAOYSA-N 267.379 2.255 10 10 CECE COc1ccc(N(C)C2CC(F)(F)C2)c(CO)c1 2220429088 OBMKAZOZZBCRGY-UHFFFAOYSA-N 257.280 2.421 10 10 CECE C[C@@H](O)c1ccc(N2CC(OC(F)(F)F)C2)cc1 2221844749 FBVXYKCQIPTUSJ-MRVPVSSYSA-N 261.243 2.465 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@@]2(C)C[C@]2(CO)C1 2232106090 YSSPEICPYZZMMC-APHBMKBZSA-N 260.381 2.223 10 10 CECE OC[C@H]1CCC2(CCC2)N1c1ccc2c(c1)OCCO2 2235114259 ZANWBDXBITWHQR-CYBMUJFWSA-N 275.348 2.342 10 10 CECE CNCc1cc(F)c(N2C[C@H](C)C[C@H](O)[C@@H]2C)c(F)c1 2235880583 HCIPCHYRNLRBAT-BFVZDQMLSA-N 284.350 2.280 10 10 CECE COc1ccc(N2CCCC[C@H]2CN(C)C)c(CO)c1 2235999344 IHJVGFPOVOQJCS-AWEZNQCLSA-N 278.396 2.108 10 10 CECE C[C@@H]1CN[C@@H](C)[C@@](O)(c2ccc(N3CCCC3)cc2)C1 2235905216 MXCANQGULMRAMU-GRDNDAEWSA-N 274.408 2.492 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H]4C[C@H]3CC[C@@H]4O)ccc2O1 2226704673 XLTIESDZQQKLQM-OPQSFPLASA-N 259.349 2.360 10 10 CECE COc1ccc(N2CCC[C@H](CO)CC2)cc1OC 2226797707 FUWVVIZFEJTKQN-LBPRGKRZSA-N 265.353 2.303 10 10 CECE CC1(C)CN(c2ccc3c(c2)COCC3)C[C@@H]1CO 2226710030 CZDIPVIQYRQDAZ-CQSZACIVSA-N 261.365 2.214 10 10 CECE COc1ccc(N(C)[C@H]2CCOC[C@H]2F)c(C=O)c1 2227702702 NIWIKSNJQQSHLS-OCCSQVGLSA-N 267.300 2.071 10 10 CECE CC[C@@H](C)NCc1ccc(N2CCNC(=O)C2)cc1Cl 2240016097 DYGCIBDOGHNTOK-LLVKDONJSA-N 295.814 2.164 10 10 CECE Cc1cc(N2CC=C[C@H](O)C2)ccc1CNC1CCC1 2240056219 JHPFXZXLDDLLTL-KRWDZBQOSA-N 272.392 2.374 10 10 CECE C[C@H](N)c1ccc(N(C)CC2COC2)c(Cl)c1 2248985311 OIRVPIDQRDPAOI-VIFPVBQESA-N 254.761 2.442 10 10 CECE O[C@H]1CCN(c2ccc(OCF)cc2)CC12CC2 2263854066 RESAPWWUAUXDLX-ZDUSSCGKSA-N 251.301 2.344 10 10 CECE C[C@H](C1CNC1)N(C)c1ccc(OC(F)F)cc1 2263936005 WNLKSCWWDNLTLA-SECBINFHSA-N 256.296 2.332 10 10 CECE C[C@H]1CCN(c2ccc(OCF)cc2)C[C@H]1CO 2263940614 RPYNLVKHHOEGTI-RYUDHWBXSA-N 253.317 2.447 10 10 CECE C[C@]1(CO)C=CCCN1CCCOc1ccc(N)cc1 2279074631 UMVHFCFDYUXMQH-MRXNPFEDSA-N 276.380 2.051 10 10 CECE COC[C@@]1(C)C[C@H]1CN(C)c1ccc(CO)cc1F 2269262622 ZQFFFYGRPIANTJ-SWLSCSKDSA-N 267.344 2.427 10 10 CECE CCN[C@H](C)c1ccc(N2CC([C@@H](C)O)C2)cc1C 2269670465 YHSYHJUFZROUSO-CHWSQXEVSA-N 262.397 2.483 10 10 CECE CNCc1ccc(OC)c(COCCOC(F)(F)F)c1 2279825192 SKSNUYUHUPKEEQ-UHFFFAOYSA-N 293.285 2.468 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCOC(C)(C)[C@@H]1CO 2282824101 CMNVKEARZUFWIJ-WFASDCNBSA-N 279.380 2.024 10 10 CECE Cc1cc(N(C)CCN2CCCC2=O)ccc1[C@@H](C)O 2285154555 UUJLWBVPNSDMIN-CYBMUJFWSA-N 276.380 2.107 10 10 CECE COc1ccc(N2CC[C@@H]3NCC[C@@H]3C2)c(OC)c1C 2295431428 WOTPPRXEKYHHME-OLZOCXBDSA-N 276.380 2.200 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H]3CN[C@@H](C)C3)ccc21 2285616089 KVMXMNGSTBGEBC-OGHNNQOOSA-N 274.408 2.491 10 10 CECE CN(C(=O)C[S@@](=O)CC1=CCCC1)c1ccc(N)cc1 2296255462 KJWRSUCXYIIDQN-FQEVSTJZSA-N 292.404 2.091 10 10 CECE COc1ccc2c(c1)CCN2C(=O)C=Cc1cnn(C)c1C 2304162989 KYDGQHDHGRKWCF-UHFFFAOYSA-N 297.358 2.340 10 10 CECE COC[C@@H](NCc1c(C)cccc1O)C(F)(F)F 2314957904 IVEXECHRPZQFIS-LLVKDONJSA-N 263.259 2.368 10 10 CECE C[C@@H](CN(C)C)N(C)[C@H](C)c1c(O)cccc1O 2326774507 HOULNKZHJSKODG-WDEREUQCSA-N 252.358 2.041 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)C[C@@H]2C[C@H]1C[C@@H]2F 2329126434 HPLQEYNQIPMTMO-GSZDYRQJSA-N 265.328 2.152 10 10 CECE OC[C@]12C[C@H]1CC[C@H]2N[C@@H]1CCc2cccc(O)c21 2331790962 XGZKNBCGSYGLNM-ZNEHSRBWSA-N 259.349 2.130 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3CC[C@H]2C[C@@H]3O)c(F)c1 2337139005 ZDWBPNVAMSVXCS-LIBKGXAOSA-N 265.328 2.229 10 10 CECE COC(=O)[C@@](N)(CSc1nccs1)[C@H]1CC12CCC2 2345027026 IKJHYXBABSXBMD-TVQRCGJNSA-N 298.433 2.296 10 10 CECE CO[C@@H]1COCCN(c2ccc([C@@H](C)O)cc2Cl)C1 2351659212 BJNVTDJKEUSVEU-PWSUYJOCSA-N 285.771 2.245 10 10 CECE CSc1cc(N2C[C@H](C)C(O)[C@@H](C)C2)ccc1CN 2353852334 SRUXYPQBVGYCSN-QWRGUYRKSA-N 280.437 2.320 10 10 CECE O=C(O)CCCNC1=NC(=O)/C(=C/c2ccccc2)S1 6495801 ABSSFPHEQXSSAY-LUAWRHEFSA-N 290.344 2.111 10 10 CECE CC(C)N(CC(N)=O)c1ccc(CNC(C)(C)C)cc1F 62737576 JSERSGATGXSWGW-UHFFFAOYSA-N 295.402 2.414 10 10 CECE Oc1c(CN[C@@H]2C[C@H]3[C@@H]4CC[C@@H](O4)[C@@H]23)ccc(F)c1F 2356935115 UCSYEZSXJIIGAO-JUJYEKSXSA-N 281.302 2.326 10 10 CECE CCN([C@H](C)c1c(O)cccc1O)C(C)(C)C(=O)O 300443317 UWUSNQRRUQYYIX-SECBINFHSA-N 267.325 2.344 10 10 CECE COCCN1CCC(CN[C@H](C)c2ccccc2O)CC1 183484741 IYYFIRZAICKBQG-CQSZACIVSA-N 292.423 2.401 10 10 CECE COc1ccc([C@H](C)N(C)C2CCN(C)CC2)c(O)c1 131724628 QNZMQFAFIUEGFF-LBPRGKRZSA-N 278.396 2.488 10 10 CECE CCOc1ccc(O)c(CN(C)C[C@@H]2CCCO2)c1 128099541 FPQFMMKXQHAHMC-AWEZNQCLSA-N 265.353 2.402 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@H](C)CN 124584003 PYOWXMLFYXLVGF-AWEZNQCLSA-N 291.439 2.476 10 10 CECE CN(C)CCCN(C)c1c(F)cc(/C=C\C(=O)O)cc1F 211983573 TYAJXZHLCKNPJR-WAYWQWQTSA-N 298.333 2.451 10 10 CECE CN(C)c1ccc(CN2CCC[C@H](Cn3cncn3)C2)cc1 128486269 XXVUUUBLGKKDKU-INIZCTEOSA-N 299.422 2.256 10 10 CECE COc1c(F)cc([C@@H](C)N)c(O)c1Br 218178273 ZUMCFTAFNGBESA-SCSAIBSYSA-N 264.094 2.322 10 10 CECE C[C@@H]1COc2ccccc2[C@@]1(NCCCN=[N+]=[N-])C(=O)O 228184748 IEXQXYSOHTWWJZ-QMTHXVAHSA-N 290.323 2.285 10 10 CECE OC[C@@H]1CCCC[C@@H]1NCc1cccc(F)c1O 226610110 UTPQPABHLNCDNX-AAEUAGOBSA-N 253.317 2.172 10 10 CECE CCN(C(=O)Nc1ccc(N)cc1)[C@H](C)COC 42782162 KTKQYOKMXBOEEA-SNVBAGLBSA-N 251.330 2.158 10 10 CECE CS[C@@H]1CC[C@H](NC(=O)c2ccc(O)c(O)c2)C1 227035437 LZRWEZALUHMXFK-VHSXEESVSA-N 267.350 2.112 10 10 CECE O[C@H]1CCN(c2ccc(CNC3CC3)c(Cl)c2)C1 236562245 GDRRBOSDEHOXGQ-ZDUSSCGKSA-N 266.772 2.163 10 10 CECE c1ccc(CCNCc2ccc(N3CCOCC3)cc2)nc1 236745123 QALRRFRYEANCRM-UHFFFAOYSA-N 297.402 2.251 10 10 CECE CN(Cc1cc(Br)ccc1O)[C@H](CN)C1CC1 234281542 KNEVKMAIHUQGLB-GFCCVEGCSA-N 299.212 2.324 10 10 CECE CCCN[C@@H](Cc1ncnn1C)c1ccc(N(C)C)cc1 97275336 IEVYLVZOEJYKFX-HNNXBMFYSA-N 287.411 2.165 10 10 CECE CCNCc1ccc(N2CCOCC2)cc1Br 233531075 NJPDGYJEVILFFH-UHFFFAOYSA-N 299.212 2.395 10 10 CECE Oc1ccccc1CNC[C@H]1CCN1C1CCCC1 527804827 BTZOFNWYZWYTOH-OAHLLOKOSA-N 260.381 2.499 10 10 CECE O=C(Nc1ccccc1-c1nc[nH]n1)c1cccc(O)c1O 1148218749 KBWUCGYUPVRLGC-UHFFFAOYSA-N 296.286 2.135 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@@H]2C)c(C#N)c1 384774826 HUGJYYIDERNLJK-WFASDCNBSA-N 273.380 2.017 10 10 CECE CCNC(=O)C1CN(c2ccc([C@H](C)NC)c(Cl)c2)C1 2168054219 FJHNXYCOCSPKBM-JTQLQIEISA-N 295.814 2.193 10 10 CECE CC[C@H](C(=O)OCC(=O)C(C)=O)c1ccc(F)cc1 808537878 VETLKBYDNZDJNY-LBPRGKRZSA-N 266.268 2.021 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)C[C@@H](C)C3CC3)ccc21 2164463246 PDEMVQLGPRNTEX-MEBBXXQBSA-N 273.380 2.382 10 10 CECE OC[C@@H](CNCc1cc(Cl)ccc1O)c1cccnc1 808430453 GQOYENNQIHIUAA-CYBMUJFWSA-N 292.766 2.306 10 10 CECE CC(=O)C(=O)COC(=O)C[C@H](C)c1ccccc1F 808511902 DGXQROPFJXAOOV-VIFPVBQESA-N 266.268 2.021 10 10 CECE CC(C)[C@H]1CNCCCN1c1ccc2c(c1)OCCO2 2162633717 AVMKIHUIRJVPOB-CQSZACIVSA-N 276.380 2.282 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H](CN)C(F)(F)F)ccc21 2163065918 GAYYRJULVOSDPT-WCQYABFASA-N 288.313 2.240 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@@H]1CCN(C)C1 2163068984 NYQAUHMEHXZAPP-WBVHZDCISA-N 273.424 2.281 10 10 CECE CCN1CCc2cc([C@H](NN)[C@@H]3C[C@H]3C(F)F)ccc21 2163161530 XMOKLBPDMHTYOF-BZPMIXESSA-N 281.350 2.475 10 10 CECE CN1CCCc2cc([C@H](N)[C@H](O)C3CC=CC3)ccc21 2163229731 LMJDKOUUZFHMQG-DLBZAZTESA-N 272.392 2.396 10 10 CECE CCCN(Cc1ccc(N)cc1)C[C@H]1CCNC(=O)C1 2165516213 MSFXDYQUCULOOU-AWEZNQCLSA-N 275.396 2.007 10 10 CECE CN1CCC[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 725846439 IOINDVRLKLTSKQ-NSHDSACASA-N 299.758 2.138 10 10 CECE CC[C@@](C)(NC(=O)c1cc(O)c(O)c(O)c1)C1CC1 2132349345 BWGGLRRYXDAUCD-CQSZACIVSA-N 265.309 2.112 10 10 CECE CO[C@@H]1CC[C@@H]1NCc1c(O)cccc1Br 724197445 JIQHPGHSEYORBR-CMPLNLGQSA-N 286.169 2.422 10 10 CECE C[C@H](N)c1ccc(N(C)CC(=O)NC2CC2)cc1Cl 723177346 RTAVKPCLGJJZIQ-VIFPVBQESA-N 281.787 2.075 10 10 CECE COc1ccnc(NNC(=S)Nc2ccccc2C)n1 914705073 ZFFXRHWMHYHQBF-UHFFFAOYSA-N 289.364 2.107 10 10 CECE NCc1cnc(Sc2nc3ncccc3o2)s1 2213515016 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O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1[C@H]2CCC[C@H]21 787718458 IXDMPXXJDKSZLO-CEPHBDLNSA-N 259.305 2.026 10 10 CECE O=C(O)[C@@H]1C[C@H]1c1csc(-c2ccc(O)c(O)c2)n1 1879524162 RLXVBHORLFLZFI-HTQZYQBOSA-N 277.301 2.409 10 10 CECE CC1(CNC(=O)c2cccc(O)c2O)CCSCC1 1879821631 OGQBUIKBDXUVMS-UHFFFAOYSA-N 281.377 2.361 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1CC[C@]1(N)c1ccccc1O 1957264242 CQQRTMXJWPSGLA-BDJLRTHQSA-N 292.379 2.481 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1COC[C@@H]1C1CC1 898375144 CBQLPGACEPAKKQ-YPMHNXCESA-N 269.291 2.185 10 10 CECE Nc1ccc(Cn2c(N)nc3cc4c(cc32)OCCO4)cc1 75948124 QEABSTHBKVURFG-UHFFFAOYSA-N 296.330 2.020 10 10 CECE Oc1ccccc1CN=c1[nH]nc([C@@H]2CCCO2)s1 1963629243 JKXRGQZRPPIFKF-NSHDSACASA-N 277.349 2.129 10 10 CECE COc1ccc2c(c1)CCN[C@@H]2c1cc(O)ccc1O 83598099 AJLXVZZXOGWIQE-INIZCTEOSA-N 271.316 2.342 10 10 CECE Oc1ccc2c(c1O)[C@@H](CC1CCOCC1)NCC2 83724454 VCDDUSBVYPYJDN-GFCCVEGCSA-N 263.337 2.101 10 10 CECE COc1cc2c(cc1Cl)N(CC(=O)O)C[C@@H]2C 84799100 VFAXADHGQVCFNZ-ZETCQYMHSA-N 255.701 2.357 10 10 CECE C[C@@H]1CN(c2ccc(CN)cc2)C[C@@](C)(C(F)F)O1 705122813 PPQQCXMYSXGDGD-YGRLFVJLSA-N 270.323 2.394 10 10 CECE Nc1ccc(NC(=O)CCCN2CC[C@@H]3C[C@H]32)cc1 706988737 ONJZUGKJDPFQIV-BXUZGUMPSA-N 259.353 2.082 10 10 CECE C[C@H]1CN(C)CCN(c2ccc(CNC3CC3)cc2)C1 707539600 KMHXNQVAQGJBIQ-AWEZNQCLSA-N 273.424 2.327 10 10 CECE Cc1cc(CO)ccc1N1CC(OCC(F)(F)F)C1 687946620 TYMPNTXPEVPFTE-UHFFFAOYSA-N 275.270 2.255 10 10 CECE C[C@@H](CO)CN(C)c1ccc(CO)c(Br)c1 688674199 DZHFYNWGAQPPEB-SECBINFHSA-N 288.185 2.006 10 10 CECE O=C(O)[C@H]1CN(Cc2cc(Cl)ccc2O)CC12CC2 715986649 FIKQRMZBHCMCQV-LLVKDONJSA-N 281.739 2.342 10 10 CECE COc1ccc(O)c([C@@H](C)NCC[C@@H](O)C(F)F)c1 716697636 GSODKLXGZVHGPX-PRHODGIISA-N 275.295 2.068 10 10 CECE COc1ccc(CN2CCC(C)(C(=O)O)CC2)c(O)c1 86776457 YOOZLZUJDKQREB-UHFFFAOYSA-N 279.336 2.088 10 10 CECE CCn1ncnc1CN(Cc1ccc(N)cc1)C(C)C 88595701 CCLGKSRXTWDKPA-UHFFFAOYSA-N 273.384 2.291 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])CCO[C@@H](C(C)C)C1 90259245 ZYZVIJDLJBGVMY-DGCLKSJQSA-N 284.360 2.023 10 10 CECE COc1cccc(CNC(=O)c2cccc(F)c2N)c1O 1445963335 BMSFSOYQVAPVID-UHFFFAOYSA-N 290.294 2.052 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](CO)C[C@H]2C)c(F)c1 2115829271 BZNIZKMBTAZNSG-WOPDTQHZSA-N 267.344 2.476 10 10 CECE Oc1ccc2ccccc2c1CN[C@@H]1[C@H]2COC[C@H]21 2118013085 AKIYBZHUAOFJOS-FOLVSLTJSA-N 255.317 2.280 10 10 CECE C[C@H](NC[C@H](O)CC(F)(F)F)c1c(O)cccc1O 2119070102 CMQUBSJGCOKNQM-JGVFFNPUSA-N 279.258 2.062 10 10 CECE CSCC1(CC(=O)NCc2cc(O)ccc2O)CC1 1471662037 LOVGKMGGLIVINZ-UHFFFAOYSA-N 281.377 2.247 10 10 CECE CN1CCc2cc([C@H](N)C=C3CCOCC3)ccc21 2120468491 VSXRTXUNYVJRSV-OAHLLOKOSA-N 258.365 2.416 10 10 CECE COc1ccc(N2CCN[C@H](CC(F)F)C2)cc1F 2120813853 FYDBKINCGICIRL-SECBINFHSA-N 274.286 2.268 10 10 CECE CN(c1cc(Cl)c(CN)cc1F)[C@H]1CN2CC[C@H]1C2 2120887111 KATCUFWLGPGQRI-XPTSAGLGSA-N 283.778 2.078 10 10 CECE C/C(=C/C(=O)N1CCc2cc(F)cnc21)c1cnccn1 1625350805 WBURYQCCAIWPQN-POHAHGRESA-N 284.294 2.003 10 10 CECE Cc1cc(CN)ccc1N1CC[C@@H]2[C@H](O)C(C)(C)[C@@H]21 2121680341 ARBNLTLXJKSCNQ-CFVMTHIKSA-N 260.381 2.049 10 10 CECE C[C@@H](C(F)F)N(C)C(=O)CCOc1ccc(N)cc1 2122246287 OXLLLGAJVJETKH-VIFPVBQESA-N 272.295 2.150 10 10 CECE CNCc1ccc(N2CC[C@@](F)(COC)C2)cc1C 2123219599 HDLFUNGFAQTPNZ-HNNXBMFYSA-N 266.360 2.279 10 10 CECE CN(Cc1ccc(N)cc1)c1nnc(C(F)(F)F)o1 2125101843 AQHKKOYQJSZORV-UHFFFAOYSA-N 272.230 2.307 10 10 CECE C[C@@H](OCc1ccc(N)cc1)C(=O)N1CCCCC1 20390888 ZWFLCWFFMULCCW-GFCCVEGCSA-N 262.353 2.186 10 10 CECE CN1CC[C@@H]2[C@H]1CCCN2c1ccc(CN)c(Cl)c1 2127351709 GZRXYWBCGATISL-HUUCEWRRSA-N 279.815 2.472 10 10 CECE CC[C@@H]1CCN(C(=O)c2ccn(-c3ccc(N)cc3)n2)C1 158102802 KQIMONDKTCLTLV-GFCCVEGCSA-N 284.363 2.327 10 10 CECE COC[C@@]1(F)CCN(c2ccc3c(c2)CC[C@H]3N)C1 2128312307 GKORDVNSZXIFKI-HUUCEWRRSA-N 264.344 2.197 10 10 CECE C[C@H](N)[C@H]1CN(Cc2c(O)ccc3ccccc23)CCO1 156406548 UOZIUFUUSGXLBW-YVEFUNNKSA-N 286.375 2.093 10 10 CECE OCCN(c1ccc2c(c1)CCC[C@H]2O)C1CCC1 2128276084 YQUYXXFATVPUMY-MRXNPFEDSA-N 261.365 2.408 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)CC[C@H]1O 2128275831 WVDPICKEEITMQW-LYRGGWFBSA-N 261.365 2.263 10 10 CECE CC[S@](C)(=O)=NCCN[C@@H](C)c1ccc(F)cc1O 2130750731 GMUDQOJXLZSOMJ-OVWNDWIMSA-N 288.388 2.300 10 10 CECE CN(CC1(O)CCCCC1)c1ccc(CN)cc1F 2129437254 QDWAGZQXHHTJQC-UHFFFAOYSA-N 266.360 2.416 10 10 CECE CO[C@H](CNCc1cccc(Cl)c1O)[C@H]1CCOC1 826822061 JXMQPMCWEFKCIF-WCQYABFASA-N 285.771 2.187 10 10 CECE Oc1c(F)cc(F)cc1CNC1C[C@@H]2CC[C@H](C1)O2 1965955853 AYLIBBRLYDQCSR-YOGCLGLASA-N 269.291 2.470 10 10 CECE COC(=O)c1ccc(CN2CCC[C@H](N=[N+]=[N-])C2)nc1 1912170614 ZMBGBENOIDHYNX-LBPRGKRZSA-N 275.312 2.143 10 10 CECE C[C@H](C(=O)NC1CCCCC1)N1CC[C@@H](CN=[N+]=[N-])C1 1912199419 RZMDZPMKIWAWGR-NEPJUHHUSA-N 279.388 2.456 10 10 CECE C[C@@H]1OCC[C@@H]1C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912173538 NVKHBUBDQQSSQN-SRVKXCTJSA-N 266.345 2.350 10 10 CECE CC(=O)c1c[nH]c(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)c1 1912155320 HIMHTTKCIFCXJA-JTQLQIEISA-N 275.312 2.380 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2cc(F)ccc2O)C1 1912143748 KFWISGYUYFYKHH-MRVPVSSYSA-N 250.233 2.056 10 10 CECE [N-]=[N+]=NCCCCN(CC(N)=O)Cc1ccccc1 1912175454 LXVKWAPZZJPJLP-UHFFFAOYSA-N 261.329 2.064 10 10 CECE CC1(C)C[C@](C)(CO)CN1c1ccc(CN)c(F)c1 2134831976 HBLJZAZVPIOOGP-HNNXBMFYSA-N 266.360 2.272 10 10 CECE COc1cccc(CNCc2nc(C)c(C)o2)c1O 220912150 GEDGIVIRIYGSPE-UHFFFAOYSA-N 262.309 2.295 10 10 CECE CNCc1ccc(N(C)C2COC2)c(C(F)(F)F)c1 1915679884 BZKMAEZXZMUFHR-UHFFFAOYSA-N 274.286 2.260 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2CC(O)C3)c([N+](=O)[O-])c1 111393351 SWGWMCFYQDNFQE-UWVGGRQHSA-N 278.308 2.096 10 10 CECE C[C@H]1CCO[C@@H]1CCNCc1cccc(O)c1O 1918126570 CACJJPXHMYMSGW-GXFFZTMASA-N 251.326 2.003 10 10 CECE COc1cccc(O)c1CNCCc1cncs1 1967763334 CMGHNYKZDVYVMK-UHFFFAOYSA-N 264.350 2.190 10 10 CECE C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)Nc1ccc(N)cc1 251656721 FVTYTDLCTBNZPQ-IJLUTSLNSA-N 261.369 2.469 10 10 CECE CO[C@@H](c1noc(Cc2ccc(N)cc2)n1)C1CC1 227333971 IHRSTDWGRJBQAM-CYBMUJFWSA-N 259.309 2.340 10 10 CECE Cc1ccc(O)c(CN[C@H]2C[C@H]2NC(=O)OC(C)(C)C)c1 227550728 ZMPDPJHCVYQWPG-QWHCGFSZSA-N 292.379 2.456 10 10 CECE Cc1sccc1-c1noc(-c2nnsc2N)n1 1923224252 FLPSSWJWJMGXIX-UHFFFAOYSA-N 265.323 2.207 10 10 CECE C[C@H](CNC(=O)OC(C)(C)C)NCc1ccc(N)cc1 1923883439 NHULKJOJQIAVLX-LLVKDONJSA-N 279.384 2.272 10 10 CECE CN1CC[C@@H](NCc2cc(F)cc(F)c2O)C1(C)C 1924373691 MMNQMRLZHVHNMP-GFCCVEGCSA-N 270.323 2.243 10 10 CECE CC(=O)NC1CCN(c2ccc([C@H](C)N)c(Cl)c2)CC1 228279641 UAHAUJXTYJEKQO-JTQLQIEISA-N 295.814 2.465 10 10 CECE COc1ccc(N(CCO)CCC(C)C)c([N+](=O)[O-])c1 1924504145 PZQSRQLRGIXLJS-UHFFFAOYSA-N 282.340 2.448 10 10 CECE COc1cc(Cl)cc(CN[C@H]2CCCN(C)C2)c1O 228671975 WPDIWFNVPHYGKM-LBPRGKRZSA-N 284.787 2.238 10 10 CECE Cc1ccc(CN2CCC[C@H]3CC[C@@]32CN)c(O)c1 2139756713 YHCQGSGHYWKBOX-GOEBONIOSA-N 260.381 2.404 10 10 CECE CC[C@H]1OCC[C@@H]1CNCc1ccc(OC)cc1O 234182378 VPJASNLZRDFWOA-IUODEOHRSA-N 265.353 2.306 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@H]1C[C@H]2COCC[C@@H]2O1 2148974599 VWHLDEZEQCWUCA-WHOFXGATSA-N 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Cc1ccc(CNC(=O)CCc2ccc(N)cc2)n1C 158112208 RMZBDMHVAVJRSW-UHFFFAOYSA-N 271.364 2.165 10 10 CECE CC(C)CNC(=O)CN(c1ccc(CN)cc1)C(C)C 34655271 UTDLZKUDPAOADX-UHFFFAOYSA-N 277.412 2.132 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H]3COCC[C@@H]32)cc1 2145002787 IMKWSSKUEOQIKV-ZFWWWQNUSA-N 273.332 2.400 10 10 CECE CC1(C)[C@H]2C[C@H](C(=O)NCc3cc(N)ccc3O)C[C@H]21 2149976215 KBXULWSYOGFRQC-CGJHYDBRSA-N 274.364 2.273 10 10 CECE COc1ccc(O)c(CNCc2nc(C)cc(C)n2)c1 2149969976 GEFDRPFDXZHZIN-UHFFFAOYSA-N 273.336 2.097 10 10 CECE CSC[C@H]1C[C@H](NCc2cccc(O)c2O)C1 2004097845 YJSHKEJFSYKIKI-HOMQSWHASA-N 253.367 2.329 10 10 CECE CCN(CC)CCN1CCc2cc([C@H](C)N)ccc21 162091455 VNTWSAWGDVMGMU-ZDUSSCGKSA-N 261.413 2.411 10 10 CECE CN(CCc1ccc(N)cc1)C1CCN(C2CC2)CC1 2145797498 ZNIUOSUHLPONLO-UHFFFAOYSA-N 273.424 2.370 10 10 CECE CN[C@@H](c1ccccc1O)c1cccc2c1OCCO2 2146241232 KNVJPTFCCFXOKG-HNNXBMFYSA-N 271.316 2.472 10 10 CECE CC(=O)c1ccc(O)c(CN2CC(C)(C)C[C@@H]2CO)c1 2151113968 RKBBKFBEIWYZNL-CQSZACIVSA-N 277.364 2.188 10 10 CECE COCCN1CCC[C@@H](NCc2ccc(Cl)cc2O)C1 2146319927 IFEIEGNZQCICFJ-CQSZACIVSA-N 298.814 2.246 10 10 CECE CCNCc1ccc(N2CC[C@H](C)[C@H]2C(N)=O)c(Cl)c1 2146465221 TVLZNCHEPRXHBS-HZMBPMFUSA-N 295.814 2.150 10 10 CECE CCCOCCCN1CCN(c2ccc(N)cc2)C1=O 2149026861 HVMRFBDKRGQTGJ-UHFFFAOYSA-N 277.368 2.328 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)C1CCCC1 40302685 XMZUBBRCIJZDRJ-UHFFFAOYSA-N 262.353 2.439 10 10 CECE Cn1cc(CN2CC[C@@H](CN=[N+]=[N-])C2)c(Cl)n1 2002826011 FMFAJOIBSZPAFP-QMMMGPOBSA-N 254.725 2.206 10 10 CECE CN(CCc1ccc(N)cc1)Cc1cncn1C1CC1 2153012029 WDAAEQIUNNVGSZ-UHFFFAOYSA-N 270.380 2.475 10 10 CECE NCc1cc(F)c(N2C[C@H](F)[C@H](F)C2)cc1Cl 2008204475 DPCWTBYCZQYESE-AOOOYVTPSA-N 264.678 2.434 10 10 CECE Nc1ccc(OC[C@H](O)CSC2CCC2)cc1 2008681804 RENQYFJEFHPVJO-NSHDSACASA-N 253.367 2.294 10 10 CECE CN(C)c1ccc([C@](C)(N)CC[C@H]2COCCO2)cc1 2154773261 ZXADTTPRTZEWDJ-JKSUJKDBSA-N 278.396 2.122 10 10 CECE Cc1c([C@H](N)c2ccccc2O)c(Br)nn1C 2014539866 JNEKUPPPWMMJHD-LLVKDONJSA-N 296.168 2.245 10 10 CECE Cc1cc(CN(C)c2ccc([C@@H](C)O)c(O)c2)n(C)n1 2155335427 ADLOZEBWXLJXGN-LLVKDONJSA-N 275.352 2.124 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CN)c(Br)c1 2018107403 LNEHCKNYVXCOHC-RNCFNFMXSA-N 299.212 2.257 10 10 CECE COc1ccccc1N(C)C(=O)Cc1ccc(N)cc1 49967462 SZJLAXQGCCCIDQ-UHFFFAOYSA-N 270.332 2.483 10 10 CECE CO[C@@H](C(=O)NCc1ccc(N)cc1)c1ccccc1 50437054 QCIJRKDMWVNBKQ-OAHLLOKOSA-N 270.332 2.273 10 10 CECE CCOC(=O)c1cnc(Sc2ccnnc2)s1 2022117694 RLQGOENXDXRVKC-UHFFFAOYSA-N 267.335 2.261 10 10 CECE C[C@@H](c1ccc(Cl)cc1O)N(C)CC[S@@](C)=O 2024140080 XORGEMMPBQECQV-HUTHGQBESA-N 275.801 2.417 10 10 CECE C[C@@H]1C[C@@H](N(C)Cc2ccc(F)cc2O)CCN1C 295265926 HGEMYQRFCFHKAK-RISCZKNCSA-N 266.360 2.446 10 10 CECE CC(F)(F)[C@H]1CCCN1CC(=O)Nc1ccc(N)cc1 2160121200 MCWDEMNWKIVOBP-GFCCVEGCSA-N 283.322 2.327 10 10 CECE CCNCc1ccc(OCOCCOC)c(C)c1 2037496686 IHYHMLMCJCZCRF-UHFFFAOYSA-N 253.342 2.104 10 10 CECE CCOC(C)(C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2038000661 SLNQCLKJLPEYJO-JTQLQIEISA-N 254.334 2.493 10 10 CECE CCC(=O)NCCCNCc1cc(Cl)ccc1O 2040875260 WWGAJYRDVZLUSQ-UHFFFAOYSA-N 270.760 2.052 10 10 CECE C[C@H]1CNC[C@H](C)N(Cc2ccc(Cl)cc2O)C1 2041200615 KNCLHWDHLYQBDG-QWRGUYRKSA-N 268.788 2.475 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCCN3)C[C@H](C)S1(=O)=O 400836104 IBEMZUUEDJXGCV-RYUDHWBXSA-N 294.420 2.057 10 10 CECE CCN(CCn1cc(C)cn1)c1ccc(CN)cc1 311400368 UPQGUJZYXXVSFO-UHFFFAOYSA-N 258.369 2.177 10 10 CECE C[C@@H](CN1CCCC1)N[C@@H]1CCc2cccc(O)c21 312066506 FOPYIKWUMCVTSD-GXTWGEPZSA-N 260.381 2.453 10 10 CECE CC[C@H](NCc1ccc(N2CCCC2)cc1)C(=O)OC 312835797 VAVYDKLQUWTYJH-HNNXBMFYSA-N 276.380 2.328 10 10 CECE C[C@H](NC[C@@]12COC[C@@H]1C2(F)F)c1c(O)cccc1O 2161889064 BJGVWEQAFFJKOJ-LJUAHTATSA-N 285.290 2.030 10 10 CECE Cc1cc(CN)ccc1N1CC[C@@H](c2cnn(C)c2)C1 2171786366 GFMVSQMKTQXTGH-CQSZACIVSA-N 270.380 2.181 10 10 CECE COc1ccc(N2CC[C@@H](c3ccnn3C)C2)c(N)c1 2171781872 LTKDGBPWYCSDLF-LLVKDONJSA-N 272.352 2.005 10 10 CECE NCc1ccc(N2CC[C@@H](N3CCC3)C2)c(Cl)c1 702293531 IPUOTHVDYXBSRY-GFCCVEGCSA-N 265.788 2.083 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1Cc2ccccc2CO1 704337882 KDOKOSZEKJQPGG-CYBMUJFWSA-N 274.324 2.335 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H](C(=O)O)CC1(C)C 2162155023 NJQHEJIJHBCYAB-NXEZZACHSA-N 279.336 2.344 10 10 CECE COc1ccc(O)c(CN(CCN(C)C)C(C)C)c1 708328543 AGGSQXMVTARSPR-UHFFFAOYSA-N 266.385 2.173 10 10 CECE CCN1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1 709176627 NZNSLYUPIFLILM-OAHLLOKOSA-N 260.381 2.195 10 10 CECE C[C@@H](N)C1CCN(c2ccc3c(c2)OCCCO3)CC1 2162629366 FLBKHWZYDKQRSB-GFCCVEGCSA-N 276.380 2.412 10 10 CECE COCc1csc(C(=O)NCc2ccc(N)cc2)c1 690005890 YOOJPZWKKCVPMD-UHFFFAOYSA-N 276.361 2.407 10 10 CECE CNCc1cc(F)c(N2CCO[C@H](C)[C@H]2C)c(F)c1 380532777 MCHDYZFTCMAFTN-NXEZZACHSA-N 270.323 2.298 10 10 CECE C[C@]1(C(F)(F)F)CN(c2ccc(CO)cc2F)CCO1 712847232 XZFGOXLYXULHQW-GFCCVEGCSA-N 293.260 2.476 10 10 CECE COc1cc(Cl)cc(CN2CCC[C@@H](N)[C@@H]2C)c1O 381677378 CQPOZCFFQMMAQW-JOYOIKCWSA-N 284.787 2.366 10 10 CECE CCN(C[C@H](C)OC)c1ccc(CNC)cc1F 382747925 BBNSOYATDQDWDY-NSHDSACASA-N 254.349 2.406 10 10 CECE Cc1cc(N2C[C@@H](O)C[C@H]2C)ccc1CNC1CC1 384768848 CVFSBAQLCWRXLX-WBMJQRKESA-N 260.381 2.207 10 10 CECE CNCc1ccc(N2CC[C@@H](CO)[C@@H]2C)c(Cl)c1 385596369 BYTRIQALABQERW-JQWIXIFHSA-N 268.788 2.267 10 10 CECE CCCN(CC(F)F)C(=O)COc1ccc(N)cc1 386345832 ZRQSBFHLQDTPHY-UHFFFAOYSA-N 272.295 2.151 10 10 CECE Nc1ncccc1OCc1sncc1Br 719914363 YTKASFLRRUNBNZ-UHFFFAOYSA-N 286.154 2.462 10 10 CECE CO[C@@H]1CCN(c2c(F)cc(CN)cc2F)[C@@H](C)C1 394021017 NWRHJYPACCIUCC-GXSJLCMTSA-N 270.323 2.427 10 10 CECE C[S@@](=O)(=NC(=O)c1cccc(O)c1O)c1ccccc1 395978324 VHIGTYBLDLPNJS-FQEVSTJZSA-N 291.328 2.395 10 10 CECE COc1ccc(N2C[C@@H](C)C[C@H](CO)C2)c([N+](=O)[O-])c1 398606442 DERLMIADWAWLBM-QWRGUYRKSA-N 280.324 2.058 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC[C@@H](CCF)C2)cc1 2165899567 BFCCJFWCHDLGAH-CZUORRHYSA-N 279.403 2.434 10 10 CECE CCC(=O)N1CC[C@@H](N[C@@H](C)c2c(O)cccc2OC)C1 2064380274 OKZGLZLLFVZEET-NWDGAFQWSA-N 292.379 2.062 10 10 CECE COC(=O)[C@H]1CC[C@](F)(CN2CC[C@@H](N=[N+]=[N-])C2)CC1 2178574751 SQXOXVQNNYGWCL-WZRBSPASSA-N 284.335 2.443 10 10 CECE Cc1cc(O)c([C@@H](C)n2cc(S(C)(=O)=O)cn2)cc1C 2070203717 RIYNYNSUHAUVJO-LLVKDONJSA-N 294.376 2.218 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2C[C@@H]3C[C@@H]3CO2)cc1O 2179419372 KZRAHSCMGFOBAW-FMSGJZPZSA-N 276.380 2.273 10 10 CECE CCCN(C(=O)COc1ccc(N)cc1)[C@@H]1CCSC1 2170149915 DIUZQEMKMDJBPQ-CYBMUJFWSA-N 294.420 2.392 10 10 CECE C[C@H](O)c1ccc(N(C)CCN2CCOCC2)c(Cl)c1 2170106325 KSDZYWWDQGPZLS-LBPRGKRZSA-N 298.814 2.162 10 10 CECE CN1CCC2(CC1)CCN(Cc1cc(F)ccc1O)C2 1140059001 SOZJRXQKSVYUAB-UHFFFAOYSA-N 278.371 2.449 10 10 CECE Cc1cc(N2CC[S@@](=O)C(C)(C)C2)ccc1C[C@@H](C)N 2170925631 AFPWXKMJAOZODX-ZUOKHONESA-N 294.464 2.232 10 10 CECE C[C@@H]1C[C@@H]2CN([C@H](C)c3c(O)cccc3O)CCN2C1 2181240430 CZNGRERAIHJLQE-JHJVBQTASA-N 276.380 2.185 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CCC(=O)N(C)C)cc1 2188488945 YJEIMDHGGATZPY-ZDUSSCGKSA-N 277.412 2.272 10 10 CECE CN(Cc1cccc(Cl)c1O)[C@@H]1CC(=O)N2CCC[C@H]12 2188462887 CKLQEESNGFBMOZ-CHWSQXEVSA-N 294.782 2.241 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2CCCN(C)CC2)cc1O 2192804415 ICTPEDYNSLNYDL-OLZOCXBDSA-N 278.396 2.366 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@@H]3C[C@H]32)cc1[N+](=O)[O-] 2188576664 OQGBCAXRBDGITE-ZYHUDNBSSA-N 274.276 2.291 10 10 CECE CC(C)(C)[C@@H]1C(=O)NCCN1c1ccc(CN)cc1Cl 2196500655 RVFHNTFIJRSXBA-ZDUSSCGKSA-N 295.814 2.150 10 10 CECE CC(C)n1ncc([C@@H](O)c2ccc(N(C)C)cc2)c1N 2188977172 CISYUUKWSZTRET-AWEZNQCLSA-N 274.368 2.194 10 10 CECE CN(Cc1ccc(N)cc1)c1cc([N+](=O)[O-])cc(F)n1 2183207896 DKBZTYNRNCZTGI-UHFFFAOYSA-N 276.271 2.348 10 10 CECE N[C@H]1CCc2cc(N3CCC[C@H](N4CCC4)C3)ccc21 2184744625 XXNCWROZPGJOEG-RDJZCZTQSA-N 271.408 2.307 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@H]4CC[C@@H](O)[C@H]3C4)ccc21 2184731208 FMSADWVIADHSGP-GAEVZRCVSA-N 273.376 2.406 10 10 CECE N[C@H]1CCc2cc(N3CC[C@@H](N4CCCC4)C3)ccc21 2184732239 ROROXPMJYFQLDH-WBVHZDCISA-N 271.408 2.307 10 10 CECE CN(C)C1CC2(C1)CN(c1ccc3c(c1)CC[C@@H]3N)C2 2184735588 IQSSTFUHOYOYKC-INIZCTEOSA-N 271.408 2.163 10 10 CECE 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CECE CC(C)([C@@H](O)c1ccc(N2CCCC2)cc1)S(C)(=O)=O 2163109385 YQQDOZKMPKMSOT-AWEZNQCLSA-N 297.420 2.143 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCCN3C)C[C@@H]1CCN 2163111293 QFSHRQDDRXHZGF-HIFRSBDPSA-N 273.424 2.490 10 10 CECE CCN1CCc2cc([C@H](N)C3(O)CC(SC)C3)ccc21 2163130089 DVBMWKZWZPNSNX-SIWZUTFBSA-N 292.448 2.325 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CC[C@@H]1C1CC(F)(F)C1 2165952620 BAEGAZJPDJTVRW-SNVBAGLBSA-N 283.274 2.358 10 10 CECE COc1ccc(O)c([C@H](C)N(C)[C@H]2CNCC[C@H]2C)c1 2163613755 PXZVOJTZKATLHT-XUJVJEKNSA-N 278.396 2.392 10 10 CECE CCO/C(O)=C1/SC(c2ccc(OC)cc2)=NC1=O 139186339 ZENPMXOINUPXDC-JLHYYAGUSA-N 279.317 2.479 10 10 CECE COC(=O)Cc1ccc2c(O)c(/C=C/C(=O)O)sc2c1 725433180 USQMWQAMSJDHGY-SNAWJCMRSA-N 292.312 2.420 10 10 CECE CN(C)c1ccc(CN2CC[C@@H]3[C@H](C(=O)O)[C@@H]3C2)cc1F 902554419 MZMIDMSGZYURHG-ZOWXZIJZSA-N 292.354 2.044 10 10 CECE CC(C)(C)[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C[C@@H]1O 832140571 QLHNXHZBWZPAQK-GJZGRUSLSA-N 290.407 2.067 10 10 CECE CN(C)c1ccc(/C=C/CNCC(C)(C)OCCO)cc1 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O=C(NCc1ccc(O)c(O)c1)c1cc(-c2ccoc2)[nH]n1 778914841 MUYPZAOTYULPSK-UHFFFAOYSA-N 299.286 2.011 10 10 CECE CCN(c1ccc(OC)cc1N)C1CCC(N)CC1 1876281772 RMGKUCRRRZPEBR-UHFFFAOYSA-N 263.385 2.374 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@@H]1CC[C@@H]1C1CC1 1876560389 JSWIUYFQAQUGNX-VXGBXAGGSA-N 261.321 2.358 10 10 CECE COc1cc(O)c(CN2CCOCC3(CC3)C2)cc1OC 782303169 XAEKGDRRRAEMGG-UHFFFAOYSA-N 293.363 2.022 10 10 CECE Nc1ccc(OCC(=O)NOC2CCCCC2)cc1 1878761771 BZHWMXGCYOZPMR-UHFFFAOYSA-N 264.325 2.028 10 10 CECE Cc1cc(N(C)Cc2ccccc2O)cc(CN)n1 1877532658 IVFFRCNTKYZCJJ-UHFFFAOYSA-N 257.337 2.191 10 10 CECE Cc1ccc([C@@H](C)N[C@H]2CCN3CC[C@H]2C3)c(O)c1 1877893457 XZYCCKPZRREBKQ-IPYPFGDCSA-N 260.381 2.445 10 10 CECE C[C@H]1CN(Cc2ccc(N3CCC(O)CC3)cc2)[C@H]1C 894861502 JJHVTWBPCQUIIA-KBPBESRZSA-N 274.408 2.488 10 10 CECE COc1cc(NS(=O)(=O)c2cccs2)ccc1O 797820378 UXGNYDZSUPIAMK-UHFFFAOYSA-N 285.346 2.263 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3COC[C@H]3C2)c(F)c1 1880482079 MCZBVVVYTNRKEZ-JMJZKYOTSA-N 269.291 2.101 10 10 CECE OCc1ccc(N2C[C@@H]3C[C@H](C2)O3)cc1C(F)(F)F 1899715492 CQCWBSUCWYODNQ-PHIMTYICSA-N 273.254 2.175 10 10 CECE COc1ccc(CN[C@@H]([C@H](C)O)C(F)(F)F)cc1C 1882720007 ATSUKNGVCCBEGL-CABZTGNLSA-N 277.286 2.405 10 10 CECE CC(C)(C)OC(=O)NC1(C(=O)NCCN=[N+]=[N-])CCCC1 1963808884 HNYPDEXVABLYGV-UHFFFAOYSA-N 297.359 2.250 10 10 CECE C[C@@H](c1ccccc1O)N(C)S(=O)(=O)CC1CC1 86497445 OQQLXACCYVZIHJ-JTQLQIEISA-N 269.366 2.125 10 10 CECE CC1(C)CN[C@](C)(c2cc(F)c(F)c(F)c2O)CO1 83542999 QUZRYCFCBAHAIS-ZDUSSCGKSA-N 275.270 2.423 10 10 CECE CN(CC[C@@H]1CCOC1)c1c(F)cc(CN)cc1F 1885673503 RJBYIWKNLYXGNY-SNVBAGLBSA-N 270.323 2.286 10 10 CECE CC(C)NCc1ccc(N2CCC(C(=O)O)CC2)cc1 84828000 UOYUSGNNASCCPZ-UHFFFAOYSA-N 276.380 2.486 10 10 CECE CC[C@H](C)[C@H](NCc1ccc(C)cc1O)C(=O)OC 1963189056 JWOFOEYRXZXRMG-FZMZJTMJSA-N 265.353 2.378 10 10 CECE Cc1cc(N(C)[C@@H]2CO[C@@H](C3CC3)C2)ccc1CN 691715946 NCDYASOYVLIUED-JKSUJKDBSA-N 260.381 2.457 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@H]2C[C@]2(C(=O)O)C1 703462247 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NC[C@H]1CCC[C@@H](NCc2ccc3c(c2)CCO3)C1 1964655052 WRDWNDWNVRJMJX-SWLSCSKDSA-N 260.381 2.229 10 10 CECE CNCc1ccc(N2CC[C@H]([C@H](C)O)C2)c(Cl)c1 162195162 YUDCOXWYFZOHAW-JQWIXIFHSA-N 268.788 2.267 10 10 CECE CN(C)C1(C)CN(c2ccc3c(c2)CCC[C@H]3O)C1 2128270452 FXAQSDZUHXTRPO-OAHLLOKOSA-N 260.381 2.197 10 10 CECE CCCC1(O)CN(c2ccc3c(c2)CCC[C@H]3O)C1 2128275804 WKQLMALLPCSMKM-OAHLLOKOSA-N 261.365 2.408 10 10 CECE CN(C)[C@]1(C)CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128317065 AYNWZROVDQHAPA-JKSUJKDBSA-N 259.397 2.163 10 10 CECE CN(C[C@@H]1[C@H]2CCO[C@@H]12)c1ccc2c(c1)CC[C@@H]2N 2128320646 FEFDQUNEPNHHDX-LVQVYYBASA-N 258.365 2.104 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2O)C1CC2(COC2)C1 2128320554 CUQZDGBHROWHCB-HNNXBMFYSA-N 259.349 2.281 10 10 CECE CC1(C)C[C@H](CCN)CN1c1ccc2c(c1)OCO2 259282777 GOOZWHNKPVKCMK-NSHDSACASA-N 262.353 2.369 10 10 CECE COc1ccc(CN2CCC[C@]23CCCNC3)c(O)c1 1222236771 AZKUYXPPLSJKGU-INIZCTEOSA-N 276.380 2.119 10 10 CECE CCN1[C@@H](C)CN(c2ccc(CN)cc2F)C[C@H]1C 2130405711 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C[C@@H](NCc1c(O)cccc1F)[C@H]1C[C@@H]2CCO[C@@H]21 2333169646 WKEJXEHPKAKZAB-RSQPEXBXSA-N 265.328 2.434 10 10 CECE Nc1ccc(OCC(=O)OC[C@H]2CCC2(F)F)cc1 2335323298 VFMVCCFJGNCKPK-SECBINFHSA-N 271.263 2.236 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@H]2CC[C@H]1C[C@@H]2O 2337149050 VFHHFNKAUZFEEC-AEIGPULVSA-N 260.381 2.364 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@H]2C[C@H]1CC21CC1 2339124692 PTVQCJJYIPERGW-NRUUGDAUSA-N 264.329 2.008 10 10 CECE CC1(C)[C@@H](O)CCN1c1ccc(CN)c(C2CC2)c1 2339145246 HPMGWIIMTIAWPZ-HNNXBMFYSA-N 260.381 2.372 10 10 CECE COc1cc(Cl)c(N2C[C@H]3[C@H](O)C[C@H]3C2)c(OC)c1 2342307212 NQTJBQOAZMNIQK-MKPLZMMCSA-N 283.755 2.174 10 10 CECE Cc1nc(CCCN2CCC[C@H](N=[N+]=[N-])CC2)n[nH]1 2351856047 QKGPDXNNSJYSTH-NSHDSACASA-N 263.349 2.211 10 10 CECE CSc1cc(N2CCO[C@H](C3CC3)C2)ccc1CN 2353848252 JJPTWWPFATYJSF-AWEZNQCLSA-N 278.421 2.482 10 10 CECE CSc1cc(N2C[C@H]3C[C@H](O)C[C@H]3C2)ccc1CN 2353859124 XOCUYAGBYJXFHQ-IMRBUKKESA-N 278.421 2.074 10 10 CECE C[C@@H](NC[C@H]1C[C@@H]2OCC[C@@H]2O1)c1cc(F)ccc1O 2354612858 IRLDCNLIMLAELZ-OLJUCXRQSA-N 281.327 2.128 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@]1(N)CC[C@@H]2C[C@@H]21 2354754102 CQLPQYUQZQXMPF-NGOBNIPXSA-N 274.364 2.039 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CCCC[C@@H]1C(N)=O 50561925 GUFKWUFHTAGOSJ-MRXNPFEDSA-N 289.423 2.337 10 10 CECE CC[C@H]1C(=O)NCCN1c1ccc(CNC(C)(C)C)cc1 110683242 WXYUFIXZLQMPLP-HNNXBMFYSA-N 289.423 2.290 10 10 CECE CN1CC[C@@H](N(C)Cc2cc(Br)ccc2O)C1 310501197 JHGCZUHALXJXEJ-GFCCVEGCSA-N 299.212 2.291 10 10 CECE CC[C@@H](NCCC[S@](C)=O)c1ccccc1O 119185039 JRRSKUCBAIZXPT-SJKOYZFVSA-N 255.383 2.202 10 10 CECE CCNC(=O)CN(C)c1ccc(CNC(C)(C)C)cc1F 62737481 CKIOCCLSFIWDIK-UHFFFAOYSA-N 295.402 2.286 10 10 CECE COCCN(Cc1cc([N+](=O)[O-])ccc1O)CC(F)F 173324227 YRXNHTQZLLBJPV-UHFFFAOYSA-N 290.266 2.014 10 10 CECE CO[C@H]1C[C@@H]2C[C@@](N)(c3ccc4c(c3)CCN4C)C[C@@H]21 2357036369 BLCLAVGONUTMBB-QCPWZWHMSA-N 272.392 2.278 10 10 CECE Oc1cc(Br)cc(C[C@H]2CCNC2)c1O 218492471 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LYNNENNWBCDGTD-ZDUSSCGKSA-N 262.313 2.283 10 10 CECE CC(C)(C)OC(=O)N[C@H](CC(=O)O)c1cc(O)cs1 238146360 VHYSVQAICHNBHD-MRVPVSSYSA-N 287.337 2.494 10 10 CECE Nc1oncc1-c1c(O)c(O)cc(Br)c1F 258683632 XLCVXOXMHWAFFL-UHFFFAOYSA-N 289.060 2.237 10 10 CECE CCn1ncc(CN[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)n1 527922431 GIGFOFMCJJMEQM-SKDRFNHKSA-N 290.342 2.481 10 10 CECE CN1CCc2cc([C@H](O)[C@H](N)[C@H]3C[C@@H]4C[C@@H]4C3)ccc21 2163926517 UWFBBZCPIVIKAW-QZCUMHFISA-N 272.392 2.086 10 10 CECE CO[C@@]1(CN(C)Cc2c(O)cccc2F)CCCOC1 2166142076 QUFKYLUYCLFDQD-OAHLLOKOSA-N 283.343 2.159 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@H](O)C1CCCCC1 2167600003 UXLGQARIKJHFHE-INIZCTEOSA-N 278.396 2.347 10 10 CECE COc1ccc(O)c(CN(C(C)C)[C@H]2CCOC2)c1 291334934 VCZPZUHOWAAFHV-ZDUSSCGKSA-N 265.353 2.400 10 10 CECE CS[C@@H](CO)[C@@H](C)NCc1cc(Cl)c(F)cc1O 293584853 JZYXLQNMQHBVQD-KRTXAFLBSA-N 293.791 2.387 10 10 CECE Cc1cc(N2CCNCC2)ccc1OC[C@@H]1C[C@H]1C 722636069 AQTDNZHYXJEJFM-OCCSQVGLSA-N 260.381 2.439 10 10 CECE CN(C)c1ccc([C@H](N)c2ccc3nccn3c2)cc1 2163065991 HCORKBWMGHZJAC-INIZCTEOSA-N 266.348 2.448 10 10 CECE Nc1ccc(OCCN2CCC3(CCCC3)C2=O)cc1 2163080317 TXTMNIGBHRLSNQ-UHFFFAOYSA-N 274.364 2.440 10 10 CECE CN(C)c1ccc([C@H](NN)c2ncoc2C(F)F)cc1 2163096784 ZBDRDLLVMIABFX-JTQLQIEISA-N 282.294 2.231 10 10 CECE CN1CCCc2cc([C@H](Cc3cscn3)NN)ccc21 2163095047 ADIQECAFUZOFEG-AWEZNQCLSA-N 288.420 2.273 10 10 CECE Cc1ccc([C@H](C)NC[C@@H]2C[C@@H]3OCC[C@H]3O2)c(O)c1 2163198543 MFJGIRVLAQYPTJ-RKLWJJNISA-N 277.364 2.298 10 10 CECE CON1CCC(NCc2c(O)cc(C)cc2Cl)CC1 817418360 NJFOBBJJXWTFLY-UHFFFAOYSA-N 284.787 2.469 10 10 CECE c1cc(N2CC[C@H]3CNC[C@@H]32)ccc1OC1CCC1 2132367081 ICSDIKUVIMDYLO-LRDDRELGSA-N 258.365 2.416 10 10 CECE CCc1cccc(CN[C@H]2C[C@@H](O)C23CCC3)c1O 827366497 WJBDMYXQMHPQNI-UONOGXRCSA-N 261.365 2.348 10 10 CECE N[C@H]1CCc2cc(N3C[C@H]4COC[C@@H](C4)C3)ccc21 2132521505 ZNRCZZHLAZMZQG-MKBNYLNASA-N 258.365 2.105 10 10 CECE Cc1cccc(CN2CC[C@H]([C@@H](O)C(F)(F)F)C2)c1O 825124772 XTYFQZDLKPTZBW-WCQYABFASA-N 289.297 2.446 10 10 CECE CCOc1cccc(CN2C[C@H]3COC[C@]3(C)C2)c1O 827282797 NICJETHUWHXDEM-BBRMVZONSA-N 277.364 2.259 10 10 CECE CCN(C/C=C\c1ccc(N(C)C)cc1)CCCO 835025782 JVOAPDOAOQUGNH-ALCCZGGFSA-N 262.397 2.470 10 10 CECE CC[C@@H]1CN(C/C=C/c2ccc(N(C)C)cc2)C[C@@H]1O 835028888 LVFMGBOFNJFZTM-HEDFYIJFSA-N 274.408 2.469 10 10 CECE CN(C)c1ccc(/C=C/CN[C@@H](CO)CCF)cc1 846095535 AZCJWYMMSXNCJD-RDFMZFSFSA-N 266.360 2.076 10 10 CECE C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)C2(CCC2)CO1 846067854 ZCNHMWKIFDBCLT-LLVKDONJSA-N 291.347 2.264 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCC[C@@H]1CC 164769788 OKJKNFCRQJKPIX-JQWIXIFHSA-N 254.334 2.398 10 10 CECE Cc1ccc(O)c(CNc2ccc3c(n2)OCCO3)c1 849347914 VNNJNZZDIPRQLV-UHFFFAOYSA-N 272.304 2.479 10 10 CECE CCOc1ccc(O)c(CN[C@H]2CC[C@@H](CN)C2)c1 841084100 GDRVTPDGTSDTMZ-YPMHNXCESA-N 264.369 2.008 10 10 CECE CC[C@@H]1C[C@@H](N[C@@H]2CCN(c3ccc(OC)cc3)C2)CO1 850347107 NNDHOFZHOAKYKM-IIAWOOMASA-N 290.407 2.431 10 10 CECE CCCN1CCC[C@@H](C(=O)NCc2c(O)cccc2F)C1 928712153 ZUBAIQUHURMOKF-GFCCVEGCSA-N 294.370 2.270 10 10 CECE COC[C@@H](N[C@H]1CCc2cccc(O)c21)C1CCOCC1 850493880 KWKQGCLWDQAQRZ-LSDHHAIUSA-N 291.391 2.411 10 10 CECE CC1(C)[C@H](CNC(=O)NCc2ccccc2O)C1(F)F 852627615 JVGHMDHAUUQYGK-NSHDSACASA-N 284.306 2.483 10 10 CECE CCOc1ccc(O)c(CNC[C@@H](CO)CC2CC2)c1 850388023 FYSINALZAMOTET-ZDUSSCGKSA-N 279.380 2.289 10 10 CECE CN(CC[S@](=O)C(F)(F)F)Cc1ccccc1O 929975986 KTKPYLOYHFXGFD-SFHVURJKSA-N 281.299 2.093 10 10 CECE CC[C@H](NC[C@@H]1COCCN1C)c1cccc(Cl)c1O 858523509 RDGDGSBVOZDQSB-RISCZKNCSA-N 298.814 2.417 10 10 CECE COCc1nc(C[C@H](O)Cc2ccc(N)cc2)cs1 699037108 GSXWLCQAYAUIQK-CYBMUJFWSA-N 278.377 2.018 10 10 CECE COc1ccc(CNC2(CCO)CCOCC2)cc1C 761993634 JXQXTQPSEMQISF-UHFFFAOYSA-N 279.380 2.025 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)CC1CSC1 864633173 ATZYAPKAGIBIHD-UHFFFAOYSA-N 278.421 2.464 10 10 CECE CO[C@@H](C(=O)N1Cc2cccc(O)c2C1)C1CCCC1 871206223 WTKYSNNZBTYWLC-OAHLLOKOSA-N 275.348 2.440 10 10 CECE O=C(c1coc(C2CC2)n1)N1Cc2cccc(O)c2C1 871204847 QDEKHCXBBNFLIT-UHFFFAOYSA-N 270.288 2.414 10 10 CECE O=C(C1CCN(C2CC2)CC1)N1Cc2cccc(O)c2C1 871204658 NXEHQZWDHSCVRX-UHFFFAOYSA-N 286.375 2.109 10 10 CECE CC(C)[C@H](NC(=O)COc1ccc(N)cc1)C(F)F 1876868487 ZBBZLPRLYJVFJG-LBPRGKRZSA-N 272.295 2.054 10 10 CECE COC[C@@H](NCc1cc(C)ccc1O)[C@H]1CCCOC1 886360279 STVSOJPIRIVFGR-DZGCQCFKSA-N 279.380 2.232 10 10 CECE CCc1nnc(COC(=O)c2ccc(C)c(O)c2O)s1 785272435 HVEBAGZPPWTROQ-UHFFFAOYSA-N 294.332 2.177 10 10 CECE CC(C)[C@H](CCN)C(=O)N[C@H](C)c1ccccc1O 1877588246 RNQCXZOKHKTLCM-NEPJUHHUSA-N 264.369 2.190 10 10 CECE COc1cc(C)cc(CN[C@@H]2C[C@@H](C)n3ncnc32)c1O 895232051 XWLKMOALRJIEEZ-ZYHUDNBSSA-N 288.351 2.096 10 10 CECE CC[C@H]1[C@H](CO)CCN1Cc1cc(C)cc(OC)c1O 894881359 OPJQKFYAMPCUFL-JSGCOSHPSA-N 279.380 2.302 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)[C@@H]2CCC[C@H]2O)c(F)c1 1880482585 QDHDVVMGQZZKAG-BZHVJNSISA-N 271.307 2.368 10 10 CECE Oc1c(F)cccc1CNCC1CC2(CC[C@H]2O)C1 1882870909 IHOOQSPXYRYSSZ-VROQLPPWSA-N 265.328 2.172 10 10 CECE COc1ccc(N2C(=O)/C(=C\N(C)C)SC2=S)cc1 1088686130 NPPUIKSTQMDHFZ-DHZHZOJOSA-N 294.401 2.463 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)OCO3)[C@H](CC)CN1 83456586 FLWKUWPMOVHPRV-NWDGAFQWSA-N 262.353 2.382 10 10 CECE COc1ccc(N2C[C@H](C)NC[C@H]2C(C)C)cc1O 83479502 HJQCGXDIOZYEAR-AAEUAGOBSA-N 264.369 2.224 10 10 CECE Cc1cncc([C@H]2NCCc3c(O)ccc(O)c32)c1 75799370 ZCUGMYXOVIIREJ-OAHLLOKOSA-N 256.305 2.036 10 10 CECE Nc1ccc(-n2c(C=O)nc3cc4c(cc32)OCCO4)cc1 76081350 WSCZWGLAJBXDFK-UHFFFAOYSA-N 295.298 2.191 10 10 CECE C[C@@H]1CCCN1c1cc2c(cc1Cl)[C@H](N)C(=O)N2 92750648 DDXFBLYKBPRAKN-KRTXAFLBSA-N 265.744 2.281 10 10 CECE NC[C@H]1CCCN1Cc1ccc(Br)cc1O 691480249 XFGYSIUZTYRDNN-LLVKDONJSA-N 285.185 2.078 10 10 CECE CC1(C)CCN(Cc2ccc(N)cc2)C[C@H]1C(=O)O 1891860108 VMJFEXHSCBDNQM-ZDUSSCGKSA-N 262.353 2.202 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CCC[C@@H]2O)cc1O 709477645 XPZLPXCPPYOIKF-SWHYSGLUSA-N 264.369 2.022 10 10 CECE CC[C@]1(O)CCCN(c2ccc(CN)c(F)c2F)C1 710238893 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CCC[C@@H]1COCCN1c1ccc([C@@H](C)O)c(O)c1 2113887282 ZZEQULKOJJYCDI-DGCLKSJQSA-N 265.353 2.451 10 10 CECE CC1(C)C[C@H]2C(=O)N(c3ccc(N)cc3Cl)C(=O)[C@@H]21 2114436330 VCNNZRJFGFZWSQ-LDYMZIIASA-N 278.739 2.458 10 10 CECE CN(CCNCc1c(O)cccc1Cl)C(=O)C1CC1 2265826395 DACMLESGBNRVMH-UHFFFAOYSA-N 282.771 2.004 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@](C)(N)C1CCCC1 2204156038 DJAXRQISZXMFSV-MRXNPFEDSA-N 276.380 2.258 10 10 CECE COc1cc(N2CCO[C@](C)(C(F)F)C2)ccc1CN 2204540935 FPAHUQYQCWDHHR-AWEZNQCLSA-N 286.322 2.014 10 10 CECE COCCNCc1ccc(N2CC3CC2C3)cc1OC 2204546039 XAWMIXUUFCLODG-UHFFFAOYSA-N 276.380 2.030 10 10 CECE COc1cc(N2C[C@H](O)[C@@H]2C)ccc1CNC(C)(C)C 2204547989 BYSJHJKDVAOQAC-FZMZJTMJSA-N 278.396 2.153 10 10 CECE Cc1ccc(CN2CC(F)(F)C[C@H]2CC(=O)O)c(O)c1 2204623338 KRPZBTPNPMOCBG-LLVKDONJSA-N 285.290 2.385 10 10 CECE Nc1ccc(OCCN2CCCC[C@@H]2CCCO)cc1 2206659993 UJVIKMQWMJGXMG-OAHLLOKOSA-N 278.396 2.275 10 10 CECE COc1cccc(CN[C@@H]2C[C@H]3COC[C@H](C3)C2)c1O 2206784343 XUJCEAYUNAVHLL-IMRBUKKESA-N 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HBMKIMAANWCTAI-CVEARBPZSA-N 261.365 2.499 10 10 CECE COc1ccc(N2CCC3(CC2)C[C@H]3CO)c(F)c1 2226783422 JPHDGRCDNAYYOS-NSHDSACASA-N 265.328 2.433 10 10 CECE COc1ccc(N2CC[C@@H](CO)[C@H](C)C2)c(OC)c1 2226804773 KKLUBGWUFPHXSI-NEPJUHHUSA-N 265.353 2.159 10 10 CECE CC[C@@H](CN(C)c1ccc(OC)cc1CNC)OC 2227673512 PGQOUKKGADJZOW-ZDUSSCGKSA-N 266.385 2.276 10 10 CECE CC1(C)CN(c2ccc3c(c2)CC[C@@H]3N)C[C@H]1CCO 2238455720 BKJGIBUWVYIZJO-CJNGLKHVSA-N 274.408 2.477 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C[C@@]1(C)COCCO1 2240741369 AXAOGPAMWQXUPA-BBRMVZONSA-N 278.396 2.256 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)CC1(S(C)(=O)=O)CC1 2240842897 YGBWIHOBLXFBJX-GFCCVEGCSA-N 297.420 2.062 10 10 CECE CCn1nc(C)c(CO)c1Sc1nccs1 2243281365 NQQVUPVGNHBYQB-UHFFFAOYSA-N 255.368 2.311 10 10 CECE CC1(C)C[C@@H](Sc2ncc(C(=N)NO)s2)CO1 2253287263 RRAFTLOIZTWBJT-ZCFIWIBFSA-N 273.383 2.107 10 10 CECE CC(F)(F)CCS(=O)(=O)CCc1ccc(N)cc1 2256432481 BCRORCTVYYHOQS-UHFFFAOYSA-N 277.336 2.271 10 10 CECE CCC1(O)CN(c2cc(Cl)c(OC)cc2OC)C1 2258075974 KVZZJUOYBQKCEV-UHFFFAOYSA-N 271.744 2.318 10 10 CECE CC(F)(F)CCS(=O)(=O)Cc1ccc(N)cc1 2248291809 OPPWKIPNMKCVQC-UHFFFAOYSA-N 263.309 2.229 10 10 CECE C[C@@H](N[C@@H]1C[C@H]2CO[C@H]1C2)c1cc(F)ccc1O 2258405843 VVQIINHKVPJPPJ-MGGABWITSA-N 251.301 2.359 10 10 CECE CCOC(=O)CCCNCc1cnc(SC)s1 2248614144 XRTFDHGWPBWLKP-UHFFFAOYSA-N 274.411 2.298 10 10 CECE C[C@H](c1ccccc1O)N1CC[C@@H]2[C@@H](C(=O)O)C[C@@H]21 2270875305 CTLPKYGJYPLTHJ-XEZLXBQYSA-N 261.321 2.248 10 10 CECE C[C@@H](O)CN(c1ccc2c(c1)OCCO2)C1CCC1 2272341788 ZAJPSGRMHZJCKR-LLVKDONJSA-N 263.337 2.198 10 10 CECE Cc1cc(O[C@@H](C)C(F)F)ccc1N1CCNCC1 2278454004 IIHCCLSBDRTUCB-NSHDSACASA-N 270.323 2.437 10 10 CECE COC[C@]1(C)C[C@H]1CNC(=O)Nc1ccc(N)cc1 2269290986 LPLNGHHSAPAMAD-HZMBPMFUSA-N 263.341 2.063 10 10 CECE CNc1cccc(C(=O)NCc2cnc(SC)s2)n1 2269305060 UKDSGQLSZXCVCH-UHFFFAOYSA-N 294.405 2.232 10 10 CECE Cc1ncc2c(N(C)Cc3ccc(N)cc3)nccn12 2284255533 CIWWUZWGGJZDAA-UHFFFAOYSA-N 267.336 2.256 10 10 CECE COC[C@@]1(O)CCCN(c2ccc(OC)c(C)c2C)C1 2284511730 FCVGNCGBQALYFK-MRXNPFEDSA-N 279.380 2.290 10 10 CECE Cc1cc(N(C)[C@H](C)[C@H](C)S(C)(=O)=O)ccc1[C@@H](C)O 2285154196 QMOXNIHTAZJAIR-UPJWGTAASA-N 299.436 2.306 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@@H](C)O)c(C)c2)C1 2285170905 IIRFPPZSBXXIJJ-SNPRPXQTSA-N 279.380 2.288 10 10 CECE Nc1ccc(CC(=O)NCC2CC3(CC(F)C3)C2)cc1 2287827998 OXVVHUBOLFHHOR-UHFFFAOYSA-N 276.355 2.456 10 10 CECE Cc1c(CN2C[C@H]3C[C@]3(CN)C2)n(C)c2ccccc12 2288269018 QOHAZSIDCVJOHJ-DYVFJYSZSA-N 269.392 2.267 10 10 CECE Cc1cc(N2CCCc3ccncc32)cc(CCN)n1 2288344665 MILPIBUBUMGHSV-UHFFFAOYSA-N 268.364 2.371 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1CCCN(C2CC2)C1 2288803316 NAJLKCDQNIJNCN-JTQLQIEISA-N 275.352 2.006 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](O)[C@H]2CC)cc1O 2288895889 WWUWNSCIYMRNNK-KCPJHIHWSA-N 278.396 2.412 10 10 CECE O=C(N[C@@]12CCCC[C@@H]1CC2)c1cc(O)c(O)c(O)c1 2289025713 CPIQWUTWPIALJC-MEBBXXQBSA-N 277.320 2.256 10 10 CECE CCN1C(=O)C(=Cc2cccc(O)c2)C(C(=O)OC)=C1C 2297308084 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CC[C@]1(C)[C@@H](O)CCN1c1c(F)cc(CO)cc1F 2336869151 RKYOYTCMMJBOQY-GXTWGEPZSA-N 271.307 2.197 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H]2CCCC23CNC3)cc1 2339403401 RANSDTCGFXSICX-GJZGRUSLSA-N 260.381 2.176 10 10 CECE C[C@]1(O)C[C@H]2C[C@H]1N(c1cc(Cl)c(CN)cc1F)C2 2339636523 NCQLVXSEYNFDFF-WZYXQFPFSA-N 284.762 2.287 10 10 CECE CN(CC1(O)CC1)c1ccc(CO)c(C(F)(F)F)c1 2340178716 BXXJKJURCYUCLH-UHFFFAOYSA-N 275.270 2.159 10 10 CECE Cc1c([C@H](C)O)ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)c1C 2340845683 DKVOOWGRYIGTKK-RKLWJJNISA-N 261.365 2.316 10 10 CECE O=C(O)[C@@H]1CCN(Cc2cc(Cl)ccc2O)[C@H]2C[C@@H]21 2343898388 TWKGWGXSXFBGDP-UTUOFQBUSA-N 281.739 2.341 10 10 CECE N[C@H]1CCc2cc(N3CC4(C3)CC4(F)F)ccc2C1 2351853925 OFWBWBQBBPJTAX-LBPRGKRZSA-N 264.319 2.348 10 10 CECE Nc1ccc(CCCNC[C@H]2O[C@H]3CC[C@H]2C3)cc1 2352712755 PVVPPTNWUFKNKR-CWRNSKLLSA-N 260.381 2.359 10 10 CECE CC1(C)C[C@H](N2CCCc3cc(CN)ccc32)CO1 2353349751 RKFZAHQJPAPTMP-AWEZNQCLSA-N 260.381 2.465 10 10 CECE CCOc1ccc(N2C[C@@H]3CC[C@H]2[C@@H]3N)cc1OCC 2356121167 DIXIKQTYVFMSAP-DETPVDSQSA-N 276.380 2.410 10 10 CECE Oc1ccc(CNC[C@@H]2COc3ccccc3O2)cc1O 20137737 SFSCCISWDISKDV-GFCCVEGCSA-N 287.315 2.027 10 10 CECE O=C(N[C@@H]1CCOc2ccccc21)c1cccc(O)c1O 126381404 HNKMRATYYVMMDL-GFCCVEGCSA-N 285.299 2.351 10 10 CECE CN(C)c1ccc(-c2nc3cccc4c3n2CNC4=O)cc1 72319802 OCAYNDSNYDDWPL-UHFFFAOYSA-N 292.342 2.470 10 10 CECE C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1N(C)C 131460646 DMOCMNGNEHJTCX-GWCFXTLKSA-N 268.788 2.428 10 10 CECE NCc1ccc(N2CCCC3(C2)OCCO3)cc1Cl 133647258 AGUWQMJKGJBCIS-UHFFFAOYSA-N 282.771 2.142 10 10 CECE CNC(=O)[C@H]1CCCCN1[C@H](C)c1ccc(OC)cc1O 133039428 FWMDDTFBRMBPOE-BXUZGUMPSA-N 292.379 2.062 10 10 CECE CC1(C)CN(c2ccc(CN)c(Cl)c2)CC[C@@H]1O 384970784 KZXDGVFGGKQQJJ-ZDUSSCGKSA-N 268.788 2.396 10 10 CECE Cc1cc(O)c(CN2CCCC[C@H]2CC(N)=O)cc1C 92588583 XFEURKDBURZGHM-AWEZNQCLSA-N 276.380 2.239 10 10 CECE CCN(C)c1ccc([C@@H](C)NC[C@H](C)CO)cc1 247067701 ODLNYJAEZWABNF-QWHCGFSZSA-N 250.386 2.422 10 10 CECE CC(=O)N(C(=S)N1CCCC1)c1ccc(N)cc1 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CCN1CCc2cc([C@H](O)[C@H]3CSCCN3C)ccc21 2163073137 GEXHCAJIKXRNFD-CVEARBPZSA-N 292.448 2.150 10 10 CECE CN1C[C@H]2CN(c3ccc4c(c3)CCCN4)C[C@@]2(C)C1 702305166 ZXTMYLKOHUIZBA-WMLDXEAASA-N 271.408 2.433 10 10 CECE C[C@@H]1[C@@H](N)CCN(c2ccc(CN(C)C)cc2)[C@@H]1C 709710026 CMNUUNCCKQUVPF-ZENOOKHLSA-N 261.413 2.310 10 10 CECE CC[C@H](O)[C@@H](N)c1ccc(Br)c(F)c1O 396957526 VXJOBBKPSKVQAZ-CBAPKCEASA-N 278.121 2.065 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)[C@@H]1CCCCN1 2164103050 UYKWGMHVINVYFY-DOTOQJQBSA-N 273.424 2.472 10 10 CECE CCOC(=O)[C@H](F)[C@H](O)c1ccc2c(c1)CCCN2C 2166973382 KEHRJOMSBVIAOC-ZIAGYGMSSA-N 281.327 2.004 10 10 CECE C[C@H]1CN(C)C[C@H]1Nc1c(N)cccc1Br 722290701 UKIYGUIAUWRMFK-GZMMTYOYSA-N 284.201 2.393 10 10 CECE Cc1cc(CC(=O)N2CC[C@@H](O)C2)c(C)n1-c1ccccc1 829494322 ZHKKDIMDKVLYTP-QGZVFWFLSA-N 298.386 2.230 10 10 CECE Cc1cc(Cl)cc(CN(CCO)[C@@H]2CCO[C@H]2C)c1O 825130376 WZTCQOIJUHSAMZ-SMDDNHRTSA-N 299.798 2.326 10 10 CECE C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1nccs1 588406413 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CO[C@H]1CC[C@@H](C)N(C(=O)c2cc(O)cs2)C1 870723821 GNJMUOMXCWEATB-SCZZXKLOSA-N 255.339 2.093 10 10 CECE Cc1nc(-c2ccc(N(C)C)cc2)[nH]c1CCC(=O)O 71612827 DFEOFKDKQPNBDE-UHFFFAOYSA-N 273.336 2.468 10 10 CECE CCN(C)C(=O)OCCN[C@H]1CCc2cccc(O)c21 1876014645 COQPUHIRSGDXAN-LBPRGKRZSA-N 278.352 2.057 10 10 CECE CCSC1(CNC(=O)COc2ccc(N)cc2)CC1 691831741 VSSNZAQAQGIMEG-UHFFFAOYSA-N 280.393 2.050 10 10 CECE Cc1cc(C)c([C@H](C)NC[C@@]2(CCO)CCOC2)c(O)c1 788633826 VADPXSDPMQFCLG-WMLDXEAASA-N 293.407 2.449 10 10 CECE CC[C@@H](CNCc1ccc(N(C)C)c(F)c1)C(=O)OC 895121083 DAHDFICGQMAEJT-LBPRGKRZSA-N 282.359 2.181 10 10 CECE Cc1ccnc(N)c1CNCc1ccc(N(C)C)cc1 894161534 VMDBDFHLCGFNIO-UHFFFAOYSA-N 270.380 2.328 10 10 CECE COc1ccc(N(C)CCNC(=O)OC(C)(C)C)c(N)c1 1955944695 IJGIOIIOLXXDQE-UHFFFAOYSA-N 295.383 2.238 10 10 CECE CC(C)CN(c1ccc([C@H](C)O)c(O)c1)C1COC1 1879155883 SNMQDTQIOGVWFF-NSHDSACASA-N 265.353 2.307 10 10 CECE Nc1ccc(NC(=O)N2CC[C@H]([C@H]3CCCO3)C2)cc1 886961209 NFNBZINMVJFXQF-SMDDNHRTSA-N 275.352 2.302 10 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O=C(/C=C/c1cnccn1)N1CCOc2cc(F)ccc21 491841073 BGPKYAICCQTRSQ-DUXPYHPUSA-N 285.278 2.055 10 10 CECE CCCOC(=O)c1ccc(N=NN2CCN(C)CC2)cc1 2318776078 VYKAPXSIXRSTKY-UHFFFAOYSA-N 290.367 2.500 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)cc1Cl 2311861988 DWNUOOZBWVJHMS-COPCRZHJSA-N 267.756 2.210 10 10 CECE CSc1ncc(CN[C@H]2CC[C@@H]3CN(C)C[C@@H]32)s1 2312989336 PRAXRUCKNBQMNJ-USWWRNFRSA-N 283.466 2.295 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@@H](F)C2)c(F)c1 2315060653 IWTRXHVGWDYNFG-ONGXEEELSA-N 256.296 2.020 10 10 CECE CSc1cc(N2CCN(C)[C@@H](C)C2)ccc1CN 2328549277 URCVAYZRIZQTRP-NSHDSACASA-N 265.426 2.008 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(CN)cc1F 2329966944 BVDTXNCBNSRKLN-ZOWXZIJZSA-N 264.344 2.288 10 10 CECE CCN(CC)c1ccc(CN[C@H]2[C@@H]3CCO[C@@H]32)cc1 2330684100 RUTBLCKAVYYYDZ-JYJNAYRXSA-N 260.381 2.410 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H]3[C@H](C[C@H]3O)C2)cc1 2333484816 IHEZTSZTYVCTPB-RUAUBTSSSA-N 260.381 2.174 10 10 CECE Cc1ccc(O)c([C@@H](C)N2C[C@@H]3C[C@H](N)[C@@H](C3)C2)c1 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NN1C(=O)/C(=C/c2cccc(Cl)c2)SC1=S 4882751 FVNWBTNOMANCCW-YVMONPNESA-N 270.766 2.415 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1CCCNC1 54307726 HQIKZRVEGYLSBD-OAHLLOKOSA-N 289.423 2.101 10 10 CECE C[C@H]1C[C@H]1CN(C)C(=O)c1ccn(-c2ccc(N)cc2)n1 111765887 DKYAMKBLAPEASG-RYUDHWBXSA-N 284.363 2.183 10 10 CECE COc1ccc(N(C)[C@H](C)CC(=O)O)c(OC)c1 58499543 NIQQZSJTPPSZDU-SECBINFHSA-N 253.298 2.003 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@@H]3CC[C@@H]32)cc1O 2357031762 SEYHZLRJGCPSOQ-QPKOPYBWSA-N 276.380 2.022 10 10 CECE CNC(=O)c1cccc(NC(=O)CCc2ccc(N)cc2)c1 66153510 SNVGQFAOYSPLFI-UHFFFAOYSA-N 297.358 2.200 10 10 CECE O=C(Nc1cc(O)c(O)c(O)c1)Nc1cccnc1Cl 217278770 HEFAOLADKMKFAF-UHFFFAOYSA-N 295.682 2.496 10 10 CECE CC1(C)CC[C@H]1CNC(=O)COc1ccc(N)cc1 2131996068 QZMCQQWSJOCJRW-NSHDSACASA-N 262.353 2.200 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CCc2c(F)cccc21 214687824 DDMVBIRBVIFLDI-AWEZNQCLSA-N 292.314 2.430 10 10 CECE COc1cccc(CN2C[C@H](C)OCC2(C)C)c1O 184791549 YHTUJFODLFNTSC-NSHDSACASA-N 265.353 2.400 10 10 CECE O=C(O)[C@@H]1CCCC[C@@H]1CNCc1ccccc1O 89445739 LBWGLFOLJOYBOQ-DGCLKSJQSA-N 263.337 2.373 10 10 CECE C[C@H]1CN([C@H](C)c2cc(F)ccc2O)C[C@@H](C)N1 227384902 QASBVIZBAYFGPC-OUAUKWLOSA-N 252.333 2.275 10 10 CECE C/C(=C\c1cc(O)c(O)c(Br)c1)C(=O)O 199207574 HYAYHXLMXUZZHG-GORDUTHDSA-N 273.082 2.348 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@@]1(C)C(=O)O 86816280 RYPZCVNNEJUKAM-OTYXRUKQSA-N 265.309 2.098 10 10 CECE Cc1cc(O)c([C@H]2CCC(=O)N2)cc1Br 238490230 GQXRRHXKFODWAF-SECBINFHSA-N 270.126 2.414 10 10 CECE C[C@@H]1C[C@H](N)CCN1c1ccc2c(c1)OCCCO2 49707513 VYPYDPIIXPOQON-VXGBXAGGSA-N 262.353 2.164 10 10 CECE CNCc1ccc(OC)c(CSCCCO)c1 90119520 PPPVFERJFCTRRU-UHFFFAOYSA-N 255.383 2.030 10 10 CECE O=C(O)C=Cc1ccc(N2CCCC2)cc1[N+](=O)[O-] 2132058321 OVQUAGPAUMEYFI-UHFFFAOYSA-N 262.265 2.293 10 10 CECE CCN(Cc1cc(CNC)ccc1OC)[C@H](C)COC 50125349 HTPWPKADLVCRHN-CYBMUJFWSA-N 280.412 2.271 10 10 CECE Cc1cccc(CN(C)c2cc3c(cc2N)OCCO3)n1 94910733 IRVRGCBQNNIXLW-UHFFFAOYSA-N 285.347 2.380 10 10 CECE CCN[C@@H](Cc1ncnn1CC)c1ccc(N(C)C)cc1 97280562 JVWLNXOMKFRTSN-HNNXBMFYSA-N 287.411 2.257 10 10 CECE CC(C)(N)c1c(Br)cc(O)c(O)c1F 258445172 NROPISUEUNYTNF-UHFFFAOYSA-N 264.094 2.193 10 10 CECE CC(C)(N)Cc1c(Br)ccc(O)c1O 258420644 OTWXYVUQVJRYMI-UHFFFAOYSA-N 260.131 2.140 10 10 CECE CCCN([C@H](C)c1ccccc1O)[C@H]1COC[C@H]1C(=O)O 250015034 LTVUVIWDPAGVBQ-BNOWGMLFSA-N 293.363 2.265 10 10 CECE Cc1c(Cc2onc(O)c2N)c2ccccc2n1C 606592776 AKHCUMXEICEJGK-UHFFFAOYSA-N 257.293 2.353 10 10 CECE Oc1c(Cl)cccc1CNCc1nc(C2CC2)n[nH]1 294744818 HPLSRPGDPJFGNR-UHFFFAOYSA-N 278.743 2.331 10 10 CECE Cc1c[nH]nc1NC(=O)/C=C\c1ccc(N(C)C)cc1 383035963 GNHGEBAKKXTRPN-TWGQIWQCSA-N 270.336 2.436 10 10 CECE CC(=O)C(=O)COc1ccc2ccccc2c1C=O 808013032 XHRJFUDEYCNNBX-UHFFFAOYSA-N 256.257 2.189 10 10 CECE CN1CCc2cc([C@]3(N)CCN(C(C)(C)C)C3)ccc21 2163070137 GTMBKAUVGVSHJC-KRWDZBQOSA-N 273.424 2.337 10 10 CECE CCN1CCc2cc([C@]3(O)C[C@H](C)NC[C@H]3C)ccc21 2163080959 XGAXJRNAFKRFDR-IGCXYCKISA-N 274.408 2.275 10 10 CECE C[C@@H]([C@@H](O)c1ccc(N2CCCCC2)cc1)S(C)(=O)=O 2163098383 VTEYQUPDKGZSRW-SWLSCSKDSA-N 297.420 2.143 10 10 CECE NN[C@H](c1ccc(N2CCCCC2)cc1)[C@@H]1CCCO1 2163105093 HYAZARHCDKPGPM-JKSUJKDBSA-N 275.396 2.360 10 10 CECE CC[C@H](O)CN(c1c(F)cc(CNC)cc1F)C1CC1 2163677621 DTSWGRBNHBFSIR-LBPRGKRZSA-N 284.350 2.424 10 10 CECE CN1CCc2cc([C@H](CN)N3CC4CC(C4)C3)ccc21 2163726384 HFLKVMIDNAJRQM-FVKWTLKZSA-N 271.408 2.021 10 10 CECE OCC[C@@H](NCc1ccc(O)c(O)c1)C1CCCC1 725104865 PFLBKDWSMGYXAQ-CYBMUJFWSA-N 265.353 2.129 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2nnc3ccccn23)CC1 2168469364 ZUMJLDPWBPICAY-NSHDSACASA-N 271.328 2.394 10 10 CECE Cc1cc(N)ccc1N1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@H]2C1=O 2166923720 QCXIOOSVDHSPTM-IOQCUFBNSA-N 270.332 2.113 10 10 CECE CCNCc1cc(F)c(N(CCO)[C@@H]2C[C@@H]2C)c(F)c1 2167111500 FWQOQRNBIYCUMN-IINYFYTJSA-N 284.350 2.281 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1O 718308704 BDAJBRWZUJHXGB-SUMAQBCMSA-N 275.348 2.059 10 10 CECE 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CCCN(C)C1CN(CCCc2ccc(N)cc2)C1 1877439484 BHCODEIDYRWEDL-UHFFFAOYSA-N 261.413 2.227 10 10 CECE C[C@H](NC(=O)[C@@H]1CCC[C@@]1(C)N)c1ccccc1O 1877588023 HTGNOETXDJKUED-ITDIGPHOSA-N 262.353 2.087 10 10 CECE CN(Cc1ccccc1O)c1ccccc1C(N)=O 1877518405 UKKMYEHJXOKJSC-UHFFFAOYSA-N 256.305 2.128 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H]1CNC(C)(C)C1 1878955673 PBAUOTPQZSWOMJ-DZGCQCFKSA-N 261.413 2.401 10 10 CECE COc1cc(C)cc(CN[C@@H]2C[C@H](C)O[C@@H]2C)c1O 895441155 YBQKFYSEDDVSIZ-DMDPSCGWSA-N 265.353 2.365 10 10 CECE Cn1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)c(C2CC2)n1 794537423 ZNUVZIWEZUGSQL-CLTKARDFSA-N 299.330 2.361 10 10 CECE C[C@@H]1C[C@H](NC(=O)C(F)(F)F)CN(CCCN=[N+]=[N-])C1 1957248612 DMCUJZVVFLNFCW-BDAKNGLRSA-N 293.293 2.076 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCCC[C@H](O)C2)c(F)c1 1880924291 PWQOVFKIWRSYBF-KOLCDFICSA-N 270.323 2.336 10 10 CECE CCON[C@H](c1ccccc1)c1ccc(O)c(O)c1O 133453275 XKKQQKVFCRBVRZ-CYBMUJFWSA-N 275.304 2.434 10 10 CECE C[C@@H](NCc1c(O)cccc1F)[C@@H]1CCCOC1 896639535 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CC[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(N(C)C)cc1 180594447 LBYVNPKXPARENL-ZBFHGGJFSA-N 299.422 2.400 10 10 CECE Nc1ccc(OCCNC(=O)Cc2ccc(F)cc2)cc1 32141122 CMUAKTNVOUUZRI-UHFFFAOYSA-N 288.322 2.146 10 10 CECE CO[C@H]1CCC[C@@H](N2CCN(c3ccc(N)cc3)CC2)C1 70332622 WWAIZZNWARSAFQ-SJORKVTESA-N 289.423 2.348 10 10 CECE Cc1c([C@@H](C)N)ccc(N(C)C[C@@H](C)CO)c1C 2318391953 QKGMJQRIEFCBAK-ZWNOBZJWSA-N 250.386 2.388 10 10 CECE CCn1ncnc1Cn1ccc2c(C[C@@H](C)N)cccc21 88622494 ZKHLNGNAEVVUEA-GFCCVEGCSA-N 283.379 2.191 10 10 CECE COC[C@H]1CCN(c2ccc(CN)c(Br)c2)C1 228153406 JDKVAXCLALICIC-JTQLQIEISA-N 299.212 2.381 10 10 CECE CC(=O)N[C@@H]1CCN(c2ccc([C@H](C)N)cc2Cl)C1 228281859 SZMUHCSSSVLOGV-JOYOIKCWSA-N 281.787 2.075 10 10 CECE CC(C)CC(=O)N1CCc2cc(N3CCOCC3)ccc21 41121905 RBJATFVVRZCDGE-UHFFFAOYSA-N 288.391 2.458 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H]1CCC(=O)N(C)C1 84063545 UDLZYIREXUPPQQ-UPJWGTAASA-N 288.391 2.459 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@@H](NC(C)=O)C2)cc1 229789263 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O=C(Nc1cnc(CC2CC2)nc1)c1cccc(O)c1O 803557506 DIWFDGVFJNASGS-UHFFFAOYSA-N 285.303 2.093 10 10 CECE CN1CCc2cc(C3(N)CCC(N(C)C)CC3)ccc21 2163070467 HUNJOJUQQKJRGO-UHFFFAOYSA-N 273.424 2.337 10 10 CECE CCN[C@H](c1ccc2c(c1)CCCN2C)[C@H](O)C1CC1 2163231336 UNOSMMFHZRNYRF-IAGOWNOFSA-N 274.408 2.491 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@]2(CCNC2)C1 2163335028 PUDMVGNOFMSJPZ-MLGOLLRUSA-N 276.380 2.234 10 10 CECE COc1ccc(O)c(CN=c2cc[nH]c3cccnc23)c1 814850040 VPQBADBRLWMFQW-UHFFFAOYSA-N 281.315 2.378 10 10 CECE Oc1cc(F)c(Cl)cc1CNC[C@H]1CCC[C@@H]1O 816555200 XBGRRIDQDQULQR-PELKAZGASA-N 273.735 2.435 10 10 CECE Cc1ccc([C@@H](N2CCNCC2)C(F)(F)F)c(O)c1 575266039 ZWAGSFSWFWEPPD-GFCCVEGCSA-N 274.286 2.209 10 10 CECE CN1CCN(c2ccc(CN[C@H]3CC34CC4)cc2)CC1 818230186 OAILWZZSEBDNBE-INIZCTEOSA-N 271.408 2.081 10 10 CECE CNCc1ccc(N(C)C[C@H](COC)OC)c(Cl)c1 691354349 GYIZEGYTPPEMMS-GFCCVEGCSA-N 286.803 2.157 10 10 CECE Nc1ccc(OCCN2C(=O)C[C@H]3CCCC[C@@H]32)cc1 386314986 SHTYFJCZOVJOKI-DOMZBBRYSA-N 274.364 2.439 10 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Cc1ccc(O)c(CN2CC[C@](CO)(C(F)(F)F)C2)c1 895835821 FOPCCWXDXLJBLE-ZDUSSCGKSA-N 289.297 2.447 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2cccnc2N)c1 1168712069 HYAHPPGFAKAJCP-SNVBAGLBSA-N 273.336 2.229 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cccc(N)c2)c1 83415580 UCHJKRQATVGJCD-UHFFFAOYSA-N 256.305 2.213 10 10 CECE CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-] 1885562039 ZPZUCOBIPQTQFW-JTQLQIEISA-N 299.375 2.496 10 10 CECE CCN1CCN(Cc2cc(F)ccc2O)CC1(C)C 1963281574 XOHJFBKAJCKUNF-UHFFFAOYSA-N 266.360 2.447 10 10 CECE FC1CC(CNCc2ccc(N3CCOCC3)cc2)C1 1963525636 KFXIYYUKYRAIKT-UHFFFAOYSA-N 278.371 2.361 10 10 CECE CC[C@@H](O)[C@H](C)NCc1ccc(Br)cc1O 691478090 VPZUILWIHFQUBK-GZMMTYOYSA-N 288.185 2.404 10 10 CECE COC(=O)N(C)CCN(C)c1ccc([C@H](C)N)cc1Cl 690799448 POEXLULDTKJTJT-JTQLQIEISA-N 299.802 2.494 10 10 CECE Cc1ccc(O)c([C@H](C)NCC[C@H]2CCCS2(=O)=O)c1 714352755 UZIQUGDHTZXEKY-QWHCGFSZSA-N 297.420 2.319 10 10 CECE CN(Cc1ccccc1O)C(=O)C[C@@H](N)C1CCCC1 718666751 ADQJOFUJTVCKHI-CQSZACIVSA-N 276.380 2.258 10 10 CECE Nc1ccc(CC(=O)NC[C@@H]2CCC[C@H]3C[C@@H]32)cc1 694298386 JNLNMJCDTAKVLI-YDHLFZDLSA-N 258.365 2.364 10 10 CECE CN(Cc1ccccc1O)C(=O)C1CCC(CN)CC1 93425337 KGTJBYOUFRUAPF-UHFFFAOYSA-N 276.380 2.116 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)cc2F)C[C@@H](C)O1 19872055 KUTUYUQRVFMSMD-OUAUKWLOSA-N 252.333 2.459 10 10 CECE CC[C@H](NC)c1ccc(N2CC(O)(C(F)F)C2)cc1 2115481774 PCPVGMOXZNTCHB-LBPRGKRZSA-N 270.323 2.173 10 10 CECE C[C@@H](CCCCO)NC(=O)c1ccc(N=NC(N)=O)cc1 1449998708 FCCVYSJKZQMGSG-JTQLQIEISA-N 292.339 2.130 10 10 CECE Nc1cc2c(cc1N1CCCC[C@@H]1CF)OCCO2 2115158527 KXQFLOLKSPKMAX-SNVBAGLBSA-N 266.316 2.368 10 10 CECE Nc1ccc(CCC(=O)N2CC3(CC(F)C3)C2)cc1 2115297082 CHDKWIKLAHLLFQ-UHFFFAOYSA-N 262.328 2.162 10 10 CECE Cc1cccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)n1 1291780418 YEFAVORATNWXLJ-UHFFFAOYSA-N 297.318 2.482 10 10 CECE CCNCc1ccc(N2CCC[C@@H](C(=O)O)C2)c(OC)c1 212644946 PBUKKJTZOOFHRI-CYBMUJFWSA-N 292.379 2.106 10 10 CECE COc1ccc2c(c1)SC[C@H](CCCO)N2C 215061653 HBPWHVLTRFCRRU-JTQLQIEISA-N 253.367 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2.272 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC(C4CC4)CC3)ccc21 724807743 XCUGNNKDYJPPQD-OAHLLOKOSA-N 271.364 2.265 10 10 CECE COc1cccc(CN2C[C@H](C(=O)O)CC2(C)C)c1O 2162156788 UZAXLMUCOHPFKU-LLVKDONJSA-N 279.336 2.086 10 10 CECE COc1cccc(CN2[C@H](CN)C[C@@H]3CCC[C@H]32)c1O 2164806318 LGKDKLSBBUWYMS-FPMFFAJLSA-N 276.380 2.103 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@@H](C)[C@@H]1N 2162636745 RADVVJPAZKJGNH-WOFXILAISA-N 284.306 2.428 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H](N)[C@H](C(F)(F)F)C3)ccc2O1 2162671218 PRNFYNZWHKFGCV-FXAINCCUSA-N 286.297 2.336 10 10 CECE CCC[C@H]1CCOCC[C@]1(NCCN=[N+]=[N-])C(=O)OC 2165350748 RBWAJCFAOCOHMQ-WCQYABFASA-N 284.360 2.025 10 10 CECE CCN1CCc2cc([C@H](O)C[C@H]3CNC[C@@H]3C)ccc21 2163064913 ZDSXPEWMOQHEQI-YLQAJVPDSA-N 274.408 2.348 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2CC)C1(O)CSC1 2163139169 VSGPHPDDNHWBDV-HNNXBMFYSA-N 292.448 2.198 10 10 CECE CC(=O)C(=O)COC(=O)[C@H](C)SCc1ccccc1 808505725 MYLDKRCGVDJQSR-NSHDSACASA-N 280.345 2.010 10 10 CECE 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CC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2O)nc1 1557966496 DMTMUDGJRJDVDS-SNVBAGLBSA-N 299.330 2.237 10 10 CECE COc1ccc(O)c(CN2CCOCCC2(C)C)c1 2126003532 ZSCFIFYUNBSXDR-UHFFFAOYSA-N 265.353 2.402 10 10 CECE C[C@@H](NCCCOC(=O)N(C)C)c1ccc(F)cc1O 1964506706 PTXMXBDNOZKROE-SNVBAGLBSA-N 284.331 2.270 10 10 CECE CC(C)NCc1ccc(N2CCN3CCC[C@H]3C2)cc1 250769785 SKTZIMLAECHQAK-KRWDZBQOSA-N 273.424 2.469 10 10 CECE CN(C(=O)c1cnc(F)c(F)c1)c1ccc(N)cc1 2126876781 OIVWZIQMSCFQSF-UHFFFAOYSA-N 263.247 2.219 10 10 CECE Cc1cc(O)c2c(c1)C(=O)c1ccc(O)cc1C2=O 13334403 VQUUDWPESXALSD-UHFFFAOYSA-N 254.241 2.182 10 10 CECE biogenic,in-vitro COc1ccc(O)c(CNC(=O)[C@@H](C)C2CCOCC2)c1 160305311 MEGMKTXRPDJZBU-NSHDSACASA-N 293.363 2.080 10 10 CECE C[C@@]1(O)CCCN(c2ccc3c(c2)CCC[C@H]3N)C1 2128277726 RKCZRAVONHSZPL-HZPDHXFCSA-N 260.381 2.374 10 10 CECE CN(C[C@@H]1CCOC1)c1ccc2c(c1)CCC[C@H]2N 2128279720 SMWVWFBHXPVUME-BLLLJJGKSA-N 260.381 2.495 10 10 CECE COc1cc(CN2C[C@H](C)O[C@@H](C)C2)c(O)cc1C 159457332 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10 CECE C[C@H](O)c1ccc(N(C)C[C@@]2(C)CCCN2C)cc1O 2154944098 CLJXJSSJDMHXML-BLLLJJGKSA-N 278.396 2.366 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H]2CCC(=O)N[C@H]2C)c1 282196789 GPWAAHUYEQOKRO-GMXVVIOVSA-N 262.353 2.018 10 10 CECE Cc1cnn(Cc2ccc3c(c2)CCCN3C)c1N 50286977 STLALYVOOADPIL-UHFFFAOYSA-N 256.353 2.204 10 10 CECE NCc1ccc(N2CC[C@@H]3COC[C@@H]32)cc1Cl 2021411864 DUORUBMKTBFSBW-MFKMUULPSA-N 252.745 2.024 10 10 CECE Nc1ccc(CCN2CCC3(CCC(O)CC3)C2)cc1 2156005395 SWURYJPNZSIFCY-UHFFFAOYSA-N 274.408 2.438 10 10 CECE CO[C@H]1C[C@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 2156392323 VPSGVLLGHGPNHT-KBPBESRZSA-N 276.380 2.083 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)C3(CC3)C2)c(Cl)c1 2032396977 HCDKIOXVXQQKPC-RNCFNFMXSA-N 267.756 2.354 10 10 CECE CCCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(F)cc1O 62746518 PGAUYQIAYKYCTL-VHSXEESVSA-N 268.332 2.097 10 10 CECE CC[C@@]1(C(=O)N(C)[C@@H](C)c2ccccc2O)CCNC1 62896478 LVNTTWDZNSNXDT-BLLLJJGKSA-N 276.380 2.301 10 10 CECE C[C@H](N)c1ccc(N2CCCN3CCC[C@@H]3C2)cc1 62941048 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CCN(CC1CCOCC1)c1ccc(OC)cc1CN 2235956665 YTTKLXCVWMBVNX-UHFFFAOYSA-N 278.396 2.407 10 10 CECE COc1ccc(N2CCO[C@@](C)(C(F)F)C2)c(CN)c1 2235966529 UQNKYXYSCFTNSX-CQSZACIVSA-N 286.322 2.014 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)[C@H]1CC1(F)F 2227038260 VIWYDDPFAPQFMF-UPJWGTAASA-N 270.323 2.029 10 10 CECE COC[C@H](C)CN(C)c1ccc(OC)cc1C(=O)O 2227665964 PUVOZYMOQQZKNJ-SNVBAGLBSA-N 267.325 2.112 10 10 CECE COc1ccc(N2CCSC[C@H](C)C2)c(CCN)c1 2227685572 HYMQIVMAJSVGFF-GFCCVEGCSA-N 280.437 2.386 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC([S@](C)=O)C2)c(F)c1 2240041961 BSRSFHDXLXXDFG-GIPWTMENSA-N 298.427 2.281 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(CCS(C)(=O)=O)C(C)C 2240842915 YIHBFGRFEXJGID-CYBMUJFWSA-N 299.436 2.308 10 10 CECE Cc1nscc1CC(=O)NCC1(CN=[N+]=[N-])CC1 2254288093 AFFRBNPKRLCBHJ-UHFFFAOYSA-N 265.342 2.201 10 10 CECE Nc1ccc(N2CC[C@@H](N)C[C@@H]2C(F)(F)F)cc1 2254997988 ANQBPGHHQATBBY-MWLCHTKSSA-N 259.275 2.127 10 10 CECE CSc1ncc(CNC[C@]2(CCF)CCNC2)s1 2257126866 LNVDSEPLLMBRMI-GFCCVEGCSA-N 289.445 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c1cc2n(c1)CCN(Cc1ccc(N3CCOCC3)cc1)C2 932525837 HVTCXOBRGVWZOJ-UHFFFAOYSA-N 297.402 2.341 10 10 CECE CC[C@H](NCC1(N)CCOCC1)c1ccc(F)cc1O 863542159 SHYTVBWLAIXUOK-ZDUSSCGKSA-N 282.359 2.080 10 10 CECE Oc1cccc(F)c1CNC[C@@H]1C[C@H]2C[C@H]2CO1 1875658822 AZKGNWVXMPAAEI-VWYCJHECSA-N 251.301 2.046 10 10 CECE C[C@H](c1ccccc1O)N(C)c1ccnc(CN)c1 1877532911 MFRDOKCXHGMEHC-LLVKDONJSA-N 257.337 2.443 10 10 CECE Cc1cc(CN)ccc1N(C)[C@@H]1CCCN(C)CC1 1877824586 YCBJGZQVBIULHR-OAHLLOKOSA-N 261.413 2.374 10 10 CECE Cc1nc(O)ccc1C(=O)N(C)Cc1ccccc1O 1137345319 CJBYVISIALEFMH-UHFFFAOYSA-N 272.304 2.073 10 10 CECE CCCN(CCC)c1ccc(CNC[C@@](C)(O)CO)cc1 794748739 QPPUPXKVHUHBTK-QGZVFWFLSA-N 294.439 2.146 10 10 CECE NC1(C2CN(c3ccc(OCC(F)F)cc3)C2)CC1 1879916757 BDWSBJIRBOWYQL-UHFFFAOYSA-N 268.307 2.258 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)Cc2cnns2)c(F)c1 1880927699 LQKNPNNBQZZWEJ-SSDOTTSWSA-N 284.335 2.472 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H]3OCC[C@@H]3C2)c(F)c1 1880924274 PSPMOUTUYFSGNU-IGJMFERPSA-N 268.307 2.210 10 10 CECE Cc1ccc2c(c1)CCN2C(=O)c1ccnc2c1CC(=O)N2 1156838903 MQIBUHDAMYASFN-UHFFFAOYSA-N 293.326 2.088 10 10 CECE COc1ccc(O)c(CN2CC[C@H](CCC(=O)O)C2)c1 134704829 FRYSPEOWYUHYBO-NSHDSACASA-N 279.336 2.088 10 10 CECE O=C(c1ccccc1)[C@@H]1NCCc2c(O)ccc(O)c21 75799178 UIXNLUNETGLKFT-OAHLLOKOSA-N 269.300 2.168 10 10 CECE CC[C@]1(C)CN(CCO)c2ccc(OC)cc2N1 76931121 WGKHQXAYNVEQMG-CQSZACIVSA-N 250.342 2.088 10 10 CECE C[C@H](NCc1cc(F)cc(F)c1O)c1nccn1C 1962968198 UZTDVBJDWMHEAY-QMMMGPOBSA-N 267.279 2.255 10 10 CECE C[C@H]1OCC[C@@H]1CC(=O)N(C)Cc1ccccc1O 1885773314 KLSHFMAGXOEUKG-VXGBXAGGSA-N 263.337 2.166 10 10 CECE C[C@@H]1[C@@H](NCc2ccccc2O)CN1C(=O)OC(C)(C)C 1885890119 VVXCJRSZRUFKKK-YPMHNXCESA-N 292.379 2.490 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCNC(C)(C)C2)c1 396060461 JPPVWZJRNIFHQS-LLVKDONJSA-N 264.369 2.146 10 10 CECE CNCc1ccc(N2CC3(CCCO3)C2)cc1Cl 702940102 WICZEEUWTMNZEL-UHFFFAOYSA-N 266.772 2.429 10 10 CECE O=C(OCC1CCC(O)CC1)c1cc(O)cs1 1324897144 XJIKKPHHWKNITB-UHFFFAOYSA-N 256.323 2.162 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1cccnc1N 691147919 VDOGHXKRFZLKGW-JTQLQIEISA-N 271.320 2.203 10 10 CECE COc1ccc(CNCc2cnc(C)s2)c(O)c1 40997874 FFEFGRFOXLUGMI-UHFFFAOYSA-N 264.350 2.456 10 10 CECE CCN(Cc1ccccc1)C(=O)c1cc(O)c(O)c(O)c1 586734985 DAWYIJZCEULUDV-UHFFFAOYSA-N 287.315 2.466 10 10 CECE Nc1ccc(CN2CCCC23CC(C(=O)O)C3)cc1 1891475388 XDVOQVQDKORXFN-UHFFFAOYSA-N 260.337 2.098 10 10 CECE Nc1ccc(-n2nccc2NC(=O)CC2CC2)cc1 61628839 BPOFFBWCNUYLOF-UHFFFAOYSA-N 256.309 2.193 10 10 CECE CCNCc1ccc(OC)c(CN2C[C@H](C)CC2=O)c1 62816337 NTYWCWPFRNWPCT-GFCCVEGCSA-N 276.380 2.173 10 10 CECE NCCc1ccc2ccn(CCN3CCSCC3)c2c1 687840130 GOJPFKSVHDHLAQ-UHFFFAOYSA-N 289.448 2.191 10 10 CECE O=C(O)[C@]12CCCC[C@H]1CN(Cc1ccccc1O)C2 715878012 ZTMBQCMPTANFHB-BBRMVZONSA-N 275.348 2.469 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CC[C@@H](C)[C@@H](N)C1 70144380 BNJHBWAVPMYLMS-WWGRRREGSA-N 261.413 2.483 10 10 CECE COC[C@@H](CCN[C@@H](C)c1ccc(F)cc1O)OC 694317882 AHCQWWIBVRYICZ-CMPLNLGQSA-N 271.332 2.233 10 10 CECE CCC[C@@H]1C[C@](NCCN=[N+]=[N-])(C(=O)OCC)CCO1 90257202 WXQWWPACIFODQJ-YPMHNXCESA-N 284.360 2.167 10 10 CECE CC(C)Oc1cccc([C@@H](NCCN=[N+]=[N-])C(=O)O)c1 90256501 FXIPWCOABFVRBI-GFCCVEGCSA-N 278.312 2.499 10 10 CECE CC1(C(=O)NCCOc2ccc(N)cc2)CCCC1 94897658 RIMCXCRSSIJVGQ-UHFFFAOYSA-N 262.353 2.344 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCC1=CCCCC1 1450453098 HYRYNEJEIZZGMZ-UHFFFAOYSA-N 261.321 2.257 10 10 CECE COCCNCc1ccc(N2CCC[C@H]2CF)cc1 2115158963 ONHJQDOGIJMFQS-HNNXBMFYSA-N 266.360 2.361 10 10 CECE CCNCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(OC)c1 212669381 GQUKMMHIJXCRSE-STQMWFEESA-N 278.396 2.418 10 10 CECE CC(C)[C@@H](C(=O)O)N(C)[C@@H](C)c1c(O)cccc1O 2118366622 HVLOKRWYUMNSGN-ZANVPECISA-N 267.325 2.200 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)C1CC=CC1 2118456779 CCRTXNHGKDLLDO-UHFFFAOYSA-N 260.337 2.215 10 10 CECE Cc1cccc(C(=O)NCc2c(O)cccc2F)c1O 1471974801 KSJZLFITWAULAN-UHFFFAOYSA-N 275.279 2.475 10 10 CECE COc1cccc(O)c1CN[C@H](CO)c1cccs1 2118996126 ITIFAXUTJHTQMF-LLVKDONJSA-N 279.361 2.286 10 10 CECE CN[C@H](C)c1ccc(N2CC=CC[C@@H]2CO)c(F)c1 2119816705 VQXBNXQUJSAEDI-DGCLKSJQSA-N 264.344 2.233 10 10 CECE CC=C(C)[C@@H](N)[C@@H](O)c1ccc2c(c1)CCCN2C 2120356593 BOLVUQZKWOUBFB-CVEARBPZSA-N 260.381 2.396 10 10 CECE O=C(CCc1ccon1)NCc1cccc(Cl)c1O 1472317190 YYMIWHKPEHIBTB-UHFFFAOYSA-N 280.711 2.283 10 10 CECE CCc1cccc(CNCc2cccc(O)c2O)n1 2121952815 XBBNUVYJKGIIBX-UHFFFAOYSA-N 258.321 2.345 10 10 CECE CN1CCC[C@@H](N(C)c2cc(Cl)c(CN)cc2F)C1 2120881689 OKBSCTPYCZSYIC-LLVKDONJSA-N 285.794 2.468 10 10 CECE CCc1ncncc1NCc1cccc(OC)c1O 2122253843 MXCFSJWPENLWLZ-UHFFFAOYSA-N 259.309 2.365 10 10 CECE CN(c1ccc(N)cc1)[C@H]1CO[C@]2(CCCOC2)C1 2122476871 QNCSGSBVSOFVFF-HUUCEWRRSA-N 262.353 2.043 10 10 CECE CN(CC12CC(CCO1)C2)c1ccc(CN)cc1F 2122925569 ZKIRPRNXGPVNCD-UHFFFAOYSA-N 264.344 2.290 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1cccc(C(N)=O)c1 2123017744 BUIPJIGCKNPDJW-LBPRGKRZSA-N 259.313 2.060 10 10 CECE O=C(NCc1cccc(O)c1O)c1cc(Cl)c[nH]1 1643809404 MOERRZGNWIYVCO-UHFFFAOYSA-N 266.684 2.009 10 10 CECE O=C(NCc1c(O)ccc2ccccc12)c1ncc[nH]1 1647791840 WLJYECVJEYNKLK-UHFFFAOYSA-N 267.288 2.199 10 10 CECE CCN1CCC[C@@H]1CNCc1c(O)cccc1F 1964535926 MERWPZIETVTMQK-LLVKDONJSA-N 252.333 2.105 10 10 CECE CCCN1CCC(NCc2ccc(F)cc2O)CC1 1964584719 NUAXRDQPLISWPH-UHFFFAOYSA-N 266.360 2.495 10 10 CECE CC(C)[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)CN1 1964668827 ZFGVSDIQXOFLTK-HOCLYGCPSA-N 261.413 2.229 10 10 CECE COc1cccc(O)c1CNC[C@@]1(CO)CC12CCC2 1964613845 HFVGFFIFTJILKJ-MRXNPFEDSA-N 277.364 2.043 10 10 CECE COC[C@H]1C=CCCN1c1ccc([C@@H](C)O)c(O)c1 2125946520 FOQPTEMSNCZCPP-DGCLKSJQSA-N 263.337 2.227 10 10 CECE Cn1ncc2cc(C(=O)NCCCCN=[N+]=[N-])sc21 1964942826 IKXMLQMYZRIUBA-UHFFFAOYSA-N 278.341 2.455 10 10 CECE CC1(C)SCC[C@@H]1CNC(=O)c1cccc(O)c1O 1965403986 ZIJYEGZSXJMOGG-SECBINFHSA-N 281.377 2.359 10 10 CECE CCc1cccnc1CNCc1cc2c(cc1O)OCO2 158424785 PQSIHCSZGNHVSQ-UHFFFAOYSA-N 286.331 2.368 10 10 CECE CN1CC[C@H](CN(C)Cc2cc(Cl)ccc2O)C1 156017250 FLOPPDNLNGWQCZ-NSHDSACASA-N 268.788 2.429 10 10 CECE COC1CCN(c2ccc(/C=C\C(=O)O)cc2)CC1 208557288 XEJAHWKPTDAIEF-DAXSKMNVSA-N 261.321 2.400 10 10 CECE C[C@H]1CN(C)CCN1c1ccc2c(c1)CCC[C@H]2N 2128269348 RDUHTHFNCYJTRB-BLLLJJGKSA-N 259.397 2.163 10 10 CECE Cc1cc(CN)ccc1N1[C@H]2CC[C@@H]1C[C@H](CO)C2 2128255688 KRDVORZNZDZXQU-QDMKHBRRSA-N 260.381 2.193 10 10 CECE N[C@@H]1CCCc2cc(N3CCC[C@H](CO)C3)ccc21 2128277301 MEFRTAACZFCOCH-BLLLJJGKSA-N 260.381 2.231 10 10 CECE CN(Cc1cnn(C)c1)c1ccc2c(c1)CC[C@@H]2O 2128321801 KNGMXCRZQPKVBW-HNNXBMFYSA-N 257.337 2.036 10 10 CECE CN(C[C@@]12COC[C@H]1C2)c1ccc2c(c1)CC[C@H]2O 2128317073 MHZOKMXIFHCGOC-WQVCFCJDSA-N 259.349 2.139 10 10 CECE Cc1cccc(O)c1CN(C[C@@H](C)C(=O)O)C1CC1 2131184601 LSQBXJLSFFVTRW-LLVKDONJSA-N 263.337 2.386 10 10 CECE C[C@@H]1COC[C@H]1N(C)c1ccc(C=CC(=O)O)cc1 1911995507 VKGFKTKZUPVJEH-BXUZGUMPSA-N 261.321 2.256 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCS[C@H](C)C1 1912173393 MBLXCDKTVCRCAA-ZYHUDNBSSA-N 286.401 2.494 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CC(=O)NCCc2cccs2)C1 1912177544 JMEWGNFNUXCRIF-NSHDSACASA-N 293.396 2.039 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@@H]2CC23CCOCC3)CC1 1912162949 CMZHRWGTTJDHQM-LBPRGKRZSA-N 278.356 2.352 10 10 CECE Cc1ccc(S(=O)(=O)N2CC[C@H](CN=[N+]=[N-])C2)c(F)c1 1912201742 YNQZTMKJDDKXMM-SNVBAGLBSA-N 298.343 2.455 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCCNC23CC3)cc1 2134172507 JSCNPGITJNVSAP-OAHLLOKOSA-N 259.397 2.127 10 10 CECE CCOc1cccc(CNC[C@H]2CC3(CC3)CO2)c1O 1967810474 YAXIDDYMELTJRF-CYBMUJFWSA-N 277.364 2.450 10 10 CECE CC(=O)C(=O)[C@H](O)c1ccc(-c2ccc(F)cc2)o1 1919043614 AUFBYKGLXPIEAK-CQSZACIVSA-N 262.236 2.277 10 10 CECE CC[C@@]1(C)CN(c2ccc3c(c2)OCO3)[C@@H](C)CN1 225618377 ZICOHVPULXLOFY-NHYWBVRUSA-N 262.353 2.382 10 10 CECE COc1ccc([C@H](C)NCCCc2ncc[nH]2)c(O)c1 139249939 TVGHALGFUDOBPV-NSHDSACASA-N 275.352 2.407 10 10 CECE CCO[C@@H]1C[C@H](NC(=O)c2ccc(O)c(O)c2)C1(C)C 227032604 KPNMTTXZTFTIOZ-QWHCGFSZSA-N 279.336 2.031 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@]3(CO)C2)c(Cl)c1 2136090721 PLICRJSHCOQGMZ-JVLSTEMRSA-N 280.799 2.439 10 10 CECE C[C@H](O)c1ccc(N2CC(=O)N(C)[C@@H](C)C2)c(Cl)c1 1926025855 CZDYDQZQCVTZHA-UWVGGRQHSA-N 282.771 2.060 10 10 CECE C[C@@H](CC(=O)O)N(C)Cc1c(O)cccc1Cl 1926916132 DQZHKXCUPRTGMK-QMMMGPOBSA-N 257.717 2.341 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c(OC)c2)C[C@H](C)O1 2139683070 QGILCIJRJHOCQV-SMDDNHRTSA-N 265.353 2.191 10 10 CECE CCn1cc(-c2cncn2Cc2ccc(N)cc2)cn1 234248213 JQSKYQQFQCPKQY-UHFFFAOYSA-N 267.336 2.397 10 10 CECE CC[C@H](CO)CNCc1ccc(Br)cc1O 1939304399 QKUGKHKCKMIAQQ-VIFPVBQESA-N 288.185 2.263 10 10 CECE Cc1cc(N2C[C@H](O)[C@@H](F)C2)ccc1CNC(C)(C)C 2149246780 AFYQNRVFKNJTEY-GJZGRUSLSA-N 280.387 2.402 10 10 CECE CCN(CC)c1ccc([C@H](O)CC(=O)OC)c(OC)c1 1951587814 CZJHVUTWCLJBBL-CYBMUJFWSA-N 281.352 2.138 10 10 CECE CCOC(=O)C(C)(C)[C@@H](N)c1ccc(F)cc1O 1951854904 LACIMEWVYTYSBT-NSHDSACASA-N 255.289 2.120 10 10 CECE CN[C@H](COC)c1cc(Br)cc(F)c1O 1951960752 BQFMWQZVPHTVSX-SECBINFHSA-N 278.121 2.201 10 10 CECE COC(=O)[C@@H]1CCN[C@H](c2cccc(Cl)c2O)C1 1952447291 FGNOALAKRAWEBM-KCJUWKMLSA-N 269.728 2.259 10 10 CECE CC(C)(C)OC(=O)Nc1cccc([C@@H]2NCC[C@@H]2O)c1O 1952682892 POKNTQUTVJVLTB-RYUDHWBXSA-N 294.351 2.135 10 10 CECE CN(CC[C@H]1CCCO1)c1ccc(CO)cc1[N+](=O)[O-] 1972185392 WZNPUXKOTNMDAH-GFCCVEGCSA-N 280.324 2.092 10 10 CECE Cc1cc(O)nc(CN(C)[C@H](C)c2ccccc2O)n1 2143420820 XTVUBSSGOAGGSZ-LLVKDONJSA-N 273.336 2.389 10 10 CECE C[C@H](NCc1ccc(F)c(F)c1O)C12CC(CO1)C2 1973565709 DLKZBYQKMHFQRP-JUXJKVCFSA-N 269.291 2.328 10 10 CECE CCc1cccc(CNC[C@@H]2C[C@]23CCOC3)c1O 1974223836 LIPOWQAIWNGHKJ-HOCLYGCPSA-N 261.365 2.471 10 10 CECE CCNCc1ccc(N(C)C[C@@H]2COCCO2)c(Cl)c1 2143679874 PMYCEGIQGOWFGX-CYBMUJFWSA-N 298.814 2.301 10 10 CECE CNCc1cncc(CN(C)c2ccc(OC)cc2)c1 2143937342 FACLORZJSKOFTR-UHFFFAOYSA-N 271.364 2.446 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CCSC(C)(C)C3)ccc21 158834144 RKHBKAORBBETFX-CYBMUJFWSA-N 291.420 2.231 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1ccc(O)cc1 35360145 TXZCFVZPINORSL-UHFFFAOYSA-N 256.305 2.247 10 10 CECE Oc1c(F)cccc1CN1CCN2CCCC[C@@H]2C1 160247850 BHUKWSKFUJVWCW-CYBMUJFWSA-N 264.344 2.201 10 10 CECE Cc1noc(CNCc2ccc(N3CCCC3)cc2)n1 38034092 VLROQUNJRRRNCM-UHFFFAOYSA-N 272.352 2.268 10 10 CECE CC(C)OC1CN(c2ccc(CO)c(Cl)c2)C1 1996706884 AZKALJGXWUJLMS-UHFFFAOYSA-N 255.745 2.446 10 10 CECE CC1(C)C[C@H](NCc2cccc(Cl)c2O)[C@H]1O 1998348985 GZICFGNJVHDQQL-CMPLNLGQSA-N 255.745 2.295 10 10 CECE CC(C)NCc1ccc(N2CCCNC(=O)C2)c(Cl)c1 164115731 VNQHQQHUCGAIAK-UHFFFAOYSA-N 295.814 2.164 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@@H]2C[C@]2(CO)C1 2146309365 FDWTYWGEWOEVRZ-WMLDXEAASA-N 272.392 2.066 10 10 CECE O=C(O)[C@@H]1C[C@]12CCCN(Cc1cc(F)ccc1O)C2 2146459200 GBQGTTVZFFAQTB-WFASDCNBSA-N 279.311 2.218 10 10 CECE CCNCc1ccc(N2CC(F)(F)C[C@]2(C)CO)cc1 2159049001 JVNQNIKPCHHDLX-CQSZACIVSA-N 284.350 2.393 10 10 CECE OCc1cc(F)c(N2CCC[C@@H]3OCC[C@H]3C2)c(F)c1 2151891144 XWJHYOGAFRVDPH-FZMZJTMJSA-N 283.318 2.462 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCS[C@H]3CC[C@H]32)cc1 2152206778 NMRSFRKWRIOCJO-PMPSAXMXSA-N 291.464 2.332 10 10 CECE C[C@@H](C(=O)N1CC[C@H](CN=[N+]=[N-])C1)C(F)(F)F 2009554793 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2.495 10 10 CECE OCc1ccc(N2CCO[C@@H](CF)C2)cc1C1CC1 2339159723 HDOHKFQUUVIJCI-AWEZNQCLSA-N 265.328 2.231 10 10 CECE CN(c1ccc(CN)c(C2CC2)c1)[C@H]1CCC[C@H]1O 2339162296 YDZRTMYEJPZZCR-JKSUJKDBSA-N 260.381 2.372 10 10 CECE CN(CC1(O)CC1)c1ccc(CN)c2ccccc12 2340253119 LUIQRIREQVINEZ-UHFFFAOYSA-N 256.349 2.260 10 10 CECE COc1ccc(O)c(CNC(C)(C)[C@@H](O)C(C)C)c1 2340381025 LHHKEGYINPCQKQ-AWEZNQCLSA-N 267.369 2.286 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC(C)(N(C)C)C2)c1C 2341068135 WEJGSDJSCZQYHL-CYBMUJFWSA-N 262.397 2.497 10 10 CECE COc1cc(Cl)c(N2CC[C@H]3C[C@]3(O)C2)c(OC)c1 2342303143 UMIJJOCUGFKVQS-XPTSAGLGSA-N 283.755 2.318 10 10 CECE CN(CCC(=O)O)c1ccc(CN2CCCC2)cc1 108256520 PTRZDVKKRBOWKO-UHFFFAOYSA-N 262.353 2.193 10 10 CECE CCCNCc1ccc(N(C)CC[C@@H](C)O)cc1 135585799 DNBIMTSZEAYNQO-CYBMUJFWSA-N 250.386 2.393 10 10 CECE Cc1cc(N2CCC[C@H](N)C2)ccc1OC[C@H]1CCCO1 63063418 JVMVTCULKTXYRO-GOEBONIOSA-N 290.407 2.480 10 10 CECE COC[C@@H]1CCN([C@H](C)c2c(O)cccc2O)C1 300438363 ARWKORMSHGATPY-GHMZBOCLSA-N 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CC(=O)C(=O)COC(=O)c1cc2ccc(F)cc2s1 808497962 YRWYUGJXKDDSOR-UHFFFAOYSA-N 280.276 2.355 10 10 CECE CC[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H]1O 294148576 HWRJLWMOYKWSPW-AMIZOPFISA-N 273.735 2.387 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H]3C[C@@]34CCOC4)ccc21 2163126510 JLPUSANXBZZCLR-DJIMGWMZSA-N 272.392 2.495 10 10 CECE CN(C)c1ccc([C@@H](N)[C@](C)(O)Cc2ccco2)cc1 2163134422 YINXDVRLLMIBOV-HZPDHXFCSA-N 274.364 2.339 10 10 CECE CCN1CCc2cc([C@@H](N)c3cnn(CC)c3)ccc21 2163140046 FHXDMISFRBVGRW-MRXNPFEDSA-N 270.380 2.334 10 10 CECE C[C@@H]1CN([C@H](C)c2cc(O)ccc2O)C[C@H]1CCN 723920825 ZWTLYTCKYJALSP-IJLUTSLNSA-N 264.369 2.076 10 10 CECE Oc1cc(F)c(Cl)cc1CN1CC2(CCOC2)C1 293962785 JQMZNCSUXDFIFM-UHFFFAOYSA-N 271.719 2.407 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](OC(C)(C)C)c1ccccc1 808528738 NNKGYZAJBZVPRE-AWEZNQCLSA-N 292.331 2.244 10 10 CECE CNCc1ccc(N2C[C@H]3COC[C@@H](C3)C2)c(C)c1 2132522846 CIMDJSMIHVGPCB-GJZGRUSLSA-N 260.381 2.187 10 10 CECE FC(F)Oc1ccc2c(c1)CCCN2C[C@@H]1COCCO1 828152926 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COCCN(CCF)c1ccc(/C=C\C(=O)O)cc1 697300101 XHAGECJVXGQMCU-DAXSKMNVSA-N 267.300 2.207 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@]1(O)C[C@H]2C=C[C@H]1C2 850374550 LXPSEQFTQVRCGC-WBIUFABUSA-N 279.767 2.462 10 10 CECE CO[C@@H](CNCc1c(O)cc(C)cc1Cl)[C@@H]1CCOC1 850342853 NYILMFJZHBVWRL-ABAIWWIYSA-N 299.798 2.495 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@]1(C)CCCCO1 935944856 AWMGRTBXJHNOEM-MRXNPFEDSA-N 298.379 2.453 10 10 CECE C[C@H](NCCOCCCN)c1cc2c(cc1O)CCCC2 863546293 KXGUIKPNUGBPBE-ZDUSSCGKSA-N 292.423 2.287 10 10 CECE CCOc1ccc(O)c(CN(C)[C@H]2CCN(C3CC3)C2)c1 769327428 ZCYOCMMOMQPQTG-HNNXBMFYSA-N 290.407 2.459 10 10 CECE Nc1ccc(OCCNC(=O)c2cccs2)cc1 32112429 SWMHSLOVHIPWQM-UHFFFAOYSA-N 262.334 2.139 10 10 CECE O=C(c1ocnc1C1CC1)N1Cc2cccc(O)c2C1 871205188 QPFDIYBVUKGPCV-UHFFFAOYSA-N 270.288 2.414 10 10 CECE CCOc1ccc(CNc2n[nH]c3c2COCC3)c(O)c1 886207483 DQWLRRYZKWQPIO-UHFFFAOYSA-N 289.335 2.199 10 10 CECE C[C@H](c1ccco1)N(C)C(=O)Cc1ccc(O)c(O)c1 1136114310 ZUEMHONHMLAQBZ-SNVBAGLBSA-N 275.304 2.453 10 10 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CN1CCN(Cc2cccc(F)c2O)CCC1(C)C 712663339 KGMYSHABVBEBFQ-UHFFFAOYSA-N 266.360 2.447 10 10 CECE COc1ccc(N2C[C@@H](OC)CC[C@@H]2C)c(N)c1 687202216 NTYKOJFUMWCVGE-JQWIXIFHSA-N 250.342 2.281 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1NCc1cc2c(cc1O)OCO2 716587229 WMYPFZAZKXNCHA-KLHWPWHYSA-N 261.321 2.255 10 10 CECE NC(=O)C1CCC(Nc2c(N)cccc2Cl)CC1 716739408 DFXYTAAFUSEPRI-UHFFFAOYSA-N 267.760 2.378 10 10 CECE CSc1ccccc1C(=O)N1CCSC[C@H]1CCO 689301825 SDHCKMJWROXGDM-LLVKDONJSA-N 297.445 2.349 10 10 CECE CN1Cc2ccc(N3[C@H]4CC[C@H]3CC(=O)C4)cc2C1 689503130 VRPNKVRCOMCEPQ-GJZGRUSLSA-N 256.349 2.332 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@@H]1CCCSC1 689554415 VQBGTQHTHZNDSX-SNVBAGLBSA-N 267.350 2.065 10 10 CECE Cc1ccc(CCNC(=O)Cc2ccc(N)cc2)o1 689854895 OSDBOCHUTGEVNV-UHFFFAOYSA-N 258.321 2.072 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1CCCN2CCSC[C@H]12 720410495 VIQUIHVYBHMZOE-ZIAGYGMSSA-N 296.411 2.201 10 10 CECE COc1ccc(CN[C@H]2C[C@H](O)CC(C)(C)C2)c(O)c1 693845582 CHHMGJFYMYFJKN-STQMWFEESA-N 279.380 2.430 10 10 CECE CSc1ncc(CN[C@H]2CCNC3(CC3)C2)s1 2248714398 GHRUNTPCKLETAS-VIFPVBQESA-N 269.439 2.239 10 10 CECE COc1ccc(N2C[C@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])c1 694711295 MGAYAJNOLPBGGH-HZMBPMFUSA-N 280.324 2.058 10 10 CECE C[C@@H](CO)[C@@H]1CCCCN1c1c(F)cc(CN)cc1F 696716056 VVCSPDMHSAXJQJ-HZMBPMFUSA-N 284.350 2.411 10 10 CECE CCOC(CN[C@@H](C)c1cc(O)ccc1O)OCC 93447499 HNEOINYDDJPWPC-JTQLQIEISA-N 269.341 2.148 10 10 CECE OCC1(F)CN(c2ccc(CNC3CC3)cc2Cl)C1 2116283429 XHAOITZJDVVHLB-UHFFFAOYSA-N 284.762 2.113 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)c1cnc(C2CC2)s1 2116335675 WMGFDSFXERCOTR-VIFPVBQESA-N 281.341 2.436 10 10 CECE CCCNC(=O)CCN(C)[C@H](C)c1ccccc1O 2116892376 XTWIMGHFUAUXNJ-GFCCVEGCSA-N 264.369 2.301 10 10 CECE C[C@H]1CC(C)(C)CN1C(=O)Cc1ccc(O)c(O)c1 1469054879 BVYZEUIZRBQPBL-JTQLQIEISA-N 263.337 2.287 10 10 CECE CCNCc1ccc(N2CCOC[C@H]2C(F)F)cc1 2119029624 WMYHZCMKSLVOJZ-ZDUSSCGKSA-N 270.323 2.266 10 10 CECE Cc1cc(C)c(C(=O)NCc2cc(O)ccc2O)c(C)n1 1471662126 OYFMHSUZHHZMOW-UHFFFAOYSA-N 286.331 2.348 10 10 CECE COc1ccc(N2C[C@H](C)CNC[C@@H]2C)c(OC)c1 217116634 ITZPDBWIKUIDSX-NEPJUHHUSA-N 264.369 2.138 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1 2121681704 JLPRQXHDSQLNKN-HPEDKQMDSA-N 260.381 2.302 10 10 CECE Cc1csc(N(C)C(=O)c2cccc(O)c2O)n1 1542922562 NBMWIGHIHMJOQA-UHFFFAOYSA-N 264.306 2.139 10 10 CECE CCc1cccc(CN[C@H]2C[C@@H]([C@H](F)CO)C2)c1O 1907257418 KVTACRDCOWLHHL-HZSPNIEDSA-N 267.344 2.153 10 10 CECE CN(C)c1ccccc1NC(=O)Cc1ccc(O)c(O)c1 1629806889 RMZSFFDDQOCYTA-UHFFFAOYSA-N 286.331 2.345 10 10 CECE O=C(/C=C\c1cccnc1)NCc1c(O)cccc1F 1635360639 OYRMRZGEOWRSIV-SREVYHEPSA-N 272.279 2.256 10 10 CECE Cc1ncsc1NC(=O)Cc1ccc(O)c(O)c1 1633065906 QAHSOIDSPOVKAE-UHFFFAOYSA-N 264.306 2.044 10 10 CECE O=C([C@H]1COc2ccccc2O1)N1Cc2cccc(O)c2C1 1636231254 XYXQTHJLFNMPIX-MRXNPFEDSA-N 297.310 2.074 10 10 CECE COc1ccc(N(C)[C@@H]2CCC[C@H]2N)cc1OC 259119878 TWAKFYSCBFQTGB-VXGBXAGGSA-N 250.342 2.020 10 10 CECE CCOc1ncc(C)cc1NC(=O)c1cccc(O)c1O 1637663824 ZSJGFSFEEKHEEB-UHFFFAOYSA-N 288.303 2.452 10 10 CECE CC(C)(C)C(=O)CNC(=O)c1ccc(N=NC(N)=O)cc1 1630657979 XFPVKAVWDUBULO-UHFFFAOYSA-N 290.323 2.194 10 10 CECE Cn1cc(/C=C/C(=O)NCc2cc(Cl)ccc2O)cn1 1644590520 CWIKQVODYBRUQI-GORDUTHDSA-N 291.738 2.109 10 10 CECE CN(C)c1ccc(CN2CC(=O)NC[C@H]2C(C)(C)C)cc1 1654901098 WMRIRDPJTTUPGI-HNNXBMFYSA-N 289.423 2.099 10 10 CECE O=C(CSc1ccncc1)NCc1c(O)cccc1F 1596906929 NEEZAPBTIZOSCR-UHFFFAOYSA-N 292.335 2.335 10 10 CECE Cc1cc(N)c(N(C)Cc2ccc(N)cc2)nc1C 2125285849 KHMBJTZPJHXEMW-UHFFFAOYSA-N 256.353 2.499 10 10 CECE COCc1n[nH]c(=Nc2cc(Cl)ccc2O)s1 1859849378 ALAYTALAGNLUNO-UHFFFAOYSA-N 271.729 2.209 10 10 CECE Nc1ccc(NC(=O)[C@@H](N)Cc2c[nH]c3ccccc23)cc1 1865948337 NXHOGTRXQMYPPR-HNNXBMFYSA-N 294.358 2.259 10 10 CECE C[C@@H]1C[C@H](CO)CN(c2ccc3c(c2)CC[C@@H]3N)C1 2128322775 SSKIYEBFOMMRFF-WQGACYEGSA-N 260.381 2.087 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@H]3O)C[C@@H]1N(C)C 2128318503 VNEBCPSOBRDNMM-KNXALSJPSA-N 260.381 2.053 10 10 CECE NCc1ccc(N2CC[C@H]3CCOC[C@H]3C2)cc1F 2128997062 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10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CC4(CCC4)C3)ccc21 1914942156 KWIDEAGFPASAOG-CQSZACIVSA-N 271.364 2.280 10 10 CECE Nc1ccc(OCC(=O)N2CC3(CCCCC3)C2)cc1 1915336837 CJRGWKVCWWKBOG-UHFFFAOYSA-N 274.364 2.440 10 10 CECE NCc1ccc(N2CC3(CCOCC3)C2)c(F)c1F 1915826082 LYYRODGMJUQVQG-UHFFFAOYSA-N 268.307 2.040 10 10 CECE CCCCOCCO[C@@H](C)C(=O)Nc1ccc(N)cc1 20507396 UWLBGRAYQDGALX-LBPRGKRZSA-N 280.368 2.429 10 10 CECE C[C@H](NC[C@@H]1CCC[C@@H](O)C1)c1ccc(O)cc1O 227607476 XLKSVJJNAHNXSW-QJPTWQEYSA-N 265.353 2.300 10 10 CECE COc1cc(Cl)cc(CN2CC=C[C@@H](C(=O)O)C2)c1O 1968223899 POPBMYBXNMTBEW-SECBINFHSA-N 297.738 2.127 10 10 CECE CC(C)C[C@@H](CO)[C@H](N)c1ccc2c(c1)CCN2C 1927617674 JKXJALMSDGDIAY-GOEBONIOSA-N 262.397 2.333 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](O)C2(C)C)cc1O 2136630258 KMOWANLYIAQBFJ-QMTHXVAHSA-N 264.369 2.022 10 10 CECE Cc1cccc(CNC(=O)CC[C@@H]2CCCO2)c1O 2139750029 BWOLXMJDQGKLQZ-ZDUSSCGKSA-N 263.337 2.276 10 10 CECE C[C@H]1CCN(Cc2ccc(F)cc2O)[C@H](C(=O)O)C1 2139756743 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264.369 2.295 10 10 CECE Oc1cc(F)ccc1CNC[C@H]1COCCC1(F)F 1974460614 YKCBXFCVTGVWRF-JTQLQIEISA-N 275.270 2.293 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](O)C(F)(F)CC2)c(F)c1 2150043261 RUODNWHVPKOGSR-RNCFNFMXSA-N 289.297 2.475 10 10 CECE Cc1ccc([C@@H](C)N2CCC[C@H]2C(=O)N(C)C)c(O)c1 2143700039 JFCRPVMZLNCOCN-OCCSQVGLSA-N 276.380 2.314 10 10 CECE Cc1ncccc1[C@H](N)[C@H](O)c1ccc(N(C)C)cc1 2147377571 CYBJVRAJXYVRDO-JKSUJKDBSA-N 271.364 2.189 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]32)cc1O 2143969999 DBXIKJAWDJVOTQ-FMVNMVDZSA-N 276.380 2.152 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3C[C@H]4CCC[C@H]4C3)ccc21 158191720 MIIAUGVEAREJBE-JRPNMDOOSA-N 271.364 2.136 10 10 CECE CCOC(=O)C[C@H](N)c1cc2ccccc2cc1O 260944398 KZTADBVIHSREDD-ZDUSSCGKSA-N 259.305 2.498 10 10 CECE Nc1ccc(OCCC(=O)NC[C@@H]2CC23CCC3)cc1 2149412738 DQEUNELGZFASQG-LBPRGKRZSA-N 274.364 2.344 10 10 CECE Cc1ccnc(CNC(=O)c2cccc(O)c2O)c1C 2145140513 HTYQOCZEGBXGNJ-UHFFFAOYSA-N 272.304 2.040 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CCCC1CNC1 2145304821 SYMMPPCJGKGSEU-GFCCVEGCSA-N 276.380 2.301 10 10 CECE COc1ccc([C@@H](O)[C@@H](N)c2ccccc2O)cc1C 2148165622 TXDZRHHYCYTENW-JKSUJKDBSA-N 273.332 2.443 10 10 CECE CCN[C@H](c1ccccc1O)[C@@H](O)c1cnn(C)c1Cl 2148150765 FBNTXPMVQSKRCS-OLZOCXBDSA-N 295.770 2.163 10 10 CECE C[C@@H](NCc1ccc(O)cc1O)c1cnsc1 1998187624 IYAYONUCMMFRCK-MRVPVSSYSA-N 250.323 2.405 10 10 CECE COc1cc(CN2CCc3cc([C@H](C)N)ccc32)on1 2145840698 CHNRRQDGKCGOAQ-JTQLQIEISA-N 273.336 2.266 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CCC[C@@]3(CO)C2)cc1O 2159410090 SZRQTDMUIYNXTB-MKBNYLNASA-N 276.380 2.011 10 10 CECE C[C@H](CC(N)=O)N(C)c1ccc(C=CC(=O)O)cc1Cl 2151338978 UATQQILTYHUJID-SECBINFHSA-N 296.754 2.138 10 10 CECE CC(C)(C)C1CN(c2cc3c(cc2F)[C@H](O)C(=O)N3)C1 2151480296 KVAHZPMCCSGZPJ-ZDUSSCGKSA-N 278.327 2.294 10 10 CECE Oc1cccc(F)c1CN=c1[nH]ccnc1Br 2008700416 YRTFNOMSEFCGQB-UHFFFAOYSA-N 298.115 2.118 10 10 CECE COc1ccc(CN2CC[C@H]3OCCC[C@H]3C2)c(O)c1 245773354 SFIVBZPQOMRXME-XJKSGUPXSA-N 277.364 2.402 10 10 CECE CCNC(=O)CN(C)c1ccc(CNC(C)C)c(C)c1 50583996 BUHDZQLGHFIORB-UHFFFAOYSA-N 277.412 2.065 10 10 CECE CC1(CCCNCc2ccc(O)c(O)c2O)CC1 2027812099 JHQBGTHGDVRXPQ-UHFFFAOYSA-N 251.326 2.473 10 10 CECE CN(C)c1ccc([C@@H]2N[C@H](CC(F)F)CO2)cc1 2028007508 BJWKAZVGTJFTQR-ZWNOBZJWSA-N 256.296 2.395 10 10 CECE C[C@@H](N[C@H]1CCCn2ncnc21)c1cc(F)ccc1O 185663580 WXKBTIPVMGUCBU-SKDRFNHKSA-N 276.315 2.309 10 10 CECE C[C@@H]1C[C@@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)CO1 2038003363 VXTSXCCFXCIVER-GMTAPVOTSA-N 252.318 2.103 10 10 CECE CCN1CCCN(c2ccc(CN)c(Cl)c2)CC1 307788518 UEOFUKLLCQHDLC-UHFFFAOYSA-N 267.804 2.331 10 10 CECE COc1ccc([C@@H](C)N2CCN(CCF)CC2)c(O)c1 402854618 CXONVDCZHCUNNW-GFCCVEGCSA-N 282.359 2.049 10 10 CECE CC[C@@H](NC)c1ccc(N(C)Cc2nncn2C)cc1 312251395 ACICLKUPCMQYOA-CQSZACIVSA-N 273.384 2.122 10 10 CECE C[C@@H]1CCO[C@H]1CCOC(=O)COc1ccc(N)cc1 2157344877 KEJLYMOQIQWEML-RISCZKNCSA-N 279.336 2.006 10 10 CECE COCCN1CC[C@H](N(C)[C@@H](C)c2ccccc2O)C1 2160028093 BBKMSTBEDDBHIK-KBPBESRZSA-N 278.396 2.106 10 10 CECE Oc1c(Cl)cc(Cl)cc1CNCC1COC1 527816702 HOBKOJMKEDNGEV-UHFFFAOYSA-N 262.136 2.435 10 10 CECE CN1CCc2cc(CNCC3(O)CCCCC3)ccc21 87017027 SOONFRFEAZLNNR-UHFFFAOYSA-N 274.408 2.464 10 10 CECE CC1(C)C[C@H](CNCCc2ccc(O)c(O)c2)CCO1 2161589434 OUECTJFRLZBGJN-CYBMUJFWSA-N 279.380 2.435 10 10 CECE Oc1cccc(-c2nc(C[C@H]3CC3(F)F)no2)c1O 701930761 JNYLTDJRYACILM-LURJTMIESA-N 268.219 2.346 10 10 CECE Oc1ccc(CNCc2ccncc2Cl)cc1O 704403970 MSXIEHSXGMVBGP-UHFFFAOYSA-N 264.712 2.436 10 10 CECE Oc1c(F)cccc1CNCC12CCCN(CCC1)C2 705801242 ONKPOPOHQLNBEV-UHFFFAOYSA-N 278.371 2.497 10 10 CECE CCOC[C@@H]1CN(c2ccc(CNC)cc2Cl)CCO1 706699972 JECHFEMFIXZYHN-ZDUSSCGKSA-N 298.814 2.301 10 10 CECE CN(C[C@@H]1C[C@H]2C[C@@H]2CO1)c1c(F)cc(CO)cc1F 2179423667 XGTRDCNLDXIPCT-UTUOFQBUSA-N 283.318 2.318 10 10 CECE CCN(c1ccc([C@H](C)NC)cc1)[C@H]1CCCNC1=O 2171227450 LSUCVIMQCLVOLB-WFASDCNBSA-N 275.396 2.072 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@]23COC[C@@H]2C3)cc1O 689320790 PRQCEMXTEFUFSO-BFQNTYOBSA-N 276.380 2.145 10 10 CECE C[C@@H](c1cnn(C)c1)N(C)c1ccc(CN)c(F)c1F 710552423 VSOWAQGRMPYWFM-VIFPVBQESA-N 280.322 2.354 10 10 CECE CCc1cccc(CNCC[C@H](C)[S@](C)=O)c1O 691501581 WQZLSEIRVXKBDI-VOJFVSQTSA-N 269.410 2.201 10 10 CECE CC(C)c1ncn([C@H](C)C(=O)Nc2ccc(N)cc2)n1 380775755 RHFGUAMVQHQJOS-SNVBAGLBSA-N 273.340 2.183 10 10 CECE Nc1ccc(OCCC(=O)N[C@@]23CCC[C@H]2C3)cc1 693234052 USXMBLDQNYLKDP-XHDPSFHLSA-N 260.337 2.097 10 10 CECE CCN(C[C@H](O)COc1ccc(N)cc1)C(C)(C)C 382134023 PGTBQYURBJTFHY-ZDUSSCGKSA-N 266.385 2.129 10 10 CECE CCS[C@@H]1CCN(CC(=O)N(C)c2ccc(N)cc2)C1 382900737 BTMQQJCWUSTMNQ-CQSZACIVSA-N 293.436 2.059 10 10 CECE COc1cccc(O)c1CN[C@H]1CCN(C)CC1(C)C 2162872595 PAKRAYZMGUTNKY-HNNXBMFYSA-N 278.396 2.221 10 10 CECE CC(C)NCc1ccc(N2C[C@H](O)C[C@@H]2C)c(C#N)c1 384798500 QVSXRQNDQFIOSM-SWLSCSKDSA-N 273.380 2.016 10 10 CECE CNCc1ccc(N2CCC[C@H](O)[C@@H]2C)c(Cl)c1 384910164 YILLFNPFYVWOHY-HZMBPMFUSA-N 268.788 2.409 10 10 CECE CC[C@H]1[C@@H](CO)CCN1c1c(F)cc(CNC)cc1F 385608021 DWNMGCFMHCXQLH-RISCZKNCSA-N 284.350 2.281 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](CO)[C@H]2C)c(F)c1 385617326 GKRGCMCJNLBBDI-FOGDFJRCSA-N 252.333 2.053 10 10 CECE C[C@H]1[C@@H](NCc2cccc(Cl)c2O)CCN1C 719550220 FVJOHFUJXFTHME-CABZTGNLSA-N 254.761 2.228 10 10 CECE CCC1(CNCc2ccc(O)c(O)c2)CCOCC1 389103674 OVBNETKNDQKHRM-UHFFFAOYSA-N 265.353 2.394 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[S@@](=O)[C@H](C)C1 2171973773 YQIOJEJMFUHHBG-ZUOKHONESA-N 292.448 2.204 10 10 CECE C[C@]12CN3C[C@](C)(CN(C1)C3c1ccc(O)c(O)c1)C2 2059107088 IPFSIPABXFHRSO-MQVJKMGUSA-N 274.364 2.144 10 10 CECE Cn1cc(COc2cc(F)cnc2N)c(C(F)(F)F)n1 2178737540 WHUGGRZMMFLBAM-UHFFFAOYSA-N 290.220 2.134 10 10 CECE CN(C)c1ccc([C@@H](N)c2ccc3cncn3c2)cc1 2176881288 HPTGQPKLYRQWOR-MRXNPFEDSA-N 266.348 2.448 10 10 CECE CCCNCc1ccc(N2C[C@H]3C[C@@H](O)[C@H]2C3)c(F)c1 2177159750 OTPQONSOHRRDIL-DAXOMENPSA-N 278.371 2.285 10 10 CECE C[C@@H](c1c(O)cccc1F)n1cc(C(=O)N(C)C)cn1 2069900369 VNJJNUXQVHECLT-VIFPVBQESA-N 277.299 2.039 10 10 CECE CCCNCc1ccc(N2CCN(C)[C@H]3C[C@@H]32)c(C)c1 2168364734 UYCBJBZDSPNSPU-IRXDYDNUSA-N 273.424 2.387 10 10 CECE C[C@@H](N[C@@H]1CCN(C2CCC2)C1)c1ccc(O)cc1O 2169572013 XHDDGJZUQXCSAX-VXGBXAGGSA-N 276.380 2.375 10 10 CECE Oc1cccc(F)c1CN1CC[C@]2(CCOC2)C1 1137833204 WTGMWRSBTVICAT-AWEZNQCLSA-N 251.301 2.144 10 10 CECE CO[C@@H]1CCC[C@H](NCc2ccc(O)cc2O)C1 1172917388 FZVLUVMTZQSHOB-WCQYABFASA-N 251.326 2.145 10 10 CECE CCN1CCc2cc([C@@]3(O)CCN[C@H]3C(C)C)ccc21 2188251741 HTXKGBPMERUPAE-IRXDYDNUSA-N 274.408 2.275 10 10 CECE CO[C@H](CN(C)c1ccc([N+](=O)[O-])c(CO)c1)C(C)C 2188444626 GUCHYRPMHUIKLT-CQSZACIVSA-N 282.340 2.194 10 10 CECE NCC1CC2(CCN2c2ccc3c(c2)OCCCO3)C1 2182209969 HIFXMPPXRIBKLW-UHFFFAOYSA-N 274.364 2.166 10 10 CECE C[C@H](NC1CN(CC(F)(F)F)C1)c1ccc(F)cc1O 2182328861 XSACFJZZZZANQU-QMMMGPOBSA-N 292.276 2.428 10 10 CECE CN(CCCC(F)(F)F)C(=O)c1cc(O)c(O)c(O)c1 2188874564 IGSXEKCIYKJUHU-UHFFFAOYSA-N 293.241 2.218 10 10 CECE Cc1cccc(O)c1CN1CC[C@H](C(F)(F)C(=O)O)C1 2184101532 PZOKYTZOLVRPPH-JTQLQIEISA-N 285.290 2.242 10 10 CECE CCNC1CCN(Cc2c(O)cccc2F)CC1 2042625913 HUPGJTQXBBHPTE-UHFFFAOYSA-N 252.333 2.105 10 10 CECE C[C@]1(CO)CC(F)(F)CN1c1ccc2c(c1)CC[C@@H]2N 2184739246 DOBHMPRFZOWBPG-UONOGXRCSA-N 282.334 2.229 10 10 CECE O[C@@H]1CCc2cc(N3CCCN4CCC[C@H]4C3)ccc21 2184729314 HVUIBYCIUCAJQY-DOTOQJQBSA-N 272.392 2.341 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H]4C[C@H](O)CC[C@@H]43)ccc21 2184738257 RGRNCLKCUMCARY-IRWJRLHMSA-N 273.376 2.406 10 10 CECE CN(C)c1ccc(CNCCCC[S@](C)=O)cc1 2047841610 OZSQYGGCZOZBPN-SFHVURJKSA-N 268.426 2.001 10 10 CECE CCOc1ccc(N2C[C@H](C)[C@@H](CO)C2)cc1F 2050275553 BMWHLXPAYGGDLS-WDEREUQCSA-N 253.317 2.289 10 10 CECE CC[C@@H](N)c1ccc(N2CCO[C@@H](CF)C2)cc1 2052004465 YGTAHJOPETWYFB-UONOGXRCSA-N 252.333 2.271 10 10 CECE CC[C@@H](N)CN(CC)[C@H](C)c1ccc(O)cc1O 2053095500 GPYZKIZWGUROSK-GHMZBOCLSA-N 252.358 2.218 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)C1(C(F)(F)F)CC1 2058824620 PJMZLNJJNOWIJA-ZCFIWIBFSA-N 266.223 2.072 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1ccc(C(=O)O)o1 2059052969 HQXDSXAPPZNQTM-QMMMGPOBSA-N 250.258 2.253 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@@]12CCOC[C@H]1C2 2194484732 BGGMZOBFVMIHGW-WBVHZDCISA-N 272.392 2.325 10 10 CECE CC(C)N(C)CCCOC(=O)CCc1ccc(N)cc1 2186345461 UYPODZNJESOTPV-UHFFFAOYSA-N 278.396 2.475 10 10 CECE CN(Cc1cnns1)c1ccc2c(c1)CC[C@@H]2N 2065081222 UGJAANNUGGMBRA-ZDUSSCGKSA-N 260.366 2.121 10 10 CECE C[C@@H](N)c1cc(F)c(N2C[C@H]3C[C@H]2CN(C)C3)c(F)c1 2194691247 QPNDCQOKIAKSQJ-SCVCMEIPSA-N 281.350 2.125 10 10 CECE CC(C)(C)NCc1ccc(N2CC([N+](=O)[O-])C2)c(F)c1 2191527313 XLPDBWPFKYPJPE-UHFFFAOYSA-N 281.331 2.179 10 10 CECE COc1cccc(O)c1CNC[C@H]1CC(C)(C)O1 2069152291 AEUIDUYGFKLVJD-SNVBAGLBSA-N 251.326 2.058 10 10 CECE C[C@H](N)c1cc(F)c(N2CCn3ccnc3C2)c(F)c1 2194702469 AVSYSEKAERENNA-VIFPVBQESA-N 278.306 2.201 10 10 CECE CCN1[C@H](C)CN(c2ccc(CCN)c(C)c2)C[C@H]1C 2186935620 NSANSHRSCIYTJJ-HUUCEWRRSA-N 275.440 2.415 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H](O)[C@H]2C2CC2)c(F)c1 2194709965 PFLMQVVCKZWBBS-NFMODRRSSA-N 282.334 2.334 10 10 CECE 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10 CECE CCCN1CC[C@@](N)(c2ccc3c(c2)CCCN3C)C1 2163100338 QEMIMKSJMUCBHP-KRWDZBQOSA-N 273.424 2.339 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@]1(O)C[C@@H](C)[C@@H]1C 2163141712 XJSMHVRHUPIBSS-AWBCAMRRSA-N 274.408 2.346 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H](C)[C@H](CCN)C2)c1 723886446 AGKFFMPCPJXEIS-FRRDWIJNSA-N 278.396 2.379 10 10 CECE CCNCCCCc1nc(-c2ccc(O)c(O)c2)no1 725071559 ABOPICQVZDRXTP-UHFFFAOYSA-N 277.324 2.080 10 10 CECE CN(C)c1ccc(/C=C\CN2CCC3(C2)OCCO3)cc1 835029345 WTWLOUDTWKBIQP-ARJAWSKDSA-N 288.391 2.215 10 10 CECE CN(C)c1ccc(/C=C/CNCCN2CCC2)cc1 835041058 JJRKTNOSVHFFOM-HWKANZROSA-N 259.397 2.061 10 10 CECE Cc1cc(O)c(CNCCN2CCC2)c(Cl)c1 840906762 IDFNKWJTBLZAGG-UHFFFAOYSA-N 254.761 2.149 10 10 CECE Cc1cc(O)c(CN[C@@H](C)CN2CCCC2=O)c(Cl)c1 840882974 XNZQAKBFRSQUOI-NSHDSACASA-N 296.798 2.455 10 10 CECE CC[C@@](C)(CO)C(=O)NCc1ccc(N(C)C)cc1C 847500112 CTJQSYJBOJOQSU-INIZCTEOSA-N 278.396 2.086 10 10 CECE O=C(NCc1c(O)cccc1F)C1(CCF)CC1 928705022 CEFOJEKCQHEIJP-UHFFFAOYSA-N 255.264 2.287 10 10 CECE CC1(C)CCC[C@H](OC(=O)c2cccc(O)c2O)C1=O 840458322 ANYBMJZFJWVIGF-NSHDSACASA-N 278.304 2.402 10 10 CECE CN(C)c1ccnc(CNCc2cc(F)cc(F)c2O)c1 922477552 HMSAFNKYZYITER-UHFFFAOYSA-N 293.317 2.421 10 10 CECE O=C(NCc1c(O)cccc1F)[C@]12CCC[C@H]1OCC2 928709933 OCFKQXFRZADDFG-HIFRSBDPSA-N 279.311 2.107 10 10 CECE CC[C@@H](COc1ccc(N(C)C)c(C(=O)OC)c1)OC 865395514 TUFWXRJFNVYULN-NSHDSACASA-N 281.352 2.343 10 10 CECE CCOC(=O)C1=CC[C@H](NCc2ccc3c(c2)CCO3)C1 862487103 MAVLDLRAWQBBAZ-HNNXBMFYSA-N 287.359 2.363 10 10 CECE O=C(CSC1CC1)NCc1ccc2cccnc2c1O 862026333 KQPQIAKZDZEYNO-UHFFFAOYSA-N 288.372 2.452 10 10 CECE O=C(NCC[C@@H]1CCCS1)NCc1ccccc1O 868974158 DBYOXPGXDLPBTM-LBPRGKRZSA-N 280.393 2.477 10 10 CECE CCO[C@H](C(=O)NCc1ccc(O)c(O)c1)C1CCCC1 866768824 FYJFDRTWVTXAPW-HNNXBMFYSA-N 293.363 2.309 10 10 CECE C[C@@H](OCc1ccncc1)C(=O)N1Cc2cccc(O)c2C1 871205685 XEBKXIGPJZIWMS-GFCCVEGCSA-N 298.342 2.235 10 10 CECE CC(C)(O)C[C@H](O)CNc1ccccc1OCC1CC1 872211795 RLJDNFVHWXZUDM-ZDUSSCGKSA-N 279.380 2.409 10 10 CECE COc1cc(CN2CCO[C@H](C3CC3)C2)c(O)cc1C 776769204 TUJXOYUDUWEHDE-INIZCTEOSA-N 277.364 2.320 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1CCNCC1(F)F 1877537134 DPACLDPALRWPOM-LBPRGKRZSA-N 270.323 2.069 10 10 CECE COC[C@H](NCc1ccc2c(c1)CCO2)C1CCOCC1 783239562 YWOWWLGIEYULRW-INIZCTEOSA-N 291.391 2.153 10 10 CECE COc1cc(C)cc(CNC[C@H]2C[C@@H](OC)C2)c1O 895414924 QBSXGXZXQHFHLE-BJHJDKERSA-N 265.353 2.224 10 10 CECE Cc1ccc(/C=C\C(=O)N2C[C@H](C)Cn3nccc32)cn1 893887683 UOBULOVTCFORSI-FJOGCWAESA-N 282.347 2.283 10 10 CECE Oc1ccc(CNCC23CCC(CC2)OC3)c(O)c1 1878074743 JASIZKVKNKHRBX-UHFFFAOYSA-N 263.337 2.147 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@@H](O)C[C@H]2C)c(F)c1 1880923076 DJDMRSSDPFJNJR-WCABBAIRSA-N 270.323 2.334 10 10 CECE COc1ccc(CNC(=O)C2[C@H]3CCCC[C@H]23)c(O)c1 794381699 RNYCHUNDSZYZOO-STQMWFEESA-N 275.348 2.453 10 10 CECE CCCCOC(=O)[C@@H](C)N1CCOc2cc(CN)ccc21 74338287 LNUVXTBOULZFNA-GFCCVEGCSA-N 292.379 2.076 10 10 CECE Oc1ccc2c(c1)[C@@H](c1cccc(F)c1O)NCC2 83595825 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CC[C@]1(C)CCN(C[C@@H](O)COc2ccc(N)cc2)C1 399455323 ZZKXAUXJFUCCMH-GDBMZVCRSA-N 278.396 2.131 10 10 CECE CN(C)C[C@H]1CCCN(Cc2ccc(F)c(F)c2O)C1 703529948 KZAZYQUGEAPKMU-LLVKDONJSA-N 284.350 2.444 10 10 CECE COC1CCC([C@@H](NN)c2ccc(N(C)C)cc2)CC1 686368369 WJTWASDRGZFKMJ-BCLQGDPASA-N 277.412 2.462 10 10 CECE Nc1ccc(COCCn2cc(Br)cn2)cc1 692413663 WIXZVCNRUSZFIY-UHFFFAOYSA-N 296.168 2.445 10 10 CECE COc1ccc(CNCc2cnc(C)cn2)cc1C 61320648 UCBXWDBQAZCVIU-UHFFFAOYSA-N 257.337 2.392 10 10 CECE C[C@H]1COCC[C@H]1C(=O)Nc1c(Cl)ccc2nonc12 1323482544 JKCDCSJTVUABAJ-JGVFFNPUSA-N 295.726 2.487 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@H]1CCC[C@H](F)C1 1326596018 GZKPQZJBRQWYHI-QWRGUYRKSA-N 267.300 2.242 10 10 CECE CNCc1ccc(N2CCCN3CCC[C@@H]3C2)cc1 62941315 BFKSCRDGOCTVGH-MRXNPFEDSA-N 259.397 2.081 10 10 CECE CC(C)[C@@H]1COC[C@H]1N(C)Cc1cc(N)ccc1O 688165673 XZFOIRLDIWXUDD-UONOGXRCSA-N 264.369 2.077 10 10 CECE Cc1cc(N2CC[C@H](CN(C)C)C2)ccc1C[C@@H](C)N 688525487 DVHGSPPQSFWUMC-HUUCEWRRSA-N 275.440 2.273 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3COC[C@H]3C2)c(F)c1 690369802 ALVJMJROYGCLEP-KGYLQXTDSA-N 265.328 2.352 10 10 CECE CC[C@H]1CCCCC[C@]1(NCCCN=[N+]=[N-])C(N)=O 691142749 VXPJHIIERWQBDL-WCQYABFASA-N 267.377 2.491 10 10 CECE O=C1Nc2cc(N3CC[C@@H]4C[C@H]4C3)c(Cl)cc2[C@H]1O 699173990 FAZUIGAYMXXPJC-BFHDXFOESA-N 278.739 2.172 10 10 CECE CC[C@@H](C)CN(CC)C[C@H](O)COc1ccc(N)cc1 93249525 NHKXDDAHJRZSOG-HIFRSBDPSA-N 280.412 2.377 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)C[C@@H]1CCCCO1 95030735 BEDWTBGDFNJHME-AWEZNQCLSA-N 262.353 2.186 10 10 CECE CN(C)c1ccc([C@H](CN)N2CCC[C@H]2CF)cc1 2115162858 HSWDFASIQOLNHD-GJZGRUSLSA-N 265.376 2.186 10 10 CECE CCCNCc1ccc(N2CC[S@@](=O)C[C@H]2C)cc1 2115326885 WAKLEQKQUFPTTI-BFUOFWGJSA-N 280.437 2.143 10 10 CECE CCCOc1cc(N2CC[S@@](=O)[C@H](C)C2)ccc1N 2115320323 NAVKTWDBZIHVJR-NSPYISDASA-N 282.409 2.015 10 10 CECE CCCN[C@H](C)c1ccc(N2CC(F)(CO)C2)cc1 2116283342 VYYMFBPDMHXYGV-GFCCVEGCSA-N 266.360 2.268 10 10 CECE C[C@H](N)[C@@H]1C[C@H]1[C@@H](O)c1ccc(N2CCCC2)cc1 2118314111 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COc1ccc(CNCc2ccc(OC)c(C)c2)nn1 1913557851 QCPIBGLGYJJSHG-UHFFFAOYSA-N 273.336 2.092 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCCC1(F)F 1912198011 BGDPRSSPFSUQKJ-VIFPVBQESA-N 262.260 2.007 10 10 CECE [N-]=[N+]=N[C@H]1CCN(Cc2ccc3c(c2)OCCO3)C1 1912144657 WRVNNORPADPADF-NSHDSACASA-N 260.297 2.342 10 10 CECE CCOCCC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912159109 CUPFKCBCYOPAQJ-NSHDSACASA-N 254.334 2.352 10 10 CECE COc1ccc(CN(C)CCN=[N+]=[N-])cc1[N+](=O)[O-] 1912187716 LQJQUCQHAIVGEN-UHFFFAOYSA-N 265.273 2.346 10 10 CECE Cc1noc(C)c1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1912186239 BFYSLZPYHTVYNO-JTQLQIEISA-N 263.301 2.454 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(Cc2ccccc2CC(=O)O)C1 1912168092 RPSKXGPTSYRPQL-NSHDSACASA-N 274.324 2.446 10 10 CECE CC(C)(C)c1noc(CN2CC[C@@H](N=[N+]=[N-])C2)n1 1912157082 WLNIYWQLXNIXKG-MRVPVSSYSA-N 250.306 2.252 10 10 CECE CN(CC1(O)CCC1)c1ccc(CNC2CC2)cc1F 1914587055 AOIOUEFIVOYCHF-UHFFFAOYSA-N 278.371 2.429 10 10 CECE CN(C)CC1CC(NCc2ccc(Cl)cc2O)C1 1913672974 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CECE CCCNC(=O)[C@H](C)N(C)[C@@H](C)c1ccccc1O 1877539431 VNIBARLHIOQOBI-RYUDHWBXSA-N 264.369 2.300 10 10 CECE C[C@H]1C[C@@H](COC(=O)c2cc(O)cs2)CCO1 783609152 WGBDYQUZFMPUJF-IUCAKERBSA-N 256.323 2.426 10 10 CECE CCc1cccc(CN[C@H](COC)[C@@H]2CCCOC2)c1O 895859400 QYNYMGOAYOWTLW-HZPDHXFCSA-N 293.407 2.486 10 10 CECE CC(C)N1CCC(N(C)C(=O)c2cccc(O)c2O)CC1 1136056626 VLGBOKPSZDIONH-UHFFFAOYSA-N 292.379 2.043 10 10 CECE CO[C@@H]1CN(c2c(F)cc([C@H](C)O)cc2F)C[C@@H]1F 1880477870 AKTLYOGXECHYFZ-CQFDHEJISA-N 275.270 2.191 10 10 CECE COc1cc(Cl)cc(CN2CC[C@@H]3COC[C@H]32)c1O 1899147633 IDTQWZRDLGXQDX-BXKDBHETSA-N 283.755 2.275 10 10 CECE CCN[C@H](C)c1ccc(N2[C@H]3COC[C@H]2C3)c(F)c1 1899636580 YGENLAWKLGRPOZ-RAIGVLPGSA-N 264.344 2.474 10 10 CECE CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[C@@H]2CN1CCN=[N+]=[N-] 1883788788 YDEJNVHYPXKYDE-OUAUKWLOSA-N 281.360 2.142 10 10 CECE CCN1CC[C@H](CNCc2cc(Cl)ccc2O)C1 37644093 RXHJCBHQXBBPOR-LLVKDONJSA-N 268.788 2.477 10 10 CECE Nc1ccc(Cn2cnc3sccc3c2=O)cc1 19273428 HUQZJBHCDYPDDU-UHFFFAOYSA-N 257.318 2.089 10 10 CECE Oc1cc(O)cc(Oc2ccc(O)c(O)c2O)c1 82312350 RVAFSCJBWPAEKA-UHFFFAOYSA-N 250.206 2.007 10 10 CECE C[C@@H](CCNC(=O)OC(C)(C)C)CC(=O)NCCN=[N+]=[N-] 1885557621 RQSQWYHMTQAECI-JTQLQIEISA-N 299.375 2.354 10 10 CECE CCOc1ccc(O)c([C@]2(CC)CO[C@H](C)CN2)c1 83482238 WTECELDVWUOVGU-ABAIWWIYSA-N 265.353 2.405 10 10 CECE CC[C@H]1CN([C@@H](C)C(=O)O)c2cc(OC)c(OC)cc2N1 76929921 YRMFQMNODMZJFC-UWVGGRQHSA-N 294.351 2.187 10 10 CECE CCOC(=O)CCCN[C@H](C)c1cc(O)ccc1O 81549957 UAGFGSQMHPRSDQ-SNVBAGLBSA-N 267.325 2.092 10 10 CECE O=C(NCc1cc(O)ccc1O)c1cc(F)c(O)c(F)c1 1176755461 PYFRUOORMDYKLZ-UHFFFAOYSA-N 295.241 2.012 10 10 CECE COc1ccc(O)c(CN2C[C@H](OC)CC[C@H]2C)c1 687219110 KPDJFIKEGWSZAL-BXUZGUMPSA-N 265.353 2.400 10 10 CECE CN1CCCc2cc([C@H](CN)N3CC[C@H]4C[C@H]43)ccc21 706976023 XDKWLTXPBOJMCR-UAGQMJEPSA-N 271.408 2.163 10 10 CECE COc1cc(N)c(N(C)[C@H]2CCC[C@@H]2OC)cc1OC 687425280 MLLRJVOUOILBIQ-AAEUAGOBSA-N 280.368 2.290 10 10 CECE CC[C@]1(C)COCCN1c1cc(OC)c(OC)cc1N 707248134 DOOZLXZELGDMAD-OAHLLOKOSA-N 280.368 2.291 10 10 CECE COc1cc(N)c(N2CCOC(C)(C)[C@@H]2C)cc1OC 707301509 LMFVYSZEOFEFHU-JTQLQIEISA-N 280.368 2.290 10 10 CECE Nc1ccc(NC(=O)CN2C[C@H]3CCCCC[C@H]32)cc1 707695808 KDEPRIHNUISMCA-IUODEOHRSA-N 273.380 2.472 10 10 CECE COc1ccc(CN2CCO[C@@H](C(C)C)C2)c(O)c1 709024456 BTRXAESUYRXHQL-OAHLLOKOSA-N 265.353 2.258 10 10 CECE CCN[C@@H](c1ccccc1O)[C@](O)(C(F)F)C1CC1 1893276388 DDBXMFUWOSVSNK-JSGCOSHPSA-N 271.307 2.449 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C1CCS(=O)(=O)CC1 689823636 AFARPUGFNKJNTO-UHFFFAOYSA-N 296.436 2.056 10 10 CECE CCNCc1ccc(OC)c(CN2C[C@H](F)[C@@H](F)C2)c1 714673784 KTZKCWPCWYQTHD-KBPBESRZSA-N 284.350 2.297 10 10 CECE C[C@@H](N[C@H]1CCCCC12OCCO2)c1cc(O)ccc1O 715671743 DGGNPNPHDLXNAB-ABAIWWIYSA-N 293.363 2.434 10 10 CECE CCN(Cc1nccn1CC)c1ccc(CN)cc1 692470925 DOCSFDLRWYVJSH-UHFFFAOYSA-N 258.369 2.388 10 10 CECE Nc1ccc(N2C(=O)C[C@H](C3CCCC3)NC2=O)cc1 718781568 ZHRWACHJERWLGG-CYBMUJFWSA-N 273.336 2.274 10 10 CECE Cc1cccc(S(=O)(=O)N2CCC[C@@H]2CN=[N+]=[N-])c1 692822393 JGDIYLDYNSRMNP-LLVKDONJSA-N 280.353 2.458 10 10 CECE CC(C)CNCc1ccc(N2CCS[C@@H](CO)C2)cc1 719990248 AQYOMTYSCPIXBF-MRXNPFEDSA-N 294.464 2.346 10 10 CECE Oc1ccc(CNC[C@@H]2CCC[C@H]3C[C@H]32)c(O)c1O 694375565 PHALPCCMVQXTAK-JBLDHEPKSA-N 263.337 2.329 10 10 CECE COC[C@@H](Cn1c(C)c(C)c2cc(CN)ccc21)OC 694701685 ZFIJZFOWMSIGPV-CQSZACIVSA-N 276.380 2.378 10 10 CECE CCC1(S(=O)(=O)N2CCC[C@H](N=[N+]=[N-])C2)CC1 696329130 POBTXXFUQHUMAQ-VIFPVBQESA-N 258.347 2.034 10 10 CECE CC[C@@H]1COC[C@@H]1N[C@@H](C)c1cc(OC)ccc1O 699544164 FSSQPWLYCFYFDK-WDMOLILDSA-N 265.353 2.476 10 10 CECE CN(c1ccc(N)cc1)[C@H]1CCC[C@H](S(C)(=O)=O)C1 94637548 UFTLXAWHQLEOME-KBPBESRZSA-N 282.409 2.061 10 10 CECE CC(=O)C(=O)[C@H](O)c1ccc(NC(=O)OC(C)(C)C)cc1 1919279363 SCWMIKZODKYNBW-CYBMUJFWSA-N 293.319 2.225 10 10 CECE Nc1cc2c(cc1N1CC[C@H]1C(F)(F)F)OCCO2 1916181968 HGFIDEAEXWAIPJ-NSHDSACASA-N 274.242 2.181 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)c(F)c1 2115465717 UGCBBOQJWMARFC-NYMYIZQJSA-N 264.344 2.066 10 10 CECE CSC1=NSC2=NC(=O)/C(=C/c3ccco3)C(=N)N12 214062 PUIAWPMQLXHGQM-PMEZZHSESA-N 292.345 2.219 10 10 CECE Cc1sc(Cl)nc1C(=O)NCc1cccc(O)c1O 1455318037 YQHLPNBADNAAPQ-UHFFFAOYSA-N 298.751 2.446 10 10 CECE O=C1Nc2cc(N3CCC[C@@H]3CF)c(Cl)cc2[C@@H]1O 2115228266 DHKKVQHLNSZSCP-KRTXAFLBSA-N 284.718 2.264 10 10 CECE C[C@@H]1CC[C@@H](C)N(C(=O)Cc2ccc(O)c(O)c2)C1 1628704378 WNKQSLFXSWMCEP-GHMZBOCLSA-N 263.337 2.287 10 10 CECE Cc1nnc(N(C)Cc2ccccc2O)n1[C@@H]1C[C@H]1CF 1726356938 HJOVNKCMQWSTQX-QWHCGFSZSA-N 290.342 2.459 10 10 CECE COC(=O)[C@H]1CC[C@H](CN2CCC[C@@H]2CN=[N+]=[N-])C1 2125325440 OJRZSCSSPIHLQP-SDDRHHMPSA-N 266.345 2.350 10 10 CECE CCN[C@H](C)c1ccc(N2CCNC(=O)[C@H]2C)cc1Cl 250268901 GEZVYQHTCVXPAX-GHMZBOCLSA-N 295.814 2.335 10 10 CECE COC(=O)CCCN1CCc2cc(OC)c(OC)cc21 1970279343 AYGDPSLMVRGNMK-UHFFFAOYSA-N 279.336 2.020 10 10 CECE Cc1noc(CNCc2cccc(Cl)c2O)n1 158728082 QWDCROONMRPDAK-UHFFFAOYSA-N 253.689 2.027 10 10 CECE COc1cccc(N)c1C(=O)N(C)Cc1ccccc1O 157885332 KHMZACZKAALAKR-UHFFFAOYSA-N 286.331 2.255 10 10 CECE C[C@@H]1CN(c2ccc(/C=C\C(=O)O)cc2F)CCO1 207659843 IULLDAADLKRLCP-TZGMSPROSA-N 265.284 2.149 10 10 CECE CCOc1ccc(N(C)CC2(C(=O)OC)CC2)cc1 258891438 DCWKCJXXWUQSRE-UHFFFAOYSA-N 263.337 2.475 10 10 CECE C[C@]1(CO)CCCN1c1ccc2c(c1)CCC[C@H]2N 2128269158 PAWYHQQIULJZFK-HZPDHXFCSA-N 260.381 2.374 10 10 CECE O=C(c1cccc(O)c1O)N1CC[C@H]2CCC[C@@H]2C1 2128299794 FSSQJWUBACPADQ-GHMZBOCLSA-N 261.321 2.360 10 10 CECE CN[C@H]1CCc2cc(N3CCC[C@H](CO)C3)ccc21 2128314421 GHCUEYKMRWBUNL-LRDDRELGSA-N 260.381 2.102 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1C[C@H]1NC(=O)OC(C)(C)C 1887718531 YXEMCVQVWPIPSX-NXEZZACHSA-N 297.359 2.058 10 10 CECE CCN(C)[C@H]1CCN(Cc2cc(F)ccc2O)C1 1659139687 NEJJPEYMCFEPIE-ZDUSSCGKSA-N 252.333 2.057 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](C3(O)CC3)C2)c(F)c1 2130510327 JLUSKIBJGKVELT-JQWIXIFHSA-N 264.344 2.197 10 10 CECE CC[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)CCO1 817415549 UXMPSTKBCWZIKS-VXGBXAGGSA-N 279.336 2.168 10 10 CECE CCn1cnc(CN[C@H](C)c2cc(OC)ccc2O)c1 902614997 WXURHPWIAWNRKH-LLVKDONJSA-N 275.352 2.468 10 10 CECE CN1CCCc2cc(CN3CCC[C@](C)(N)C3)ccc21 1204937814 GWWCMOKHNWEHNH-KRWDZBQOSA-N 273.424 2.382 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCOC[C@H]1F 2130263003 FOZSVAMTRCDQNX-CABCVRRESA-N 265.328 2.233 10 10 CECE C[C@H](NC(=O)[C@H]1CCCOCC1)c1ccccc1O 827968963 DAHURGOVCGGTPV-RYUDHWBXSA-N 263.337 2.386 10 10 CECE C[C@H](N)c1ccc(N(C)C2COCCOC2)c(Cl)c1 2131498922 STRQILCNCKKJPT-JTQLQIEISA-N 284.787 2.211 10 10 CECE C[C@]1(CCO)CCN(c2ccc3c(c2)CC[C@H]3N)C1 2131893079 BDIUVBFPYBPHSJ-HZPDHXFCSA-N 260.381 2.231 10 10 CECE C[C@H]1CN(Cc2ccc(F)cc2O)C[C@H]1CC(=O)O 2139771150 VBFKSZWDDICNLU-GXSJLCMTSA-N 267.300 2.074 10 10 CECE CCCOCCOC(=O)NCc1cccc(C)c1O 2139763435 YZYFBRZAFBAARO-UHFFFAOYSA-N 267.325 2.353 10 10 CECE Cc1csc2nc(CN(C)CCCN=[N+]=[N-])cc(=O)n12 1912199191 PKWXKHSNLIAOMS-UHFFFAOYSA-N 292.368 2.197 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@]23CCC[C@H]2OCC3)CC1 1912159422 HRNNDOHCZJTFLV-DGCLKSJQSA-N 264.329 2.247 10 10 CECE Cc1ccc(S(=O)(=O)N2CCC[C@H](CN=[N+]=[N-])C2)o1 1912187905 MVAXQFANIINVLC-SNVBAGLBSA-N 284.341 2.299 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(S(=O)(=O)c2cccc(F)c2)C1 1912172709 GXZAJIHJEUADGR-SECBINFHSA-N 284.316 2.147 10 10 CECE COc1cc(C)ncc1C(=O)N(C)CCCN=[N+]=[N-] 1912201580 WLEGFPHRVRNVDS-UHFFFAOYSA-N 263.301 2.171 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N(C)CC1CNC1 1914345917 LYCVOCHZQWVFBI-AAEUAGOBSA-N 260.381 2.400 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(F)c2F)C1(C)C 1914306837 WECYFYBJEROMNT-NSHDSACASA-N 270.323 2.427 10 10 CECE CN(C)[C@@H]1CCC[C@@H]1CNCc1ccc(F)cc1O 2139886787 FPOUZHKCMZWWJD-BXUZGUMPSA-N 266.360 2.351 10 10 CECE CO[C@H]1CCN(c2ccc(CO)c(Cl)c2)C[C@@H]1OC 2134838366 UEIISZKOKDCXQD-KBPBESRZSA-N 285.771 2.072 10 10 CECE CN(C)c1ccc([C@@H]2N[C@H](C(F)F)CCO2)cc1 1918568430 ORUJGDVNSISNLI-WCQYABFASA-N 256.296 2.395 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@]3(CCC[C@@H]3O)C2)cc1O 1918889158 UXCBQMSTBBOAGL-UVBJJODRSA-N 277.364 2.187 10 10 CECE C[C@@H](CNCc1ccc(O)cc1O)NC(=O)OC(C)(C)C 227677628 LXEGYHMGZQBYPF-JTQLQIEISA-N 296.367 2.101 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H](N)C=C3CCC3)ccc21 2135937311 VTKCXEJBMBBAEX-GOEBONIOSA-N 258.365 2.150 10 10 CECE CC(C)CNC(=O)[C@H](C)N[C@@H](C)c1cc(F)ccc1O 228977593 NJCVLPLSJFWTJB-QWRGUYRKSA-N 282.359 2.343 10 10 CECE CCc1conc1CN[C@H](C)c1c(O)cccc1O 2136051603 GGPHNYKHOZYTEO-SECBINFHSA-N 262.309 2.499 10 10 CECE COc1ccc(O)c([C@H](C)NCc2ncccc2O)c1 1969271635 OPVPEMYYBZGYET-JTQLQIEISA-N 274.320 2.352 10 10 CECE Cc1ccc(O)c(CNC2(CO)CC3(CCC3)C2)c1 1967900727 GDRFBMXVGNPAEE-UHFFFAOYSA-N 261.365 2.485 10 10 CECE C[C@H]1CCC(F)(F)CN1c1ccc2c(c1)NC(=O)[C@H]2O 2146002468 OATMRVRVCMTQGF-UFBFGSQYSA-N 282.290 2.296 10 10 CECE Oc1cc(Cl)ccc1CN1CCOC[C@@H]1[C@@H]1CCOC1 2146316262 LTPDBURMRCYFNY-TZMCWYRMSA-N 297.782 2.283 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C(=O)c1cccs1 237107219 FWKMJQBZOKASFL-UHFFFAOYSA-N 289.360 2.041 10 10 CECE Cc1ccc(Sc2ncc(C[C@@H](C)N)s2)nn1 1949621419 XIQDLRNJBYAKHG-SSDOTTSWSA-N 266.395 2.282 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H](O)C(F)(F)F)CC1 1949762976 VQWLRWIQZPMLPW-HTQZYQBOSA-N 252.240 2.074 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](C)[C@H]2C(N)=O)cc1 2146446590 DLIPAPFOKZOHKU-JMSVASOKSA-N 275.396 2.057 10 10 CECE Oc1ccccc1CN1CCOC[C@H]1C1CCOCC1 2148834392 KKQMPZJIBVRNSN-HNNXBMFYSA-N 277.364 2.020 10 10 CECE C[C@@H]1CC[C@@H](C)N(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)C1 131403841 HZWGBKMTLBDADE-UEKVPHQBSA-N 273.380 2.288 10 10 CECE CN1[C@H]2CC[C@H]1CN(c1ccc(CN)cc1Cl)CC2 252636453 GWVRFAFPHUUIGC-STQMWFEESA-N 279.815 2.472 10 10 CECE CCC1(CN(C)c2cc3c(cc2N)OCC(=O)N3)CC1 2146789853 PRRZLOHRLAMRKH-UHFFFAOYSA-N 275.352 2.226 10 10 CECE COC[C@@H](NCc1ccc(C)cc1O)C(F)(F)F 1973151910 PZCYLZLKKKAITP-LLVKDONJSA-N 263.259 2.368 10 10 CECE Oc1ccc(Cl)cc1CNC[C@@H]1C[C@H]2OCC[C@H]2O1 1974127521 JDKFEITVJACEJS-IACUBPJLSA-N 283.755 2.082 10 10 CECE Cc1cc(Sc2ncc([C@H](C)N)s2)n(C)n1 1976519490 FFFNXJOFVFZBMU-ZETCQYMHSA-N 254.384 2.356 10 10 CECE CN1CCN(c2ccc([C@H]3CCCN3)cc2F)CC1 258488300 QVLROGCAVMODQH-CQSZACIVSA-N 263.360 2.002 10 10 CECE Cc1cc2c(O)c([C@@H]3C[C@@H](CN)CN3C)ccc2[nH]1 258461507 SEBWPOIVDFYVNF-HZMBPMFUSA-N 259.353 2.133 10 10 CECE CN(C)C(=O)[C@@H]1CCCCN1Cc1cc(Cl)ccc1O 2143697547 KTTWOTBUBBOKRN-ZDUSSCGKSA-N 296.798 2.488 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(OC)c(C)cc1O 260127453 KEHWXVSQIFIYHN-LLVKDONJSA-N 267.325 2.052 10 10 CECE C[C@H]1[C@H](O)CN1c1ccc([C@@H](C)N)cc1Br 1985746222 ZNSMFVJOOANGMR-RGNHYFCHSA-N 285.185 2.038 10 10 CECE CNCc1ccc(N(C)C[C@@H]2[C@H]3CCOC[C@H]32)c(C)c1 2150188188 OSXWURSYHCPWTL-BZUAXINKSA-N 274.408 2.433 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3COCC[C@@H]32)cc1O 2145021249 RUALCUPMNVBPSR-XUJVJEKNSA-N 276.380 2.288 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@H](O)C[C@H]2C)cc1O 2149518493 HPWXRWPANQCDDH-FUTJPDQTSA-N 278.396 2.268 10 10 CECE COC[C@H](C)N(C)c1cc(Cl)c(CN)cc1F 2008204665 FIIPAMLCLHBYKS-QMMMGPOBSA-N 260.740 2.409 10 10 CECE Nc1ccc(NC(=O)N2CCC[C@H]3OCC[C@H]3C2)cc1 2151894824 MLOKPOQUCITRBG-SMDDNHRTSA-N 275.352 2.302 10 10 CECE CCOCCSCC(=O)c1ccc(O)c(O)c1 2012434662 RXGYILWZDLWBDK-UHFFFAOYSA-N 256.323 2.050 10 10 CECE COc1ccc(CN2CC[C@H](CC(=O)O)[C@H]2C)c(O)c1 2153496904 XQIUCRKJOSKPGC-GHMZBOCLSA-N 279.336 2.086 10 10 CECE Oc1cccc(Br)c1CN[C@]12CCOC[C@H]1C2 2018540007 WGKRZRBKSHUQKZ-RNCFNFMXSA-N 298.180 2.423 10 10 CECE CCNCc1ccc(OC)c(CN2CCO[C@@H](C)C2)c1 50124293 IXSLGLLVSBNJKT-ZDUSSCGKSA-N 278.396 2.025 10 10 CECE Cn1cc(CN(Cc2ccc(N)cc2)C2CC2)cn1 50540180 NVWPNQZFMYYGMZ-UHFFFAOYSA-N 256.353 2.167 10 10 CECE CN[C@](CO)(CSc1nccs1)C1CCCC1 2026589530 VYSAODLTTIVXFL-GFCCVEGCSA-N 272.439 2.376 10 10 CECE Oc1c(F)cccc1CN1CC[C@H]2COCC[C@@H]21 2028342946 SUIWVALHIZGAHP-AAEUAGOBSA-N 251.301 2.142 10 10 CECE CC[C@H](CN(C)C)N[C@H](C)c1c(O)cccc1O 2029859885 FQCYGJGBOYHDSB-GHMZBOCLSA-N 252.358 2.089 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CC23CCOCC3)CC1 2155559955 GHDSVFJPMYXBBH-NEPJUHHUSA-N 278.356 2.495 10 10 CECE CCCCn1nnnc1CN1CCC[C@H](N=[N+]=[N-])CC1 2155560458 KJTROLHKTJNPFW-NSHDSACASA-N 278.364 2.138 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC[C@@H]2CN(C)C)c1 61645750 UXSWOZRGGUZYDV-OAHLLOKOSA-N 276.380 2.121 10 10 CECE Cc1cc(N2CC[C@H](O)C2)ccc1CNCC(C)C 62738272 MERSASHTOPLQCM-INIZCTEOSA-N 262.397 2.312 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@@H]3OCCC[C@@H]32)cc1 186945221 JKTBDALNCIHXEQ-OAGGEKHMSA-N 260.381 2.410 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)CC2CCC2)CC1 2038005988 ZNDGTIVBVLEWME-NSHDSACASA-N 272.374 2.281 10 10 CECE CNC(=O)[C@]1(C)CCN([C@H](C)c2cc(F)ccc2O)C1 300713633 VNSJDQGNNYYORD-MEBBXXQBSA-N 280.343 2.050 10 10 CECE Oc1ccc(CN[C@H]2CC[C@]3(C2)CC3(F)F)c(O)c1O 2156164868 BQIRGNCBXZYSER-ZANVPECISA-N 285.290 2.471 10 10 CECE C[C@@H]1C[C@@H](CNCc2cc(F)cc(F)c2O)CO1 2040309392 GHDCHTOAXLPGHQ-BDAKNGLRSA-N 257.280 2.185 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)C[C@H](OC)C1(C)C 2156421780 WYFJFSCIEFOZLE-SQWLQELKSA-N 279.380 2.219 10 10 CECE CCCn1nncc1CN[C@@H]1CCc2cccc(O)c21 2156474519 PBAOKCWYSFDCAQ-CYBMUJFWSA-N 272.352 2.171 10 10 CECE Cc1ccc(CNC(=O)Nc2ccc(N)cc2)nc1 400915372 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Nc1ccc(NC(=O)NC[C@]23CCC[C@@H]2OCC3)cc1 687491166 LQIOZVWTLQUZMF-DZGCQCFKSA-N 275.352 2.350 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CC3(C)CC3)ccc21 710368342 PUAOKZNIOKNULA-ZDUSSCGKSA-N 259.353 2.136 10 10 CECE Cc1cc(N2CCN(C)CC2)ccc1CNCC(C)C 62734217 BFWQJTIRBJPYFM-UHFFFAOYSA-N 275.440 2.492 10 10 CECE C[C@H]1CCCN(c2ccc([C@@H](C)O)cc2F)[C@H]1CO 688668491 PYQCATRJXIOWDX-RWSFTLGLSA-N 267.344 2.476 10 10 CECE COc1ccc(CNCCC2(C)OCCO2)cc1C 716054476 PIKIPDSFUMSOLP-UHFFFAOYSA-N 265.353 2.246 10 10 CECE Oc1cccc2c1[C@H](NCC[C@H](O)C(F)(F)F)CC2 717410416 ZQYYEKBLEGLISC-KOLCDFICSA-N 275.270 2.282 10 10 CECE CO[C@H]1CCC[C@H](NCc2ccc(O)c(O)c2O)CC1 718283870 GBRGKYSBYHYBIH-RYUDHWBXSA-N 281.352 2.241 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1CN(C)C(C)(C)C1 694098022 JFKDINGDXXDWEE-CYBMUJFWSA-N 276.384 2.215 10 10 CECE COc1ccc(CNC[C@@H]2CCCC[C@@H]2O)c(O)c1 85969860 SJKAYFACQOXURS-FZMZJTMJSA-N 265.353 2.042 10 10 CECE C[C@H](NC(=O)CCC(C)(C)N)c1ccccc1O 877255477 DVEKSVSQHCLIMB-JTQLQIEISA-N 250.342 2.087 10 10 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CN(C[C@H]1CC1(C)C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 1915581241 PPIXJHFTTWBQPR-QMTHXVAHSA-N 274.364 2.179 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@H]1C1CCOCC1 2135422917 FVRCJKGOZRBWFG-RYUDHWBXSA-N 266.345 2.208 10 10 CECE C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)[C@@H]1N 1968002549 XVMCHURUFWEBKH-VIKVFOODSA-N 261.413 2.168 10 10 CECE C[C@H]1CN2CCC[C@H]2CN1c1ccc(CN)cc1Cl 251776411 MRHVNAGYSRHAQX-AAEUAGOBSA-N 279.815 2.472 10 10 CECE CN(c1cc2c(cc1Cl)[C@@H](N)C(=O)N2)[C@H]1CCSC1 227446630 AMLQRBJWGLIKDL-JVXZTZIISA-N 297.811 2.234 10 10 CECE C[S@@](=O)CCCNCc1c(O)ccc2ccccc12 116918417 DSPAWXIGNWSJMV-IBGZPJMESA-N 277.389 2.404 10 10 CECE CC(C)Oc1cncc(OCc2ccc(N)cc2)n1 1924904103 LRNBZCFZQBJQBT-UHFFFAOYSA-N 259.309 2.425 10 10 CECE FC1(COc2ccc(N3CCCNCC3)cc2)CC1 2141444202 OSPAJBGAYXTLNK-UHFFFAOYSA-N 264.344 2.367 10 10 CECE CNCc1ccc(N2CCC[C@@H](C(=O)NC)C2)c(Cl)c1 232293324 IATAQGXERPUBSN-GFCCVEGCSA-N 295.814 2.022 10 10 CECE Cc1ccc(CNc2cccn3cnnc23)c(O)c1 2139776099 VBGIBWGNESAGDS-UHFFFAOYSA-N 254.293 2.355 10 10 CECE C[C@@H]1CN(c2ccc(CNC3CC3)cc2)C[C@@H]1N(C)C 124665771 ODBXFWHEXJWHHW-DYVFJYSZSA-N 273.424 2.325 10 10 CECE CC[C@H]1CN(C)CCCN1c1c(F)cc(CN)cc1F 234133635 IZOADDBJVXVQGK-LBPRGKRZSA-N 283.366 2.344 10 10 CECE CC[C@@H](NC(=O)c1cccc(O)c1O)c1nccs1 126440723 CTDPXAVFSFUVOI-SECBINFHSA-N 278.333 2.435 10 10 CECE C[C@H](NCCc1ccncc1)c1c(O)cccc1O 235516286 KZRYTFNKZPAWRX-NSHDSACASA-N 258.321 2.386 10 10 CECE CCNCc1ccc(N2C[C@H](C)N(C)[C@@H](C)C2)cc1 127886514 SRFFLZZMVGGQRA-KBPBESRZSA-N 261.413 2.325 10 10 CECE COCC1CC(OCCCOc2ccc(N)cc2)C1 2142496656 LIGLTEXRTGHVSR-UHFFFAOYSA-N 265.353 2.479 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCOC[C@@H]1C(F)(F)F 2150468002 FZPBEYVDESQJES-LDYMZIIASA-N 291.269 2.422 10 10 CECE CCN(CC)c1ccc([C@H](N)CCCC(=O)O)c(O)c1 1951650493 MKXCKKZJJMWZPY-CYBMUJFWSA-N 280.368 2.493 10 10 CECE O=C1CCN[C@@H](c2c(O)cccc2Br)C1 1951945349 KZKJEYLEDKGKOQ-SECBINFHSA-N 270.126 2.148 10 10 CECE COCC[C@H](C)Oc1ccc(N2CCC[C@H](N)C2)cc1 130934168 QJOBYQZDAQVIMY-KBPBESRZSA-N 278.396 2.418 10 10 CECE CC(C)(C)OC(=O)Nc1cccc([C@@H]2COCCN2)c1O 1952827663 QIBRICCURYDVIX-LBPRGKRZSA-N 294.351 2.400 10 10 CECE C[C@H](c1cc(F)ccc1O)N(C)C[C@H]1CCN(C)C1 252787765 FEANCZKXRXZHPK-NEPJUHHUSA-N 266.360 2.476 10 10 CECE COc1cccc(O)c1CN[C@@H]1[C@@H]2[C@H]3C[C@@H]4[C@@H]([C@H]32)[C@@H]41 2143309167 FAGKUBRAVXPBRP-LKNGMPMGSA-N 257.333 2.001 10 10 CECE O=C(O)[C@H]1CCC[C@@H]1CNCc1ccc(F)cc1O 1972643729 XZNVEEFRFSVZPZ-SKDRFNHKSA-N 267.300 2.122 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@@H]3OCC[C@H]3C2)cc1 2143551658 DJHFCDMEAPQBKQ-ZFWWWQNUSA-N 273.332 2.400 10 10 CECE CCc1cccc(CNC[C@@H]2C[C@@]23CCOC3)c1O 1974223835 LIPOWQAIWNGHKJ-GOEBONIOSA-N 261.365 2.471 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C3(CC3)C2)c(C)c1 2149756498 GULFAIOBYGKIOV-MRXNPFEDSA-N 274.408 2.456 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H]3C[C@H](N)C[C@H]2C3)c1 2144569737 VMKWAAJCPJHXAD-ZDEQEGDKSA-N 276.380 2.273 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H]2C2CC2)cc1O 2144664814 RHDZAMZZZTZPHJ-IAQYHMDHSA-N 276.380 2.288 10 10 CECE 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CC[C@H]1CN(c2ccc(OC)c(C)c2OC)C[C@@H]1CO 2295359677 ITDMNQJKOQAOJB-QWHCGFSZSA-N 279.380 2.467 10 10 CECE C[C@@H](C1CC1)N(C)Cc1ccc(N2CCNCC2)cc1 2286073514 NWMHKNIPVYPKKP-AWEZNQCLSA-N 273.424 2.327 10 10 CECE CC[C@H](NC(=O)Nc1ccc(N)cc1)[C@@H](C)CN(C)C 2288705508 PCKDXAYBBQPAGG-FZMZJTMJSA-N 278.400 2.367 10 10 CECE CN(c1ccc2c(c1)OC(F)(F)O2)[C@H]1CNCC1(C)C 2289917719 IKPMXXFVFMLKHL-LBPRGKRZSA-N 284.306 2.442 10 10 CECE O=C(O)[C@]1(NCc2ccc3c(c2)CCO3)CCCSC1 2296980082 YVPAAVLMXDNJTJ-HNNXBMFYSA-N 293.388 2.062 10 10 CECE CC[C@]1(C)CN(C(=O)C=Cc2ccc(O)c(O)c2)CCO1 2310979642 OGTCBPVGLGAJIJ-MRXNPFEDSA-N 291.347 2.139 10 10 CECE CC(=O)NN1C(=O)C(=Cc2cccc(F)c2)SC1=S 2314717272 YBTSVWRNDHEOEK-UHFFFAOYSA-N 296.348 2.078 10 10 CECE CSc1ncc(CNCCC[C@@H]2C[C@@H]2C(=O)O)s1 2315740450 GDEVATFIUOCVLD-SCZZXKLOSA-N 286.422 2.456 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@H](C)O[C@H](C)C1 2315987371 RPTDENVTKNZLHF-JGPRNRPPSA-N 254.334 2.349 10 10 CECE COc1cc(Cl)c(N2C[C@H](C)[C@@H](N)C2)c(OC)c1 2319560852 RQPVJYXJKLPJMO-KWQFWETISA-N 270.760 2.141 10 10 CECE CO[C@]1(C(F)F)C[C@H](CN2CC[C@H](N=[N+]=[N-])C2)C1 2320213568 NSSRKPWDJCGFJM-ATZCPNFKSA-N 260.288 2.431 10 10 CECE COc1cc(N2CCSC2)ccc1C=CC(=O)O 2320231162 LNQFREXWCLNJPM-UHFFFAOYSA-N 265.334 2.304 10 10 CECE C[C@H](CN(C)C)N(C)c1cc(Cl)c(CN)cc1F 2326776981 IQUWHBRPRRQSIJ-SECBINFHSA-N 273.783 2.324 10 10 CECE CCN1CCc2cc([C@@H](CC3(C)OCCO3)NC)ccc21 2328101290 RLIZDZPLVZCVSM-OAHLLOKOSA-N 290.407 2.483 10 10 CECE CSc1cc(N2C[C@@H]3CCO[C@H]3C2)ccc1CN 2328542933 GPAKOCOQZCTDST-AAEUAGOBSA-N 264.394 2.092 10 10 CECE CN(C[C@H]1CC[C@@H]2C[C@H]12)C(=O)c1cccc(O)c1O 2329161555 NMBBNEFSIZQPEU-FOGDFJRCSA-N 261.321 2.216 10 10 CECE CO[C@H]1C[C@@H]2[C@H]1CCN2c1c(F)cc(CO)cc1F 2330944851 GTRNFJMMNMYWGT-WQAKAFBOSA-N 269.291 2.071 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H]3COC[C@@H]32)c(F)c1 2331657933 FAYPROCMUYEHOM-NVBFEUDRSA-N 264.344 2.331 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1Cl 2333104170 RSWIQJXGSQAOPW-LNSITVRQSA-N 280.799 2.267 10 10 CECE Oc1ccc(CNC[C@@H]2CC[C@H]3C[C@@H]2CO3)c(O)c1 2334120722 RMVWAUDWFOWJTD-SUHUHFCYSA-N 263.337 2.003 10 10 CECE Cc1nnsc1CN(C)CCCc1ccc(N)cc1 2335745581 QAKIUXDCQJSGFH-UHFFFAOYSA-N 276.409 2.493 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[C@@H]3[C@@H](O)C[C@H]32)c1C 2340861235 HQSAVTXSWCDKDH-YUDUHTQSSA-N 260.381 2.283 10 10 CECE NCc1ccc(N2CCC[C@H](O)[C@H]2C(F)(F)F)cc1 2344130067 ANKIVEBGUPAWGJ-RYUDHWBXSA-N 274.286 2.037 10 10 CECE Nc1ccc(CCC(=O)OCCOCC(F)F)cc1 2353441726 MPDOKMVKMSDUIZ-UHFFFAOYSA-N 273.279 2.026 10 10 CECE C[C@H]1C[C@@H](C(=O)O)CCN1[C@H](C)c1cc(O)ccc1O 2353890799 MXKKXKYFOUUGRS-AXFHLTTASA-N 279.336 2.344 10 10 CECE O=C1C[C@@H]2C[C@H]1C[C@]2(O)c1ccc(N2CCCC2)cc1 2354961852 YUTFGXXKOAAAMO-JDFRZJQESA-N 271.360 2.473 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCC[C@@H]3NCC[C@@H]32)c1 2355833931 NVAPSJOBMWIINZ-UGFHNGPFSA-N 276.380 2.288 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@](C)(N)c1ccccc1 52882307 ZKPTYYPKRSAVRD-QGZVFWFLSA-N 284.359 2.225 10 10 CECE CCO[C@H]1CCCN(c2ccc(CN)cc2F)C1 42408132 LLNNNFUAMQKVAP-LBPRGKRZSA-N 252.333 2.290 10 10 CECE CC[C@@H]1CO[C@@H](C)CN1[C@@H](CN)c1ccc(N(C)C)cc1 48914649 QWXFNSXLBZGFGG-LXZKKBNFSA-N 291.439 2.252 10 10 CECE c1csc(Sc2ncc(CNC3CC3)cn2)n1 128888483 HFYMOOWUCCQVPK-UHFFFAOYSA-N 264.379 2.336 10 10 CECE CC(C)N(C)CCNCc1ccc2c(c1)CCCN2C 54111435 HFVKXWWGSLZIII-UHFFFAOYSA-N 275.440 2.499 10 10 CECE C[C@H](N[C@H]1CCO[C@H](C)C1)c1cc(O)ccc1O 300593220 NPCXPISLKJVHSO-VWYCJHECSA-N 251.326 2.316 10 10 CECE C/C(=C1\SC(=S)N(CO)C1=O)c1ccccc1 215865842 QIANYDJZRFGPQL-CSKARUKUSA-N 265.359 2.228 10 10 CECE COCCONCc1ccc(N2CCCCC2)cc1 134047735 CLZFWKYVJRRDST-UHFFFAOYSA-N 264.369 2.345 10 10 CECE O=C(O)/C=C\c1ccc(N2CC[C@@H](N3CCCC3)C2)cc1 227486658 NKFLRTPIVYDHSJ-KQQSKNTNSA-N 286.375 2.459 10 10 CECE CN1CCc2cc([C@@H]3[C@@H](N)CCCN3C3CC3)ccc21 226475763 TWOFGBJJWUFSMU-DOTOQJQBSA-N 271.408 2.306 10 10 CECE CCOc1cccc(CN[C@H](C)[C@H](C)OC)c1O 289799756 MCSIHBVNVZINBQ-MNOVXSKESA-N 253.342 2.304 10 10 CECE N[C@@H](CCO)c1cc(Cl)cc(Br)c1O 44232962 XYRLYPDQPFUYSM-QMMMGPOBSA-N 280.549 2.190 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2CCCSC2)cc1 136296318 UOPQWMBTIMDTDJ-CYBMUJFWSA-N 264.394 2.213 10 10 CECE CC(C)N(C)CCCCNCc1cc2c(cc1O)OCO2 45684868 ZCLKGNYRLMGSBN-UHFFFAOYSA-N 294.395 2.331 10 10 CECE CCCNCc1ccc(N2CCn3cnnc3C2)cc1C 81537682 OGRXILQMIIYQOT-UHFFFAOYSA-N 285.395 2.106 10 10 CECE CC[C@]1(CO)CCCN(Cc2ccc(OC)cc2O)C1 190224067 IEGLXIQUDPVSQG-INIZCTEOSA-N 279.380 2.385 10 10 CECE CC[C@]1(C(=O)O)CCCN1Cc1cc(F)ccc1O 234094968 BGJBOCXQJGAVNN-CQSZACIVSA-N 267.300 2.361 10 10 CECE CCS[C@H]1CC[C@@H](Nc2c(N)cccc2C(N)=O)C1 233818644 TXDPLGBVJTWKLT-ZJUUUORDSA-N 279.409 2.454 10 10 CECE Nc1ccc(OCCC(=O)OCc2cccc(O)c2)cc1 94687483 RODBTHBMXKPJKU-UHFFFAOYSA-N 287.315 2.487 10 10 CECE COC(=O)CCCNCc1ccc2c(c1)CCCN2C 50286662 CDSAKGYOBZGFIU-UHFFFAOYSA-N 276.380 2.112 10 10 CECE CCOC(=O)[C@H](CN=[N+]=[N-])Nc1ccc(OC)cc1 91314392 WCRDZMOROITUCA-NSHDSACASA-N 264.285 2.349 10 10 CECE COC(=O)[C@@H](Cc1ccccc1)NCCCN=[N+]=[N-] 90259665 AMTUCVBZHQJDPQ-GFCCVEGCSA-N 262.313 2.061 10 10 CECE CN(C)c1ccc(CN2CCO[C@H](C3CC3)C2)cc1 375331407 KDKIWVZTEUBBPM-INIZCTEOSA-N 260.381 2.363 10 10 CECE C[C@@H]1CN(C)CCCN1c1ccc(/C=C\C(=O)O)cc1 383092054 UEMKFOOZEPCERT-OYVUYXNMSA-N 274.364 2.315 10 10 CECE CCN1CCc2cc([C@H](NC)C3[C@@H]4COC[C@@H]34)ccc21 2163067142 SPYLTQDOXQKMTO-CPUCHLNUSA-N 272.392 2.222 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@@H]1C[C@@H](F)CN1 2163106197 IPAWYWJQWYLIKD-VNQPRFMTSA-N 278.371 2.410 10 10 CECE COC(=O)c1ccc(C(=O)c2cccc3c2NCC3)o1 2163934841 QTYBCHZZZJCEDQ-UHFFFAOYSA-N 271.272 2.265 10 10 CECE CCCn1cc([C@@H](NC)c2ccc(N(C)C)cc2)nn1 2164121520 WXEGUEONPZLHMR-HNNXBMFYSA-N 273.384 2.063 10 10 CECE CC(C)CNC(=O)CN(C)c1ccc([C@@H](C)N)cc1F 723177896 IWZBFYWRKBKSBI-LLVKDONJSA-N 281.375 2.054 10 10 CECE CC1CC(CN(C)c2cc3c(cc2F)[C@H](O)C(=O)N3)C1 700792364 COKWTTOSRHTPFL-CTCYHXBNSA-N 278.327 2.294 10 10 CECE O=C(O)/C=C\c1ccc(N2C[C@H](F)[C@@H](F)C2)cc1 714748903 XLAJUNVQEUQJPC-QGILPKKRSA-N 253.248 2.281 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H](N)[C@H](C(F)(F)F)C1 720843845 GAUPKRSUGSOXJJ-ONOSFVFSSA-N 292.276 2.414 10 10 CECE C[C@H](CC(=O)NCc1ccccc1O)n1cccc1 729529925 ODZADQNFBPSPDF-GFCCVEGCSA-N 258.321 2.461 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2COCC2(C)C)c1 834903399 JCPCCSHBBNFXJB-YGRLFVJLSA-N 293.363 2.254 10 10 CECE Cc1cc(O)c(CNCCN2CCCOCC2)c(Cl)c1 840948422 HTMSRWLHNDQCNE-UHFFFAOYSA-N 298.814 2.166 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H]3CO[C@H](C)[C@@H]3C)C2)cc1 926681220 WOYZOXMMOUZPOQ-QDEZUTFSSA-N 290.407 2.287 10 10 CECE CC1(C(=O)NCc2c(O)cccc2F)CCC(=O)CC1 928706641 SVWLACPCLSIARA-UHFFFAOYSA-N 279.311 2.297 10 10 CECE CCOCC(C)(C)CNC(=O)NCc1c(O)cccc1F 922507243 CCZIXZQFCJDAGO-UHFFFAOYSA-N 298.358 2.393 10 10 CECE C[C@@H](NCC[C@@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O 757656119 IHWOKQRAHGCUIF-GHMZBOCLSA-N 280.324 2.378 10 10 CECE Cc1ccc(O)c(CNC(=O)[C@@H]2CCCOCC2)c1 862755341 FEZNMGZAWHERRR-GFCCVEGCSA-N 263.337 2.134 10 10 CECE COC[C@@]1(F)CCN(Cc2cccc(F)c2O)C1 1875796889 RFEPVDLYFNRMJC-CYBMUJFWSA-N 257.280 2.092 10 10 CECE C[C@H]1CCC[C@@]1(C)NS(=O)(=O)Cc1ccc(N)cc1 1878814358 XXGDHFCLYDMUQM-SMDDNHRTSA-N 282.409 2.267 10 10 CECE O[C@@H]1CCCc2cc(N3C[C@@H]4COCC[C@H]43)ccc21 1878825388 UDWIRMQGALRHHT-DAXOMENPSA-N 259.349 2.281 10 10 CECE O=C(c1cc(O)cs1)N1CC[C@H]([C@@H]2CCCO2)C1 899627252 GYLJIDHSLZWMNO-ONGXEEELSA-N 267.350 2.095 10 10 CECE C[C@H](N=c1nc2ccccn2[nH]1)c1ccccc1O 1877578953 REEMODUTPFYHBC-JTQLQIEISA-N 254.293 2.030 10 10 CECE C[C@H](Nc1ncncc1C(=O)O)c1ccccc1O 1877568023 CXKLTTOPHKWZCB-QMMMGPOBSA-N 259.265 2.054 10 10 CECE CN1CCC[C@@H](N(C)c2ccc(CN)c(F)c2)CC1 1877823894 SKFVUKNQLKGNBQ-CYBMUJFWSA-N 265.376 2.205 10 10 CECE O=C1C[C@H]2C[C@@H]1[C@H](C(=O)NCc1cccc(Cl)c1O)C2 890761213 NJVUWLKKPPAXSX-JMJZKYOTSA-N 293.750 2.277 10 10 CECE CN(Cc1cc[nH]n1)Cc1cc(F)cc(F)c1O 894016583 GMLDGQPOJJPVDA-UHFFFAOYSA-N 253.252 2.026 10 10 CECE COc1ccc(N(C)C[C@H]2CCC[C@H](CN)O2)cc1 1879548605 ADGWNANNETXHTM-HUUCEWRRSA-N 264.369 2.028 10 10 CECE CNc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1F 1137443666 YBZLAYSFASTMSJ-UHFFFAOYSA-N 290.294 2.209 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@]3(CCO3)C2)c(F)c1 1880451669 QGTRVKPLWZLYMF-LKFCYVNXSA-N 269.291 2.387 10 10 CECE C[C@H](O)c1cc(F)c(N2CC3(CCCO3)C2)c(F)c1 1880480300 VCAUDPNIFBQKBO-VIFPVBQESA-N 269.291 2.387 10 10 CECE CCN[C@@H](C)c1cc(F)c(N2CC(OC)C2)c(F)c1 1880962584 MEVYGZCUAAHHPR-VIFPVBQESA-N 270.323 2.470 10 10 CECE Nc1ccc(-n2c(C=O)nc3cc(N)ccc32)cc1 76081354 YPIZAMVEIXZANU-UHFFFAOYSA-N 252.277 2.002 10 10 CECE COc1ccc(C(=O)NCc2ccccc2O)c(Cl)n1 1190100842 WWVIARYMHCUMEA-UHFFFAOYSA-N 292.722 2.379 10 10 CECE CC(C)(C)OC(=O)N[C@H](C(=O)NCCN=[N+]=[N-])C1CCC1 1963818853 ZLKNMAHCKYWYFV-JTQLQIEISA-N 297.359 2.106 10 10 CECE C[C@@H](NCCNC(=O)C(C)(C)C)c1ccc(F)cc1O 1962969496 NYUJKOSXJUYYPO-SNVBAGLBSA-N 282.359 2.344 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 1963731794 ALTUMBBZWVQRAT-SNVBAGLBSA-N 297.359 2.203 10 10 CECE COCCCC[C@@H](NN)c1ccc(N(C)C)cc1 304500322 UYHHVTXLKLBOHD-CQSZACIVSA-N 251.374 2.074 10 10 CECE CC1(NCc2ccc(F)c(F)c2O)CCOCC1 703295088 XIWLGIYZFXECAP-UHFFFAOYSA-N 257.280 2.329 10 10 CECE C[C@@H](NC[C@@H]1CCN1C1CC1)c1cc(F)ccc1O 691837771 YXIWRBHFLISKIR-MFKMUULPSA-N 264.344 2.419 10 10 CECE CCO[C@@H]1CCN(c2ccc([C@@H](C)NC)c(O)c2)C1 706561167 UQBUHDMVTUEYCZ-DGCLKSJQSA-N 264.369 2.288 10 10 CECE CN[C@H](C)c1ccc(N2CC(n3cccn3)C2)cc1 707670888 JQCLPJIEXUSTQT-GFCCVEGCSA-N 256.353 2.225 10 10 CECE CC(C)C1(O)CCN(c2ccc(CO)cc2F)CC1 710564746 ODXWHEUBXZSAMJ-UHFFFAOYSA-N 267.344 2.305 10 10 CECE CCN1CC[C@@H](N(C)c2ccc(CNC)c(C)c2)C1 688445568 AWWULANMSBYTDD-MRXNPFEDSA-N 261.413 2.245 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@]23COC[C@H]2C3)c(F)c1 689307632 ZUQJEUQOTYEUOI-IXPVHAAZSA-N 264.344 2.318 10 10 CECE Cc1cc(N2C[C@H](F)[C@@H](F)C2)ccc1C[C@@H](C)N 714565070 UHIAVQNXSYGLOQ-SWHYSGLUSA-N 254.324 2.381 10 10 CECE COc1ccc([C@@H](C)NCC[C@@H](O)C(F)F)c(O)c1 716700205 XFUDUDIZGXTYBI-LDYMZIIASA-N 275.295 2.068 10 10 CECE Oc1cccc(Br)c1CN1C[C@H]2COC[C@@H]2C1 718153891 JWAIUBBRTRAYOZ-UWVGGRQHSA-N 298.180 2.233 10 10 CECE CCCN1CC[C@@H](CNC(=O)Nc2ccc(N)cc2)C1 693005309 GKAXAOGQJSSXEV-LBPRGKRZSA-N 276.384 2.122 10 10 CECE CN1CCCc2cc([C@H]3NCCc4nc[nH]c43)ccc21 690882846 ZVHYHYCPGYIQQO-OAHLLOKOSA-N 268.364 2.027 10 10 CECE COc1ccc(CN(C)[C@H]2CN(C)C(C)(C)C2)c(O)c1 694150905 URVPCQUISPKPHT-CYBMUJFWSA-N 278.396 2.315 10 10 CECE Cn1c([C@@H](O)CCc2ccc(N)cc2)cnc1Cl 695902131 QGRAVBDEHHODCR-LBPRGKRZSA-N 265.744 2.322 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCO[C@H](C(F)(F)F)C1 698971383 PYYVJXMJZNJFIO-KWQFWETISA-N 291.269 2.422 10 10 CECE Oc1cc2c(cc1CN1C[C@H]3CC[C@@H](C3)C1)OCO2 699412408 UUHCVAFTUJAXTO-QWRGUYRKSA-N 261.321 2.353 10 10 CECE C[C@]1(c2noc(COc3ccc(N)cc3)n2)CCCO1 94780840 NISBBLCVNJOBHE-CQSZACIVSA-N 275.308 2.256 10 10 CECE O[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CC12CC2 1343089063 MTZTVXJYROGFSP-MRXNPFEDSA-N 272.392 2.244 10 10 CECE CCC(=O)N[C@H](CNCc1ccc(OC)c(C)c1)C1CC1 1276529547 WBDDMJBPAIFUMM-OAHLLOKOSA-N 290.407 2.398 10 10 CECE COc1ccc(N2CC[C@H](CCO)[C@@H](C)C2)c(N)c1 2115819343 MAKUWDUUYBKPMT-NWDGAFQWSA-N 264.369 2.122 10 10 CECE CN(c1cc2c(cc1N)OCCO2)C1CC(CF)C1 2118502387 NDKUYKPSFNFSIH-UHFFFAOYSA-N 266.316 2.224 10 10 CECE CCC1=NN(C)C(=O)/C1=C/c1ccc(OC)c(O)c1 1865664294 JUPZYARXFQZIRW-JXMROGBWSA-N 260.293 2.022 10 10 CECE O=C(NCc1c(O)cccc1O)c1cc2occc2[nH]1 1472063973 QOEMDNVBVSBKBW-UHFFFAOYSA-N 272.260 2.102 10 10 CECE Nc1ccc(NC(=O)CCC[S@@](=O)C2CCC2)cc1 2121632505 GJSLMHSKVDBYKF-LJQANCHMSA-N 280.393 2.289 10 10 CECE CO[C@@H]1C[C@@H]2[C@@H]1CCN2c1ccc([C@@H](C)N)c(O)c1 2121834533 WHCMFIGZRLCLJT-MSELDCQNSA-N 262.353 2.026 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccnc(C2CC2)c1 1635847111 HSQZCAYHWICCNR-UHFFFAOYSA-N 284.315 2.300 10 10 CECE C[C@@H]1CC[C@H](CCC(=O)NCc2c(O)cccc2O)O1 1647270200 NWACCUXIFKQWFK-GHMZBOCLSA-N 279.336 2.062 10 10 CECE COCC(COC)CN(C)c1ccc([C@@H](C)N)cc1 1910180794 HTNWEXVLXBGWHS-GFCCVEGCSA-N 266.385 2.052 10 10 CECE O=[N+]([O-])c1ccc(NCc2cc(O)ccc2O)cn1 1655814892 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2.324 10 10 CECE CCCN(C)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849416241 NABKQVDIYAPZCD-CYBMUJFWSA-N 291.395 2.325 10 10 CECE CN(C)c1ccc(/C=C/CN2CCC[C@@H](CN)C2)cc1 843047841 YKQPPXRWWXIYGR-WMHVBEDNSA-N 273.424 2.437 10 10 CECE CC(C)(C)n1cc(C(=O)NCc2c(O)cccc2F)cn1 928710310 AXCXCGUHLKZOBF-UHFFFAOYSA-N 291.326 2.413 10 10 CECE C[C@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccc(F)cc1O 858603107 RCTRAMAEBDMUKI-HZMBPMFUSA-N 292.354 2.335 10 10 CECE COC(C)(C)[C@H](C)NC(=O)N(C)Cc1ccccc1O 925487309 BSFVNDDIKSFRQD-NSHDSACASA-N 280.368 2.347 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@@H]1CN2CCC[C@H]1C2 925077583 BQWJFLGIUUJNJJ-DOTOQJQBSA-N 273.424 2.245 10 10 CECE CCCN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1OC 934706910 UELAUKTUFCARRA-TZMCWYRMSA-N 263.337 2.166 10 10 CECE C[C@@H](CF)NCc1ccc(N2CCN(C)CC2)c(F)c1 1117759788 BUJCVRREZROATQ-LBPRGKRZSA-N 283.366 2.025 10 10 CECE COc1cccc([C@@H](C)NCCC[C@H]2CCOC2=O)c1O 872113165 MSEUUERGRHHXIP-NEPJUHHUSA-N 293.363 2.395 10 10 CECE N[C@@H](CO)c1ccc(N2CCCCC2)cc1Cl 72199225 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10 10 CECE CNCc1cc(F)c(N2CCC[C@H]3COC[C@H]32)c(F)c1 690347993 QMCOCMWLTUSFGH-SMDDNHRTSA-N 282.334 2.299 10 10 CECE C[C@@H](O)c1ccc(N2CCN(C)C(C)(C)CC2)cc1O 712601770 RGQIWXUVHRMUGZ-GFCCVEGCSA-N 278.396 2.366 10 10 CECE CN(C)c1ccc([C@H](CN)N2C[C@H]3CC[C@@H]3C2)cc1 688352671 UIMFLUKEPJZQQN-FMKPAKJESA-N 259.397 2.094 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H]([C@@H](C)O)C2)cc1O 688889273 GMIKCQPXKFSDJK-QJPTWQEYSA-N 264.369 2.009 10 10 CECE C[C@H]1CN(c2ccc(CN)c(F)c2)CC[C@@H]1N(C)C 693659843 HXPAJKVTLLNNHD-NHYWBVRUSA-N 265.376 2.061 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](C)[C@](C)(CO)C2)c(F)c1 694638776 YNOHQDVRWXQKEL-ZETOZRRWSA-N 266.360 2.300 10 10 CECE COc1cc([C@@H](O)CCc2ccc(N)cc2)c(F)cn1 695880204 JKLURUPCRMKBAP-AWEZNQCLSA-N 276.311 2.478 10 10 CECE C[C@H](NCC1(O)CCCCC1)c1ccc(O)cc1O 87017477 HTUCLZMWAYDSLI-NSHDSACASA-N 265.353 2.444 10 10 CECE C[C@@H]1CN(Cc2cc(N)ccc2O)C[C@@](C)(C(F)F)O1 698801156 VLDOHAXRLQVQQV-OTYXRUKQSA-N 286.322 2.219 10 10 CECE C[S@](=O)c1ccc(NC(=O)c2cc(O)cs2)cc1 1443964935 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Nc1ccc(NC(=O)N2C[C@H](N)CC23CCCC3)cc1 2191517039 QAQJCSLEOKFCAQ-GFCCVEGCSA-N 274.368 2.147 10 10 CECE Nc1ccc(OCC(=O)NOCCCC(F)(F)F)cc1 2191660255 VYUODNZWPUMWPT-UHFFFAOYSA-N 292.257 2.038 10 10 CECE C[C@@H](C1CC1)N(C)c1ccc(CO)c([N+](=O)[O-])c1 2068310919 NRYNIIYDYIIUFO-VIFPVBQESA-N 250.298 2.322 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CC(C)(C)[C@H]2CO)c(F)c1 2194703868 WKGKXDDFGXYGOZ-TVQRCGJNSA-N 284.350 2.452 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@@H](C4(O)CC4)C3)ccc21 2187053688 WTXBDBXJBNPDAQ-CZUORRHYSA-N 272.392 2.374 10 10 CECE OCc1ccc(N2CC[C@@H](CO)C23CC3)c(Cl)c1 2070129145 DLSDAPPSMDQHBN-NSHDSACASA-N 267.756 2.184 10 10 CECE Oc1ccc(F)cc1CNC[C@]12C[C@H](CCO1)C2 2073405659 RODCWVZTNGQXSQ-WJONMLJTSA-N 251.301 2.190 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C(F)(F)CO)C2)c(F)c1 2197761386 KAOSRKNSIONMIS-MWLCHTKSSA-N 288.313 2.299 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)C(C)(C)CO)c(F)c1 2074076739 MYWWIOWFEHCOFS-MRVPVSSYSA-N 259.296 2.225 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@H]2C[C@H]1CN2C 2187590136 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2104273038 CJGLTUHYNPVGSD-NSHDSACASA-N 255.321 2.262 10 10 CECE COC(=O)C1(NCCN=[N+]=[N-])C[C@@H]2CC=CC[C@H]2C1 2104209767 GVJMOQPYLIRFEI-QWRGUYRKSA-N 264.329 2.174 10 10 CECE CC(C)(C)c1nc(C(=O)[C@H]2CCCC(=O)C2=O)co1 2104278033 XHSBXRLHXLYZQP-MRVPVSSYSA-N 263.293 2.093 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CC2(CCC2)[C@@H]1O 2084791091 PWTJPZRKGGHMGN-DGCLKSJQSA-N 267.756 2.439 10 10 CECE CC1(C)CC[C@H](CO)N1c1ccc(CO)cc1F 2084962926 HRISZLKASOQVFG-LLVKDONJSA-N 253.317 2.058 10 10 CECE COc1ccc(N2C[C@H](N)CC(F)(F)C2)cc1C 2085630340 HMYNXPMLQSUSSZ-SNVBAGLBSA-N 256.296 2.176 10 10 CECE COC[C@@H]1CC[C@@H]1N(C)c1ccc(CN)cc1F 2086266046 GSNLYBNRZOZLKK-AAEUAGOBSA-N 252.333 2.146 10 10 CECE CC[C@H](O)CN(C)c1ccc(CO)cc1C(F)(F)F 2106613446 LKNJWGIRIGTPGR-JTQLQIEISA-N 277.286 2.405 10 10 CECE CCN1CCc2cc([C@H](O)c3ncc(C)[nH]3)ccc21 2106797639 COCGBGNSDHHWKH-AWEZNQCLSA-N 257.337 2.182 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@H]1C[C@@H](F)CN1 2106821084 QSYSFXJVVGHHLX-BPLDGKMQSA-N 264.344 2.020 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H]1CCO[C@H]1C 2106854861 IIAFKHUTLNATOQ-HZUKXOBISA-N 260.381 2.364 10 10 CECE CN1CCCc2cc([C@@H](N)COCC(F)F)ccc21 2106823676 RGHRHMKQOYENPS-LBPRGKRZSA-N 270.323 2.351 10 10 CECE CCN(CC)c1ccc([C@@H](O)c2ccnn2C)cc1 2106820513 LFEVYGVEZQAEMN-OAHLLOKOSA-N 259.353 2.348 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H](N)C(C)(C)C)ccc21 2106806485 XMESLKCPCVYNPQ-HUUCEWRRSA-N 262.397 2.476 10 10 CECE COc1nsc(OC)c1CNCc1ccccc1O 2087738144 IBIAZGGQXZVCHJ-UHFFFAOYSA-N 280.349 2.156 10 10 CECE C[C@@H](O)c1ccc(N2[C@H](CO)C[C@@H]3CCC[C@H]32)cc1 2108392916 XYXSMZHQICJLFE-SHPPOPEUSA-N 261.365 2.480 10 10 CECE CCC[C@H]1CCN1CCC(=O)Nc1ccc(N)cc1 2088659840 OZRAMXIYBKJTGN-AWEZNQCLSA-N 261.369 2.472 10 10 CECE O=C(NC[C@@H]1C[C@@H]2CCC[C@H]21)c1ccc(O)c(O)c1 2089194851 WZBCTRMLNOWDDV-ZMLRMANQSA-N 261.321 2.264 10 10 CECE CCCOc1cc(N2C[C@H](F)[C@H](OC)C2)ccc1N 2090281669 JBAMZJKFMJVODI-SMDDNHRTSA-N 268.332 2.231 10 10 CECE C[C@H]1CC[C@H](CO)N(c2ccc([C@H](C)O)cc2F)C1 2110595087 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Cc1cc(CNC2CC2)ccc1N1CC(CCO)C1 2095991117 PUYCDJXIJNKVGX-UHFFFAOYSA-N 260.381 2.066 10 10 CECE O=C(N[C@H]1CC[C@H]2CC[C@H]1C2)c1ccc(O)c(O)c1 2096166100 JFZXCNYIYJMQAM-SCVCMEIPSA-N 261.321 2.406 10 10 CECE C[C@@H]1CN([C@H](C)c2c(O)cccc2O)C[C@@H](C)C1N 2099319942 MYAKMBBYBSYBEI-GMTAPVOTSA-N 264.369 2.074 10 10 CECE Cc1cc(CN)ccc1N(C)[C@H]1CCN(C)[C@H](C)C1 2113996985 WPGNPMJKGJTVFI-HIFRSBDPSA-N 261.413 2.373 10 10 CECE Cc1cc(N(C)[C@@H]2CCN(C)C[C@H]2C)ccc1CO 2114010004 TZASGLPBMLQOOE-CZUORRHYSA-N 262.397 2.264 10 10 CECE CC[C@H](c1ccccc1O)N(CC)[C@H]1CCNC1=O 2114764622 OTCNXBCGSSHRQW-OLZOCXBDSA-N 262.353 2.054 10 10 CECE Nc1ccc(CNCc2conc2Br)cc1 2212403919 XDTBSGTZSSWVJI-UHFFFAOYSA-N 282.141 2.309 10 10 CECE COc1cc(N2C[C@@H](CO)CC(C)(C)C2)ccc1CO 2204549350 IPTPGLRAMVJVJV-LBPRGKRZSA-N 279.380 2.032 10 10 CECE COCCNCc1ccc(N2CC[C@H]3C[C@H]32)cc1OC 2204545685 SBLAJBHFFFLJFI-SWLSCSKDSA-N 276.380 2.030 10 10 CECE Oc1cc(F)ccc1CN1CCC[C@@]2(CCCNC2)C1 2204624698 OWWCPVOVWAZPNO-MRXNPFEDSA-N 278.371 2.497 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CCCNCc1ccc(N2CCC(C(N)=O)CC2)cc1C 50581311 DPORCTWYFBFGDB-UHFFFAOYSA-N 289.423 2.196 10 10 CECE COc1cccc(CNC(=O)N[C@@H](C)C(C)C)c1O 173330238 LVVXERNMLPQWEL-JTQLQIEISA-N 266.341 2.245 10 10 CECE COc1ccc(O)c(CNC(=O)[C@H](C)c2cccnc2)c1 174072569 JRLPBJSARMNTHG-LLVKDONJSA-N 286.331 2.216 10 10 CECE CN(Cc1ccccc1O)C(=O)c1ncncc1Cl 176545790 WWXJGCBRKMLCMJ-UHFFFAOYSA-N 277.711 2.108 10 10 CECE COc1cccc(CN[C@@H]2CCC[C@H]2n2ccnc2)c1O 37107028 YPLSEEPCEMIDAU-ZIAGYGMSSA-N 287.363 2.481 10 10 CECE CC(C)[C@@]1(C)CC(=O)N(CCOc2ccc(N)cc2)C1=O 38079650 UIEFAPLKPMNDRB-MRXNPFEDSA-N 290.363 2.069 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H](O)CN2CCCCC2)c1 185114891 QYFQVMLMMXWJRH-LSDHHAIUSA-N 292.423 2.198 10 10 CECE CC(C)c1cc(N2CCNCC2)cc2c1OCCN2 62539473 RJPIAZVQIBMGAI-UHFFFAOYSA-N 261.369 2.024 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N1CCN(C2CC2)CC1 220113810 GKDQMDGHFJWZGA-CLTKARDFSA-N 286.375 2.377 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)C[C@H]2CCCCO2)cc1 227168649 QKKWXHOTFVUAKV-SJORKVTESA-N 291.439 2.253 10 10 CECE 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272.717 2.023 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CC(=O)NCc2cccs2)C1 1912152718 XKIZWGYZBLPGGU-LLVKDONJSA-N 293.396 2.387 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C[C@H]2COC3(CCCC3)O2)C1 1912183578 QXLKNGVCDGGCKS-MNOVXSKESA-N 252.318 2.057 10 10 CECE Cc1cc(C(=O)N2CCCC[C@H](CN=[N+]=[N-])C2)nn1C 1912199368 RJEMWGBVCGWVHC-LLVKDONJSA-N 276.344 2.281 10 10 CECE C[C@H]1C[C@@H](C)C[C@H]([C@@H](NCCN=[N+]=[N-])C(=O)O)C1 1912148434 SVQMRHGVBCAUSF-VPOLOUISSA-N 254.334 2.412 10 10 CECE CC[C@@](CCC(F)(F)F)(NCCCN=[N+]=[N-])C(N)=O 1912199126 OULMMHXWUHQIID-VIFPVBQESA-N 281.282 2.253 10 10 CECE [N-]=[N+]=NCCCCN1CCCC[C@@H]1C1OCCO1 1912208821 WPZUPBSBJWJRKE-LLVKDONJSA-N 254.334 2.304 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2ccc(F)c([N+](=O)[O-])c2)C1 1912200084 BNMMRCGEMFBTSS-MRVPVSSYSA-N 279.231 2.259 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2cscn2)C1 1912204744 YAYJTBHVFNGYOU-MRVPVSSYSA-N 251.315 2.306 10 10 CECE C[C@@H](NC(=O)[C@]12CO[C@](C)(C1)C2)c1ccccc1O 2137912351 ROEMRNXGAYAXPX-VCTAVGKDSA-N 261.321 2.139 10 10 CECE CC[C@H]1CCOCCN1Cc1cc2c(cc1O)OCO2 1913697194 MTJFVGSKQKSNME-LBPRGKRZSA-N 279.336 2.122 10 10 CECE C[C@H](NCCN=S1(=O)CCCC1)c1ccccc1O 1913850138 GRKNCPNMRKIMIU-LBPRGKRZSA-N 282.409 2.305 10 10 CECE Cc1ccc(CN2C[C@@H](O)[C@H]2C)c(O)c1Br 1905139459 STJNFMMSBFUNGO-PSASIEDQSA-N 286.169 2.028 10 10 CECE Cc1ccc(CNC(C)(C)CO)c(O)c1Br 1905143600 OMTZMPGRKIBADK-UHFFFAOYSA-N 288.185 2.324 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H]3C[C@H]3[C@H]2CO)cc1 1905555588 KBKZDYBBLFYVCC-DRPJVOAASA-N 260.381 2.174 10 10 CECE CC(C)[C@@H](CCN)c1nc(-c2ccc(O)c(O)c2)no1 1914850133 MZTCIQPPHVFLHH-SNVBAGLBSA-N 277.324 2.236 10 10 CECE CC1(C)[C@H](O)C[C@H]1CNCc1ccc(F)cc1O 1967877161 RPFGHTRZKGQCKH-GXFFZTMASA-N 253.317 2.028 10 10 CECE COc1ccc(NC(=O)c2ccc(O)c(O)c2)cc1F 226955093 GQLMCCMTJRKVIC-UHFFFAOYSA-N 277.251 2.498 10 10 CECE CN1CCc2cc(CN3C[C@@H](N)CC34CCC4)ccc21 1925223347 KKNXXLSLFDLFJR-HNNXBMFYSA-N 271.408 2.135 10 10 CECE CCOC(=O)CC[C@@](C)(N)c1ccc(N(C)C)cc1 1927711671 RPPDSKKUKHVJPN-OAHLLOKOSA-N 264.369 2.270 10 10 CECE COc1cc(N(C)CCOC(C)(C)C)ccc1CN 2139696481 IEDDUYKCFRXZKY-UHFFFAOYSA-N 266.385 2.405 10 10 CECE Oc1cc(F)ccc1CN[C@@H]1CCN2CCC[C@H]1C2 2139883833 ZWTQOZZLMZXKBY-GXTWGEPZSA-N 264.344 2.105 10 10 CECE CCCS(=O)(=O)CCN[C@@H](C)c1cc(F)ccc1O 2139806291 IRKHMDOOXPWHOH-JTQLQIEISA-N 289.372 2.007 10 10 CECE Cc1cc(C)c([C@@H](NCCCN=[N+]=[N-])C(N)=O)cc1C 235797227 HXMQAIWWAMJRHC-CYBMUJFWSA-N 275.356 2.428 10 10 CECE CN1CCCc2cc(CN[C@H](CO)C(F)(F)F)ccc21 2146605846 CARAVKGSWWKNSV-CYBMUJFWSA-N 288.313 2.082 10 10 CECE Cc1cc(N(C)C[C@@H]2[C@@H]3CCOC[C@@H]32)ccc1CCN 2150178861 MIFANGUQCUUIOV-BBWFWOEESA-N 274.408 2.215 10 10 CECE CN(C[C@@H]1[C@H]2CCC[C@H]21)c1ccc2c(c1)NC(=O)[C@@H]2O 2150181652 MQYRJWSJUDIDRJ-REJLFOLJSA-N 272.348 2.154 10 10 CECE CCOC(=O)CCC[C@@H](N)c1c(O)cccc1F 1951602416 PIODSRZAKTUGHD-SNVBAGLBSA-N 255.289 2.265 10 10 CECE C[C@H](CN[C@H](C)c1cc(O)ccc1O)c1ccn(C)n1 2147080403 OVYCCIKWKKDWPU-GHMZBOCLSA-N 275.352 2.286 10 10 CECE O=C(O)[C@@H]1CCN[C@H]1c1cc2ccccc2cc1O 1952825281 IAPNPVUYYNFATN-BXUZGUMPSA-N 257.289 2.281 10 10 CECE C[C@@H]1CN([C@H](C)C(=O)Nc2ccc(N)cc2)CCS1 252980889 OPQUULIZYMHNGK-GHMZBOCLSA-N 279.409 2.033 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CCCCCC3)cc21 155736846 MWRZWDDINSLKMS-AWEZNQCLSA-N 259.353 2.043 10 10 CECE COC[C@H]1[C@H]2CN(c3ccc(CCN)c(C)c3)CC[C@H]21 2149558752 XEXBFZFIPQWSFL-IXDOHACOSA-N 274.408 2.215 10 10 CECE CCOC(=O)c1sc(-c2cn[nH]c2N)nc1CC(C)C 157749374 LZBZNIGEVDZJTG-UHFFFAOYSA-N 294.380 2.491 10 10 CECE CCCN(c1ccc2c(c1)NC(=O)[C@H]2NC)C1CC1 36194629 KWZIFHLTGXHRSZ-AWEZNQCLSA-N 259.353 2.278 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3COCC[C@@H]32)cc1O 2145021244 RUALCUPMNVBPSR-JMSVASOKSA-N 276.380 2.288 10 10 CECE CN(Cc1cccc(Cl)c1O)c1ccnn1C 2005140303 DSCNDKNXDUBBNI-UHFFFAOYSA-N 251.717 2.416 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H]2C[C@H]1CO2 2145310183 CBNQTUHDTXDXGE-MELADBBJSA-N 275.348 2.166 10 10 CECE CC(C)NCCCC(=O)N(C)Cc1ccccc1O 37823796 YALXVJIFGVCXDL-UHFFFAOYSA-N 264.369 2.129 10 10 CECE CCOC1CC(CN(C)C(=O)Cc2ccc(N)cc2)C1 2145792881 GUILDZNNGNTIED-UHFFFAOYSA-N 276.380 2.085 10 10 CECE CN[C@@H](CSc1nccs1)C1CCOCC1 1995480915 FLLHZTOSALFQJL-JTQLQIEISA-N 258.412 2.250 10 10 CECE CNCc1ccc(N2C[C@@H](C(N)=O)CC[C@H]2C)c(Cl)c1 164009388 LKYAMPSIPQJMCU-PWSUYJOCSA-N 295.814 2.150 10 10 CECE CC(C)(C)c1noc([C@H](N)Cc2ccc(O)c(O)c2)n1 40225981 BXCHESCKBSAPLU-SECBINFHSA-N 277.324 2.021 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)[C@@H]1CCSC1 40302910 PXOWLNUCFDZQMZ-GFCCVEGCSA-N 280.393 2.002 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H]3[C@H](C(=O)O)[C@H]32)cc1 2151013458 IKCMRXFENATZGN-ILXRZTDVSA-N 274.364 2.048 10 10 CECE Nc1ccc(NC(=O)N2C[C@@H](O)CC3(CCC3)C2)cc1 2151349247 RJEXYFOLSNCLKJ-ZDUSSCGKSA-N 275.352 2.038 10 10 CECE CO[C@H]1C=C[C@@H](NCc2c(O)cccc2Cl)C1 2007120729 WVHWAYIBMRUXSN-ZJUUUORDSA-N 253.729 2.479 10 10 CECE CCn1cncc1CN(C)c1ccc([C@H](C)N)c(O)c1 2153011503 NTDPCRYHXRRTIR-NSHDSACASA-N 274.368 2.265 10 10 CECE C[C@@]1(CO)CCN1c1c(F)cc(CNC2CC2)cc1F 2153562742 OXXPEAKWIYOVOU-HNNXBMFYSA-N 282.334 2.178 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CO[C@H]2C[C@@H]1C2 2011804269 AFBOYTBSJZTGRL-JFGNBEQYSA-N 253.729 2.313 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)[C@H]1CCC12CCC2 2154894910 GZGNHGPVZSISCB-KBPBESRZSA-N 271.364 2.407 10 10 CECE CCNC[C@@]1(CN(C)c2ccc(OC)cc2)CCOC1 51253188 RRSWTPPGTLTDSD-MRXNPFEDSA-N 278.396 2.148 10 10 CECE COc1ccc(N(CCCN)[C@H]2CCCC[C@H]2O)cc1 2155617948 ZKCFAFXCHBJRBE-JKSUJKDBSA-N 278.396 2.154 10 10 CECE C[C@H](c1nccs1)N(C)C(=O)COc1ccc(N)cc1 2155699807 SCUYVZQTYPPOQI-SNVBAGLBSA-N 291.376 2.324 10 10 CECE CCn1cnc(NCc2ccc(F)c(F)c2O)c1 2028666430 IDQUNKJLGPIJFT-UHFFFAOYSA-N 253.252 2.499 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3C(CO)[C@H]3C2)cc1Cl 2030271991 DHLGBOVVNGSCDN-ZHAHWJHGSA-N 267.756 2.068 10 10 CECE Cn1ncc2c1CN(c1ccc(CO)cc1Cl)C2 2049483412 PFAJMSIOSBTXIU-UHFFFAOYSA-N 263.728 2.086 10 10 CECE NC(=O)c1cccc(N)c1N[C@H]1CC[C@@]2(C1)CC2(F)F 2156330254 MNRBNJUOYQRQLS-ISVAXAHUSA-N 281.306 2.358 10 10 CECE C[C@H]1CC[C@H](CNC(=O)Cc2ccc(N)cc2)S1 2034236213 TYPHTIHFXUHMKS-GXFFZTMASA-N 264.394 2.212 10 10 CECE CNCc1ccc(N(C)CC2CCN(C)CC2)cc1 63121246 YAXGZJSHEIGREI-UHFFFAOYSA-N 261.413 2.184 10 10 CECE CNC(=O)[C@]1(C)CCN([C@H](C)c2ccc(C)cc2O)C1 300713088 QKWOOBFKTMDXAP-MLGOLLRUSA-N 276.380 2.220 10 10 CECE CN1C[C@H](NCc2cccc(O)c2O)CC12CCCC2 2156738312 KTFBOEQNZOXZOJ-CYBMUJFWSA-N 276.380 2.204 10 10 CECE Cc1n[nH]c(C)c1C=C1SC(N2CCCCC2)=NC1=O 2041514354 ANVFRVGUONIAHZ-UHFFFAOYSA-N 290.392 2.483 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)C[C@H]1COC(C)(C)C1 2041480780 ZUEWIEIIKPLJMQ-SNVBAGLBSA-N 254.334 2.350 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)CC[C@H]1CCOC1 401566252 PTUCZXHUQYQPAH-ZDUSSCGKSA-N 262.353 2.044 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)CCC2CCC2)C1 403653463 IUDHYLNHZYMNFV-NSHDSACASA-N 272.374 2.281 10 10 CECE CNCc1cc(F)c(N(C)C[C@H](C)OC)c(F)c1 310967377 VCPHUMSFBJEVOD-VIFPVBQESA-N 258.312 2.155 10 10 CECE C[C@@H](O)c1ccc(N2CCC(N3CCC3)CC2)cc1 700381935 QIMMGBWZHLKFJB-CYBMUJFWSA-N 260.381 2.414 10 10 CECE CC[C@@H]1CN(c2ccc([C@H](C)O)c(O)c2)C[C@H]1N(C)C 2170522830 FGTSLLXCXSFQHL-YWPYICTPSA-N 278.396 2.222 10 10 CECE CC(C)c1nc(CNCc2ccc(O)c(O)c2O)co1 2160569227 DYLMXVATZHVXSS-UHFFFAOYSA-N 278.308 2.205 10 10 CECE CCc1nccn1CCCNCc1c(O)cccc1F 2160769362 AMCTZXGZFXTZER-UHFFFAOYSA-N 277.343 2.470 10 10 CECE CCNCCc1ccccc1CN(C)c1cnn(C)c1 2170775677 OEFUAJUWDFBKMT-UHFFFAOYSA-N 272.396 2.209 10 10 CECE C[C@@H](N[C@H]1C[C@H]2CC[C@@]1(CO)C2)c1cc(O)ccc1O 2161034550 VQHPHHWAZCQARI-XYPYXGAPSA-N 277.364 2.300 10 10 CECE COC(=O)[C@@](C)(NCCCN=[N+]=[N-])c1ccc(O)cc1 90259467 SNVYSPGMPWCYTN-ZDUSSCGKSA-N 278.312 2.070 10 10 CECE CN(Cc1cccn1C)c1cc2c(cc1N)OCCO2 2171001242 UQFUYVZBEXHXIY-UHFFFAOYSA-N 273.336 2.015 10 10 CECE CCNCc1ccc(N2CC[C@@H](N3CCC3)C2)cc1 702246375 XJAWWRXXQJHWQG-MRXNPFEDSA-N 259.397 2.081 10 10 CECE CCN(c1ccc([C@@H](C)O)cc1)[C@H]1CCCCNC1=O 2171240848 FFDPQHNKOAOXDN-DOMZBBRYSA-N 276.380 2.235 10 10 CECE COc1cc(Cl)cc(CNC[C@@]23COC[C@H]2C3)c1O 689222673 JRADNFSVWGYUCJ-YGRLFVJLSA-N 283.755 2.180 10 10 CECE CC(C)[C@H]1CN(C(=O)COc2ccc(N)cc2)CCS1 707259627 BRIJCUSQUBKCKO-CQSZACIVSA-N 294.420 2.248 10 10 CECE COC(C)(CCN[C@@H](C)c1ccccc1O)OC 710928659 WKIVQVJMJPUVOR-NSHDSACASA-N 253.342 2.442 10 10 CECE CNCc1ccc(N(CC(C)(C)O)C(C)C)cc1 690024274 WSPUSFWSBXTRPH-UHFFFAOYSA-N 250.386 2.392 10 10 CECE N[C@H]1CN(c2ccc3c(c2)CCCO3)C[C@H]1C(F)(F)F 2162671244 PVGDXOMBPSHWIR-NEPJUHHUSA-N 286.297 2.337 10 10 CECE CCc1cccc(CN[C@@H]2CCC2(OC)OC)c1O 711462794 WSPUGPCDIJNSAJ-CYBMUJFWSA-N 265.353 2.196 10 10 CECE Cc1cc(N2C[C@H]3C[C@H]2C[C@@H]3O)ccc1CNC1CC1 2172097178 HRCJKFVCGJJDIS-COXVUDFISA-N 272.392 2.207 10 10 CECE CCCN1CC(N[C@H](C)c2ccc(N(C)C)cc2)C1 381085333 XOTNTYANHYQYDD-CYBMUJFWSA-N 261.413 2.497 10 10 CECE CN1CCCc2cc([C@@H](O)c3ncccc3N)ccc21 2163102772 NRPLYSMPQPINOH-MRXNPFEDSA-N 269.348 2.128 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 382127497 NYTWCJLOYDYAIH-SLEUVZQESA-N 274.364 2.295 10 10 CECE CS[C@@H]1CCCN(c2cc3c(cc2N)OCCO3)C1 382968841 QOMFUDYUXGIZRS-SNVBAGLBSA-N 280.393 2.372 10 10 CECE COc1cc(Cl)cc(CN2CCNC[C@H](C)C2)c1O 385269691 PIKKAVBJRXSVTH-JTQLQIEISA-N 284.787 2.096 10 10 CECE Cc1cc(N2CCS[C@@H](CO)C2)ccc1CNC(C)C 719992954 LDJROHFYCPVRJL-MRXNPFEDSA-N 294.464 2.407 10 10 CECE CCN[C@H](C)c1ccc(N2CCS[C@@H](CO)C2)c(F)c1 720041948 AIKNTQMXWOFWKD-DGCLKSJQSA-N 298.427 2.410 10 10 CECE CNCCN(C(C)C)[C@H](C)c1c(O)cccc1O 720797626 FHNUWPLDJRDFCY-LLVKDONJSA-N 252.358 2.089 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@H]2CCC[C@H]3CC[C@H]32)cc1 2172412770 QKZGSLMXQOUVOA-NWANDNLSSA-N 294.420 2.267 10 10 CECE COc1cccc(C(=O)NCc2ccc(N)cc2)c1F 397424369 QSMSPUTXKVDCJU-UHFFFAOYSA-N 274.295 2.347 10 10 CECE C[C@@H]1CC[C@H](CNCc2ccc3c(c2)CCN3C)O1 398122493 RQSODWXFHLXOHN-IUODEOHRSA-N 260.381 2.336 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 2172977952 GNPJFXSGKNRDPU-RXGFPQBGSA-N 273.332 2.214 10 10 CECE CN1C[C@H]2CN(c3cc(Cl)c(CN)cc3F)C[C@]2(C)C1 2177380090 BUPAJFRLBWXZNJ-NHYWBVRUSA-N 297.805 2.326 10 10 CECE Nc1ccc(CCC(=O)NCC[C@H]2CCCOC2)cc1 2177547996 CIXLTNJXEQHALC-CQSZACIVSA-N 276.380 2.134 10 10 CECE COc1ccc(N(C)[C@H](CN)C2(C)CCOCC2)cc1 2173993197 ALSJDXSCAYTISF-OAHLLOKOSA-N 278.396 2.275 10 10 CECE CCCNCc1ccc(N2CC[C@H]3[C@@H]2C[C@H]3O)cc1C 2178158171 ALUURWGLEQEHNP-YESZJQIVSA-N 274.408 2.454 10 10 CECE CCc1cc(CNC)n(Cc2cccc(C)c2O)n1 2070165421 RCIRCQJDZCRCNY-UHFFFAOYSA-N 259.353 2.227 10 10 CECE Cc1cc(N2CCN(C)[C@H]3C[C@@H]32)ccc1CNC1CC1 2168367250 ZDKVANAFHAGBLN-IRXDYDNUSA-N 271.408 2.140 10 10 CECE CCCN(CC(=O)c1ccc(O)c(O)c1)[C@H]1CCSC1 2170128830 BOCOPJIJQWHZQX-LBPRGKRZSA-N 295.404 2.498 10 10 CECE CC[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@H]1N(C)C 2170467016 LBOCVBUQUPKVOQ-IINYFYTJSA-N 284.350 2.442 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2C[C@@H]1COC(=O)C1 2187686355 FPZZJWUCKOBPOS-VXGBXAGGSA-N 274.364 2.022 10 10 CECE CNCc1ccc(N(C)[C@H]2CCN3CC[C@H]2C3)cc1C 2192732623 FSLIFCQSPWSEJE-RDJZCZTQSA-N 273.424 2.245 10 10 CECE CCCO[C@@H]1CCN(c2ccc(CO)c([N+](=O)[O-])c2)C1 2188575030 WRCQDXSNWFNUPZ-CYBMUJFWSA-N 280.324 2.092 10 10 CECE CCS[C@H]1CCCN(C(=O)c2cc(O)c(O)c(O)c2)C1 2188875330 PUDUPOFFGZBXKQ-JTQLQIEISA-N 297.376 2.161 10 10 CECE O[C@H]1CCCc2cc(N3C[C@H]4C[C@H]3CC[C@@H]4O)ccc21 2184688174 XJXCEWOEPNXMKH-IRWJRLHMSA-N 273.376 2.406 10 10 CECE COc1cccc(O)c1CN1CC[C@H](OC)[C@H]1C 2042571331 QBFWGJBQWOFQSO-MFKMUULPSA-N 251.326 2.010 10 10 CECE CN1CCC[C@@H](NCc2c(O)cccc2F)CC1 2042598350 YQKUWLAKIJKPGV-LLVKDONJSA-N 252.333 2.105 10 10 CECE Nc1ccc(CCS(=O)(=O)CCCOC2CCC2)cc1 2184720412 YYXCECBMFQDPIM-UHFFFAOYSA-N 297.420 2.185 10 10 CECE O[C@@H]1CC[C@@H]2[C@H](CCN2c2ccc3c(c2)CC[C@H]3O)C1 2184730109 RGRNCLKCUMCARY-ODVANORSSA-N 273.376 2.406 10 10 CECE CC(C)[C@H]([C@@H](C)N)[C@@H](O)c1ccc(N(C)C)cc1 2044702878 OZGFFDDYLSJAKD-DFBGVHRSSA-N 250.386 2.405 10 10 CECE CO[C@H]1CC(N(C)CCCCN=[N+]=[N-])C[C@@H]1OC 2047400290 KBXNIGKAYYHUQX-RYUDHWBXSA-N 256.350 2.201 10 10 CECE CN(CCCC(F)F)C(=O)c1ccc(O)c(O)c1 2047787188 RUVSKCYNLXZBDY-UHFFFAOYSA-N 259.252 2.215 10 10 CECE C[C@H](NCc1c(O)cccc1F)[C@@H]1CCC[C@H]1O 2048884151 BBVRNZMLDAYHIP-OUJBWJOFSA-N 253.317 2.170 10 10 CECE C[C@H](N)c1cc(F)c(N2CC3(CC3)C[C@@H]2CO)c(F)c1 2194695989 ZKBURDDUGJCKAS-GXSJLCMTSA-N 282.334 2.336 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)Cc2ccnn2C)c(F)c1 2194708290 IWUOBNMJSYGQAP-SECBINFHSA-N 280.322 2.354 10 10 CECE CC(C)[C@@]1(C)CCN1C[C@@H](O)COc1ccc(N)cc1 2191204675 DBVAZYNCIVLBLA-GDBMZVCRSA-N 278.396 2.129 10 10 CECE Cc1nccn1[C@H](C)CNCc1ccc2c(c1)CCO2 2186049920 DPQSBBDDMBKRBG-GFCCVEGCSA-N 271.364 2.477 10 10 CECE CN(C[C@@H]1CCCCN1C)c1ccc(CN)c(F)c1F 2186173691 PNVOUQLZFYKPBP-LBPRGKRZSA-N 283.366 2.344 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2CCO)cc1 2191502914 JSCXSGIBSUWPGG-BXUZGUMPSA-N 277.368 2.332 10 10 CECE CC[C@H](N)Cc1ccc(N2CC[C@@H]3COC[C@H]32)cc1C 2198555408 NVZMCIXDVIGWKT-HLLBOEOZSA-N 274.408 2.500 10 10 CECE Nc1ccc(CCNC(=O)c2ccc(N)c(Cl)c2)cc1 2191748941 BKYOIIUXOJYKJS-UHFFFAOYSA-N 289.766 2.477 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1cccc(N)c1F 2191712522 QSPOMZWVEDYIDU-UHFFFAOYSA-N 273.311 2.262 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3COC[C@@H]32)c(Cl)c1 2066309779 ODJXYKYRNFUTST-UDZFHETQSA-N 266.772 2.455 10 10 CECE C[C@@H](CN1CC[C@@H](CN=[N+]=[N-])C1)N1CCCCC1 2068423169 DYZTVTUTYHLCLI-STQMWFEESA-N 251.378 2.493 10 10 CECE Oc1c(CNCC2CC3(CC[C@H]3O)C2)ccc(F)c1F 2195364291 SSFYMZIQAAXHEV-YAKODHLKSA-N 283.318 2.311 10 10 CECE CCC[C@H](COC)C(=O)N(C)c1ccc(N)cc1 2073153231 CXCKUVBSCIKRRX-LLVKDONJSA-N 250.342 2.294 10 10 CECE Oc1ccc(F)cc1CNC[C@@]12CCOC[C@@H]1C2 2073986149 YOPLSPBKRCNWEF-FZMZJTMJSA-N 251.301 2.048 10 10 CECE Oc1ccc(F)cc1CNCc1noc(C(F)(F)F)n1 2199443979 KCWQGDPYZYJQGG-UHFFFAOYSA-N 291.204 2.223 10 10 CECE CN(CC[C@H]1CCCO1)c1ccc(CN)c(F)c1F 2101038776 DPNJHAZRNWVQOA-LLVKDONJSA-N 270.323 2.429 10 10 CECE CCC[C@@H](CN)CNCc1ccc2c(c1)CCCO2 2104274047 RJINIPHJYDTRKI-AWEZNQCLSA-N 262.397 2.476 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)C[C@@H]2CC=CC[C@@H]2C1 2104206118 VRQVGMAVCAQBRW-KOZAUXTDSA-N 259.349 2.499 10 10 CECE CC[C@H]1CC[C@H]1NC(=O)CCOc1ccc(N)cc1 2105654813 SXLWCIICYLOWPW-SMDDNHRTSA-N 262.353 2.343 10 10 CECE CC1(C)C[C@@H](C(=O)O)CN1Cc1cc(F)ccc1O 2105854094 ZCFUIINCQVLIOD-SNVBAGLBSA-N 267.300 2.216 10 10 CECE COc1ccc(N2C[C@@H](CCN)[C@@H](C)C2)cc1OC 2106391070 XEMQQOFHVGEPKV-NWDGAFQWSA-N 264.369 2.125 10 10 CECE C[C@H]1Cc2cc(N(C)[C@@H](CN)C(F)(F)F)ccc2O1 2106388236 GEJIHBGVYYHRRH-UFBFGSQYSA-N 274.286 2.336 10 10 CECE Nc1ccc(NC(=O)NC2([C@@H]3CCCO3)CC2)cc1 2087612659 RADBVULKXXOXRH-LBPRGKRZSA-N 261.325 2.102 10 10 CECE CO[C@@H]1CC[C@H]2CN(c3ccc(CO)cc3C)C[C@H]21 2087916082 VFRGYMUQVHDMTK-SQWLQELKSA-N 261.365 2.349 10 10 CECE CCC[C@H]1CCN1CC(=O)N(C)c1ccc(N)cc1 2088660298 TUDIISOCFKDPQY-AWEZNQCLSA-N 261.369 2.106 10 10 CECE C[C@H](N)c1ccc(N2C[C@]3(C)C[C@]3(CO)C2)c(F)c1 2109162300 OYMWOPOCVUNGMV-NZVBXONLSA-N 264.344 2.054 10 10 CECE C[C@@]1(OCCNCc2cc(Cl)ccc2O)CCOC1 2090067493 XIXGOBVVXHBFRI-CQSZACIVSA-N 285.771 2.331 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(Cc2cnn3c2CCC3)C1 2111482410 CJMTTXLMQXEJNX-LLVKDONJSA-N 260.345 2.352 10 10 CECE COC[C@@H](CCNCc1ccc(O)cc1O)C(C)C 2092766881 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Nc1ccc(CCCN2[C@H]3CC[C@@H]2C[C@@H](O)C3)cc1 2098697309 AVUDPNFMQYNHKU-MUJYYYPQSA-N 260.381 2.189 10 10 CECE CN(C[C@]1(C)CCCN1C)c1ccc(CN)cc1F 2098745733 UTTYFGKHHMTDMH-HNNXBMFYSA-N 265.376 2.205 10 10 CECE CCn1ccc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)n1 2099337585 XQDBRLCNTHBLCN-SNVBAGLBSA-N 262.317 2.208 10 10 CECE CC(C)Cn1cc([C@@H](O)Cc2ccc(N)cc2)cn1 2099778198 LZAWCPSADOLHJW-HNNXBMFYSA-N 259.353 2.397 10 10 CECE CCC1(N(C)CCC(=O)Nc2ccc(N)cc2)CC1 2112841288 SJTVKEWNFSTINY-UHFFFAOYSA-N 261.369 2.472 10 10 CECE Nc1ccc(CCN2CC[C@H](O)CC23CCC3)cc1 2113560415 BLTZNYUIDHJWLG-HNNXBMFYSA-N 260.381 2.191 10 10 CECE CCN(C)C[C@@H]1CCCN(Cc2ccc(N)cc2)C1 2114042146 DACDBZQDVANUTC-HNNXBMFYSA-N 261.413 2.433 10 10 CECE CCCOc1cc(N2CC[C@H]3C[C@]3(O)C2)ccc1N 2114561155 VIEHLYBWFRWGAX-NHYWBVRUSA-N 262.353 2.019 10 10 CECE Cc1cccc(CN2CCOc3ncccc32)c1O 2114747064 YSTNJYWOUGOURP-UHFFFAOYSA-N 256.305 2.495 10 10 CECE C[C@H]1CN(c2cc(Cl)c(CN)cc2F)CC[C@@H]1CO 2120885754 SVBJNAHGXLHPSH-VHSXEESVSA-N 286.778 2.393 10 10 CECE N[C@@H]1C[C@]12C[C@@H]2[C@H](O)c1ccc(N2CCCC2)cc1 2268054112 BFBLTCKCCDWIMG-FPCVCCKLSA-N 258.365 2.058 10 10 CECE COc1cc(N2CCO[C@@H]3CCCC[C@H]32)ccc1CO 2204544300 ZNZMLHPPRRUMBD-HUUCEWRRSA-N 277.364 2.335 10 10 CECE CCCN(CCO)c1ccc(CNC(C)C)c(OC)c1 2204552725 FYYABRVNVZRUFM-UHFFFAOYSA-N 280.412 2.402 10 10 CECE COc1cc(N(C)Cc2ccccc2O)ccc1CN 2204555180 WMSMCUYTZGPFNB-UHFFFAOYSA-N 272.348 2.496 10 10 CECE CO[C@H](C[S@](=O)CCOc1ccc(N)cc1)C(C)C 2268688908 VZGBYHVQVQJVBD-AUUYWEPGSA-N 285.409 2.067 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@@]2(C)CCO)cc1O 2205508555 CFICIDKNGRAMTN-LRDDRELGSA-N 278.396 2.414 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NS(=O)(=O)[C@H]1CCC[C@H]1F 2218735636 QFGBXRSOLKXNGF-IMSYWVGJSA-N 276.337 2.028 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H](O)C[C@@H](F)C2)cc1 2219183906 RNHHBLXGBWQHIS-MRVWCRGKSA-N 253.317 2.039 10 10 CECE COc1ccc(N(C)C[C@@H](C)C(F)F)c(CN)c1 2220418700 CTDBZOYBKGWUOS-SECBINFHSA-N 258.312 2.491 10 10 CECE CO[C@]12CC[C@H]1CN(c1ccc([C@H](C)N)cc1F)C2 2230468387 LZSWRYFLDZZFBK-WBIUFABUSA-N 264.344 2.461 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC[C@H](CO)C2)cc1 2231474587 RUXRDHPKWHWWNS-HIFRSBDPSA-N 262.397 2.393 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](O)C[C@@H](F)C2)c(C)c1 2232093303 FHXHVZLTECOEKY-MRVWCRGKSA-N 266.360 2.185 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](OC)[C@H](F)C2)c(C)c1 2232093850 LKVJMQJYPPHXMN-KYOSRNDESA-N 266.360 2.449 10 10 CECE CCN(C(=O)[C@@H]1OC[C@H]2CCC[C@@H]21)c1ccc(N)cc1 2233172076 FXYZQUKKLSZBBI-BYCMXARLSA-N 274.364 2.437 10 10 CECE Cc1ccc(CN(C)c2ccc(=O)n(C)c2)c(O)c1 2224996849 FIIDGBOYHQSZMP-UHFFFAOYSA-N 258.321 2.036 10 10 CECE COc1cc(N2CC[C@@H](O)C[C@H]2C)cc(OC)c1OC 2235140648 KTZCALQIBHSEHW-ZYHUDNBSSA-N 281.352 2.062 10 10 CECE C[C@H](NC(=O)[C@]1(N)CCCC12CC2)c1ccccc1O 2235390675 LYPAXHJQRPPBSQ-MEDUHNTESA-N 274.364 2.231 10 10 CECE CCC(CC)(CC(=O)N1CC[C@H](N=[N+]=[N-])C1)C(=O)O 2225795241 MDXLFLFMWAELQS-VIFPVBQESA-N 268.317 2.179 10 10 CECE CCN1CCC[C@H]1CN(C)c1ccc(OC)cc1CN 2235966304 QQCSDVHQEKWAHB-AWEZNQCLSA-N 277.412 2.074 10 10 CECE COc1ccc(N2CCCN3CCC[C@@H]3C2)c(C=O)c1 2235992141 KKXNJVVILUQNLC-CQSZACIVSA-N 274.364 2.182 10 10 CECE C[C@H](NC[C@H]1COC2CC1C2)c1ccc(O)cc1O 2226353222 AWYGPYSFVUPEAM-URAGZPLESA-N 263.337 2.173 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H]3C2)c(C=CC(=O)O)c1 2227671236 AGIJBORRRKYHKS-RYUDHWBXSA-N 259.305 2.249 10 10 CECE COc1ccc(N2C[C@H](F)[C@@H](F)C2)c(C[C@H](C)N)c1 2227686593 UGKUPEFZNDKTQK-XDTLVQLUSA-N 270.323 2.081 10 10 CECE CO[C@H]1CC[C@H]1CN1CCCc2cc(CN)ccc21 2227837705 KCXQSOLZAGQMJW-HOCLYGCPSA-N 260.381 2.323 10 10 CECE C[C@H](NCC1(F)CCOCC1)c1ccc(O)cc1O 2229930656 VYBRZYRFSKOLRT-JTQLQIEISA-N 269.316 2.267 10 10 CECE C[C@H]1[C@H](O)CN1c1c(F)cc(CNC2CCC2)cc1F 2240036700 ZTLMZXWBOQSQFM-LKFCYVNXSA-N 282.334 2.176 10 10 CECE Nc1ccc(OCC[S@](=O)[C@H]2C[C@@H]3C[C@@H]3C2)cc1 2257853098 CMJNXMAOWYDUHR-WZTYKQCMSA-N 265.378 2.195 10 10 CECE COc1cc(OC)c(N2C[C@@H](O)[C@H](C)C2)cc1Cl 2258078153 FDVJPERZNDZUTM-LDYMZIIASA-N 271.744 2.174 10 10 CECE Nc1ccc(N2CCC(CO)(C(F)F)CC2)cc1 2261095876 XHCGRNZFTWPLIN-UHFFFAOYSA-N 256.296 2.113 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@]1(C)CC1(C)C 2272960213 KEPIHGZGNNNLLS-SWLSCSKDSA-N 260.337 2.297 10 10 CECE OC[C@H]1CN(c2ccc(OCF)cc2)CC12CC2 2263943038 WRZQTHHDCMFILK-LLVKDONJSA-N 251.301 2.201 10 10 CECE CC(C)NCc1ccc(N2CC[C@]3(O)C[C@H]3C2)cc1 2265256595 BFHXIZGEIKIHCQ-HOCLYGCPSA-N 260.381 2.146 10 10 CECE OCC1(CNCc2cc(F)ccc2O)CC(F)(F)C1 2266922661 CKPUQHNGTBXQAG-UHFFFAOYSA-N 275.270 2.029 10 10 CECE Cc1cc(N(C)Cc2cccnn2)ccc1[C@@H](C)N 2269660393 KSWXRRSJKXHBSY-GFCCVEGCSA-N 256.353 2.441 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](CCO)C2)cc1C 2269665906 KYBSCAKAGJGSLM-UONOGXRCSA-N 262.397 2.484 10 10 CECE Cc1cc(N2CC[C@]3(O)C[C@@H]3C2)ccc1CNC(C)C 2280020764 LUTCJWVAUKKPAS-WBVHZDCISA-N 274.408 2.454 10 10 CECE Cc1cc(N2CCS(=O)(=O)[C@H](C)[C@H]2C)ccc1[C@H](C)N 2285131317 NCDPRSHLCDQKTG-YNEHKIRRSA-N 296.436 2.027 10 10 CECE O[C@H](c1ccc(N2CCNCC2)cc1)[C@H]1C[C@@H]2C[C@@H]2C1 2286070851 FVXXEPDLXIEBOT-JYYAWHABSA-N 272.392 2.176 10 10 CECE CC[C@]1(C)C[C@@H]1NCc1ccc(N2CCNCC2)cc1 2286069015 WNGYZOLDPLJMNS-DLBZAZTESA-N 273.424 2.374 10 10 CECE CCc1nsc(CN(C)c2ccc([C@@H](C)N)c(O)c2)n1 2288837915 VOJJJKSERCUSCY-SECBINFHSA-N 292.408 2.462 10 10 CECE Cc1cc(N(C)Cc2ccnnc2C)ccc1CCN 2290055113 RUCHRXYYNCMXQY-UHFFFAOYSA-N 270.380 2.231 10 10 CECE CC[C@@]1(C)NCC[C@H]1NCc1cnc(SC)s1 2299979507 FUOGHAGWOULALF-ZYHUDNBSSA-N 271.455 2.485 10 10 CECE Cn1cnc(Br)c1[C@@H](O)Cc1ccc(N)cc1 2300216645 GGCYSRZPGXSZCZ-JTQLQIEISA-N 296.168 2.041 10 10 CECE C[C@@H]1CNCC[C@](Sc2nccs2)(C(=O)O)C1 2306963360 YOTQUPNKUUBUBM-GZMMTYOYSA-N 272.395 2.078 10 10 CECE N[C@H]1CCCCC[C@@]1(Sc1nccs1)C(=O)O 2307034292 KQSRLLVYLBMPND-KWQFWETISA-N 272.395 2.350 10 10 CECE CCOC(=O)C=C(C)CN1CC[C@H](CN=[N+]=[N-])C1 2314132229 FMIRYBGWRQWPSD-LLVKDONJSA-N 252.318 2.128 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCOC[C@@H](F)C1 2315067877 MYXHQTWCDGWPFE-AAEUAGOBSA-N 252.333 2.189 10 10 CECE Cc1nn(C)cc1[C@@](C)(Sc1nccs1)C(=O)O 2326903522 KDIUDBBOCSKXKD-LLVKDONJSA-N 283.378 2.277 10 10 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CN(Cc1ccccc1O)C(=O)[C@@H]1COC(C)(C)C1 1968857272 KAJQBUQCOIPVQN-LBPRGKRZSA-N 263.337 2.166 10 10 CECE C[C@H](c1ccccc1O)N1CCN(CC(F)F)CC1 1923100894 BAROISDKTCHTJN-LLVKDONJSA-N 270.323 2.336 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N(O)CCC(=O)O 2136391488 XGXSQQAQFMGOFQ-UWVGGRQHSA-N 265.309 2.415 10 10 CECE NC[C@]12CC[C@@H]1CN(c1ccc(OC3CC3)cc1)C2 2136678213 KKHBTASKPQSCTM-WBMJQRKESA-N 258.365 2.403 10 10 CECE CC[C@@H]1C[C@@]1(N)C(=O)N(C)[C@@H](C)c1ccccc1O 2141314391 XWRBGJLQIGEJOH-RWSFTLGLSA-N 262.353 2.039 10 10 CECE COC[C@H]1CC[C@@H](NCc2c(O)cccc2F)C1 1967706035 CXJAZETVPHYVPX-WDEREUQCSA-N 253.317 2.436 10 10 CECE NC[C@]12CCC[C@@H]1CCN2Cc1ccc(F)cc1O 2139772252 MHVPABXRDHEARL-IUODEOHRSA-N 264.344 2.235 10 10 CECE CCc1cnc(CNCc2cc(OC)ccc2O)o1 234231383 KPSYKAIIBPWOMW-UHFFFAOYSA-N 262.309 2.241 10 10 CECE c1ccc2c(c1)N=S=C2c1nc(C2CCNCC2)no1 1967994517 ATIRKAIVSSDRPS-UHFFFAOYSA-N 286.360 2.017 10 10 CECE CNCc1ccc(N(C)C[C@H]2[C@H]3COCC[C@@H]32)cc1C 2150193122 AMIKKOGWMNZGND-ZACQAIPSSA-N 274.408 2.433 10 10 CECE C[C@@H](N)[C@H]1CCN(Cc2ccc(Cl)cc2O)C1 1942497367 KKVNIAADMYMKBP-ZJUUUORDSA-N 254.761 2.215 10 10 CECE NCc1ccc(N2CCC[C@@H]2CCCO)c(F)c1F 236217707 GICFMFYWODAUID-LLVKDONJSA-N 270.323 2.165 10 10 CECE Nc1ccc(NC(=O)NCCCc2cccnc2)cc1 2150834620 JWNAWYGVPNOCPY-UHFFFAOYSA-N 270.336 2.418 10 10 CECE COC[C@H]1CC[C@@H]1N(C)c1ccc(CN)c(F)c1F 2142421044 KZNVMIXFZRVTKS-MNOVXSKESA-N 270.323 2.285 10 10 CECE C[C@@H]1C[C@H](CO)CN1c1ccc(CN)c(Br)c1 1950536841 RFTUCMOAJYCIEH-ZJUUUORDSA-N 299.212 2.115 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)cc1 1970699786 BNMNXRNZVOIIHZ-AEGPPILISA-N 274.364 2.190 10 10 CECE OC[C@@H]1CCC[C@H](NCc2c(O)cccc2F)C1 1970883620 RDQWOFPPQQEACE-MNOVXSKESA-N 253.317 2.172 10 10 CECE CO[C@H]1CCC[C@@H](C(=O)N(C)c2ccc(N)cc2)C1 1971392274 XSTRBPGBEAHMFL-RISCZKNCSA-N 262.353 2.437 10 10 CECE CN(CCN1CCSCC1)Cc1ccc(N(C)C)cc1 2143420364 SRUSMPPNCMXONI-UHFFFAOYSA-N 293.480 2.233 10 10 CECE O=C(O)[C@@H]1CN(Cc2c(O)cccc2F)C2(CCC2)C1 1974192242 GKKXCYJVAVJFRG-JTQLQIEISA-N 279.311 2.361 10 10 CECE COC(=O)[C@H](NCc1ccc2c(c1)CCCO2)C(C)C 2143826430 SQMDJQYEXRCFIJ-OAHLLOKOSA-N 277.364 2.299 10 10 CECE C[C@H](NCc1csc(N(C)C)n1)c1c(O)cccc1O 2149566762 CFFUJGLOACHPNC-VIFPVBQESA-N 293.392 2.471 10 10 CECE Nc1ccc(CNC(=O)c2ccc3[nH]cnc3c2)cc1 159400614 BVMFROFLGCFTDO-UHFFFAOYSA-N 266.304 2.075 10 10 CECE CO[C@@H]1CN(c2ccc(C=CC(=O)O)cc2)CC12CC2 2149730812 ABBJXZDHFNXOLH-CQSZACIVSA-N 273.332 2.400 10 10 CECE CNCCN(CC(F)(F)F)[C@@H](C)c1c(O)cccc1O 2145388936 UFMZVXGIEKURPA-VIFPVBQESA-N 292.301 2.243 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@@H](C3CNC3)C2)c1 2149894234 IVWOPKOMSVPDRZ-NWDGAFQWSA-N 276.380 2.003 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@H]2CC[C@@]21CN 2145598614 HMMSANDCBFNEPK-BFQNTYOBSA-N 276.380 2.362 10 10 CECE Nc1ccc(OC[C@H](O)CSC[C@H]2CCCOC2)cc1 2145508407 JSNUDLSJDYUHLO-JSGCOSHPSA-N 297.420 2.168 10 10 CECE Nc1ccc(OCC(=O)NCCc2cccs2)cc1 38055494 FFXWBFXMUXYSFH-UHFFFAOYSA-N 276.361 2.068 10 10 CECE COc1ccc([C@H](C)NCc2ccnc(C)n2)c(O)c1 38037523 PNOLCWAICKTUKJ-JTQLQIEISA-N 273.336 2.350 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3C[C@H]4CC[C@@]3(C)C4)ccc21 2145894942 ATVGMBKGLJFIBW-JJMVLAAESA-N 271.364 2.278 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@@H](C)[C@@H](CN)C2)c1 163411252 ACUWEXAGYYAOFM-AGIUHOORSA-N 278.396 2.379 10 10 CECE Cc1cnc(Sc2ncc([C@@H](C)N)s2)nc1O 1997408785 WJAWBJAIYUJYRW-ZCFIWIBFSA-N 268.367 2.118 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2CCC[C@@H]2C2CC2)cc1 2150073390 RTFOXYBDRPACJP-CABCVRRESA-N 274.364 2.343 10 10 CECE C[C@@H](N)c1ccc(N2CCCCC2(CO)CO)cc1Cl 2146070999 BFAQNROXEYYJBE-LLVKDONJSA-N 298.814 2.073 10 10 CECE CC[C@H](O)c1ccc(N(C)C[C@@H]2CCS(=O)(=O)C2)cc1 2148780362 YDLCOOLTWJEZHD-WFASDCNBSA-N 297.420 2.001 10 10 CECE COc1ccc(O)c(CNC2CC([C@H]3CCOC3)C2)c1 2151170326 BVDGAPTXQZMDDA-DCBWTQNWSA-N 277.364 2.306 10 10 CECE Nc1ccc(OCCC(=O)N2CCS[C@H]3CC[C@@H]32)cc1 2152188983 KSRODPQYWSSDFZ-KBPBESRZSA-N 292.404 2.144 10 10 CECE C[C@H]1CN(c2cc(Cl)c(CN)cc2F)CCO1 2008206939 QCPQVTVUNRYHIR-QMMMGPOBSA-N 258.724 2.163 10 10 CECE Cc1scnc1CNC(=O)CCOc1ccc(N)cc1 2152812376 GVHMIVWMZIKEQX-UHFFFAOYSA-N 291.376 2.119 10 10 CECE C[C@H](O)c1ccc(N(C)C2(CO)CC2)c(Cl)c1 2012612757 FRMHRKOGPVHKQN-VIFPVBQESA-N 255.745 2.354 10 10 CECE COc1ccc(N2C[C@H](F)C[C@H]2CN)cc1Cl 2024012233 DXEZHFPWYQQKIG-SCZZXKLOSA-N 258.724 2.224 10 10 CECE Cc1nn(C)c(C)c1CNCc1ccc(F)cc1O 294194578 KMOQPNWORFEIFQ-UHFFFAOYSA-N 263.316 2.171 10 10 CECE Oc1ccc(Cl)cc1CN1CCC[C@H]2NCC[C@H]21 2027166442 IKMWRWJPXRPRIL-CHWSQXEVSA-N 266.772 2.372 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CCCC[C@@H]3C)ccc21 57579818 QSVOBARVCRGWTE-IINYFYTJSA-N 259.353 2.278 10 10 CECE CN(c1ccc(CN)cc1F)[C@H]1CCCOCC1 2028790836 JHSQMSXMKYPXGM-LBPRGKRZSA-N 252.333 2.290 10 10 CECE COc1ccc(N(C)[C@@H]2CCCOCC2)c(N)c1 2028800606 OYEPOXIQHCSBKH-LLVKDONJSA-N 250.342 2.283 10 10 CECE C[C@H]1CN(C)CC[C@H]1NCc1ccc(Cl)cc1O 2029657863 SYDUUWQDKXINGT-GXFFZTMASA-N 268.788 2.475 10 10 CECE CN(C)c1ncc(CNCc2ccc(N)cc2)s1 2032243708 YYBCIKDEUISTPX-UHFFFAOYSA-N 262.382 2.081 10 10 CECE N[C@@H]1CN(Cc2c(O)cccc2Cl)[C@]2(CCCOC2)C1 2156299224 DFGPITAHFQOOCK-XHDPSFHLSA-N 296.798 2.128 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)C(F)(F)C2)cc1Cl 2034595816 SCPJSRJRUXALDD-RDDDGLTNSA-N 277.698 2.210 10 10 CECE Oc1ccc(CN2CCC([C@H]3CCCN3)CC2)cc1O 63197530 WIMWXWFQNLVAAP-CQSZACIVSA-N 276.380 2.062 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CC[C@@H](C)N3)C[C@H]1OC 300176857 IXUFNDULVDBBCO-HFBAOOFYSA-N 276.380 2.283 10 10 CECE C[C@@H](c1ccccc1O)N1CCN(CCF)CC1 402792258 TZUVOPBBXDYWCD-LBPRGKRZSA-N 252.333 2.040 10 10 CECE Cc1cc(CNC(=O)CCOc2ccc(N)cc2)sn1 404385205 IUQGBPPDUIEJRE-UHFFFAOYSA-N 291.376 2.119 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCCOCC1 312058795 BMGYCWUESMCVMC-SNVBAGLBSA-N 264.325 2.036 10 10 CECE CSC[C@H](C)C(=O)Nc1ccnn1-c1ccc(N)cc1 312199726 FLFSDSSWDGTJOG-JTQLQIEISA-N 290.392 2.392 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)c1ncnn1C(C)C 312806262 JKQBEZVZNHYANJ-AWEZNQCLSA-N 273.384 2.234 10 10 CECE O=C(O)[C@@H]1CC[C@@H]2CCN(Cc3ccccc3O)[C@@H]2C1 312906154 KBDSHHJMRNVWOQ-YRGRVCCFSA-N 275.348 2.467 10 10 CECE CN(C[C@H]1C[C@@H]1C(F)F)c1cc2c(cc1N)OCCO2 2159760931 YYEILVIUFUVWGF-BDAKNGLRSA-N 284.306 2.377 10 10 CECE CCCN1CCC(NCc2c(O)cccc2OC)CC1 2160736726 RRVXMCRGCYTGGV-UHFFFAOYSA-N 278.396 2.365 10 10 CECE COc1cccc(O)c1[C@H](NC1CCCCC1)C(=O)O 2160725671 WBWRHFWVXBNRSZ-AWEZNQCLSA-N 279.336 2.449 10 10 CECE Oc1cccc(F)c1CN1CCC[C@]2(CCCNC2)C1 2160791519 ATZBWDSONPYUMZ-INIZCTEOSA-N 278.371 2.497 10 10 CECE COc1cccc(O)c1CNC[C@@]1(O)C[C@H]2CC[C@H]1C2 2160701766 XEPMJGNCTQSKFC-MKBNYLNASA-N 277.364 2.042 10 10 CECE CC(C)[C@@H]1COC[C@H]1NCc1ccc(F)c(F)c1O 703259051 LONBRQOCNKUVOT-CMPLNLGQSA-N 271.307 2.431 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCCC[C@@H]3C3CC3)ccc21 2171641121 GRGCSSDWRSAUPP-HUUCEWRRSA-N 271.364 2.407 10 10 CECE CN(CCCN1CCCC1=O)c1ccc(CN)c(Cl)c1 2171712823 ZLQMOOJFRMMCGL-UHFFFAOYSA-N 295.814 2.247 10 10 CECE COc1cc(N)c(N(C)CCn2cccc2)cc1OC 2171849436 KWAJMZYDVRURJF-UHFFFAOYSA-N 275.352 2.224 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@H](F)[C@@H](CO)C1 2177151052 YITGZYRXBDUZCQ-HIFRSBDPSA-N 278.371 2.014 10 10 CECE C[C@@H](CN(C)c1ccc2c(c1)NC(=O)[C@H]2O)C(C)(F)F 2171904144 RAWJUPRYVRWKNR-UFBFGSQYSA-N 284.306 2.400 10 10 CECE C[C@@H](N[C@@H]1CCc2nccn2C1)c1ccccc1O 367819850 GKQVHQLGYLQGQP-VXGBXAGGSA-N 257.337 2.254 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2CCC[C@@H]2O)c(F)c1 689252946 BMWQVOIWPOZUQJ-NVBFEUDRSA-N 267.344 2.476 10 10 CECE C[C@H](N[C@H]1CCN(C2CCC2)C1=O)c1ccccc1O 708660846 WVJKGPZXCIKFAX-FZMZJTMJSA-N 274.364 2.196 10 10 CECE CC[C@H]1COC[C@H]1N(C)c1ccc(CN)c(F)c1F 688251203 DJZSDDQEUQQEJH-JOYOIKCWSA-N 270.323 2.285 10 10 CECE OCc1ccc(N2CC(O)(C(F)F)C2)cc1C(F)(F)F 2172113173 BXCOIVHCLOGVFO-UHFFFAOYSA-N 297.223 2.014 10 10 CECE C[C@H](NC[C@H]1C[C@@H](O)C12CCC2)c1cc(O)ccc1O 2172242815 FPORKCGAXBXTGT-FIXISWKDSA-N 277.364 2.300 10 10 CECE CC(C)(C)N1CC[C@@H]1CNCc1cccc(F)c1O 690321437 FYLWQJGICZFAHF-GFCCVEGCSA-N 266.360 2.494 10 10 CECE CC[C@@H](NC)c1ccc(N(C)C[C@@H](COC)OC)cc1 691274498 VXJNCRCUKUVQMK-JKSUJKDBSA-N 280.412 2.455 10 10 CECE C[C@H]1CCN(CCC(=O)Nc2ccc(N)cc2)[C@@H]1C 380646176 WACJCZISLWZCJZ-NWDGAFQWSA-N 261.369 2.328 10 10 CECE CO[C@H](CN(C)CCCOc1ccc(N)cc1)C1CC1 692215190 HZCCHYZXIRTNPI-MRXNPFEDSA-N 278.396 2.395 10 10 CECE CN1CCc2cc([C@@H](N)[C@H]3CC34CCOCC4)ccc21 2163140857 ODRQPPSHWMBAON-GDBMZVCRSA-N 272.392 2.495 10 10 CECE Cc1cnc([C@H](O)[C@H](N)c2ccc3c(c2)CCN3C)s1 2163138657 PCABGDIDKVPTDT-ZIAGYGMSSA-N 289.404 2.177 10 10 CECE CCN1CCc2cc([C@H](N)c3cnc(C)nc3)ccc21 2163138307 LSVMHELYVDHGCF-INIZCTEOSA-N 268.364 2.216 10 10 CECE CN1CCc2cc([C@H](N)[C@](C)(O)[C@H]3CCSC3)ccc21 2163139220 WKRYBBWGSNBNQV-CWRNSKLLSA-N 292.448 2.183 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@](O)(CC)COC)cc1 2163157552 DTMALVBQNZVFIS-HOTGVXAUSA-N 280.412 2.320 10 10 CECE CCCOc1cc(N2CC(C)(OC)C2)ccc1N 382628292 XUDWGSJMCNTWCX-UHFFFAOYSA-N 250.342 2.283 10 10 CECE Cc1cccc(CN(C)C[C@@H]2CCCCS2(=O)=O)c1O 694402040 YBQLYFCGZIVXLR-AWEZNQCLSA-N 297.420 2.100 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1C[C@@H](C)O[C@H]1C 384662752 WHZKBSYDQRYPFM-GBIKHYSHSA-N 278.352 2.423 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](O)C[C@H]2C)c(F)c1 384771911 GGTNVFMTEIMSLF-KOLCDFICSA-N 270.323 2.034 10 10 CECE CN(C)[C@H]1[C@@H]2CN(Cc3c(O)cccc3Cl)C[C@@H]21 384807432 URKVUDSJLNNXHN-MSRIBSCDSA-N 266.772 2.037 10 10 CECE CCN(CCC1CC1)CC(=O)c1ccc(O)c(O)c1 385779288 YYKDMDLHTFHALV-UHFFFAOYSA-N 263.337 2.403 10 10 CECE CCCNCc1ccc(N2C[C@H]3C[C@H]2CO3)c(C)c1 387493578 JHVSLYHVLAVNGO-LSDHHAIUSA-N 260.381 2.472 10 10 CECE OCc1ccc(N2CCN3CCC2CC3)c(Cl)c1 722771346 LZQTYOOUUZVHEO-UHFFFAOYSA-N 266.772 2.117 10 10 CECE [N-]=[N+]=NCCCN[C@@H](CC1CCCCCC1)C(N)=O 394530699 JQHWGYLOHJRZRE-LBPRGKRZSA-N 267.377 2.491 10 10 CECE COC[C@@H](N[C@H](C)c1ccc(O)cc1O)C1CC1 397472634 XVDMEIIGRLYRAF-NOZJJQNGSA-N 251.326 2.173 10 10 CECE COc1ccc([C@@H](C)NCC2=CCOCC2)c(O)c1 397767913 SVOGZODRDPZHMF-LLVKDONJSA-N 263.337 2.398 10 10 CECE CN1CCc2cc([C@H](CN)N3C4CCC3CC4)ccc21 399398693 WDYACSLRPFUNCY-DQPZFDDXSA-N 271.408 2.306 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CC(=O)Nc1cccnc1Cl 2179618671 ZLEZUNVBWUZTNC-VIFPVBQESA-N 294.746 2.448 10 10 CECE CN[C@H](C)c1ccc(N(C)CC2[C@@H]3COC[C@@H]23)cc1O 2174643892 OIUMNKXHRFCSEU-ONERCXAPSA-N 276.380 2.001 10 10 CECE COc1ccc(O)c([C@@H](C)n2ncnc2Cl)c1 2070035938 PXTZLPIAOHPCPH-SSDOTTSWSA-N 253.689 2.255 10 10 CECE Cc1cccc([C@@H](C)n2ncc(CN(C)C)c2O)c1O 2070566258 NLNUETOKWARWPY-LLVKDONJSA-N 275.352 2.274 10 10 CECE Cc1ccc(Cn2nc(CO)cc2C(F)(F)F)c(O)c1 2079246163 YFRKQEFJCPXCSQ-UHFFFAOYSA-N 286.253 2.457 10 10 CECE CC[C@@H]1CN(c2ccc(CNC)c(C)c2)C[C@@H]1N(C)C 2170471712 KIMAKZRWXIEVQP-PBHICJAKSA-N 275.440 2.491 10 10 CECE Oc1ccc(CNC[C@@H]2[C@@H]3CCC(F)(F)[C@@H]32)c(O)c1O 2170847489 WFZJUCNBKPXLNK-NGZCFLSTSA-N 285.290 2.184 10 10 CECE C[C@@H](c1ccccc1O)N(C)Cc1cc(=O)c(O)co1 2192601523 ZBEKINQDSWKGAG-JTQLQIEISA-N 275.304 2.244 10 10 CECE CC(C)Cn1cc(CN[C@@H](C)c2ccccc2O)nn1 2192631953 NGOFMWOMYQCPNP-LBPRGKRZSA-N 274.368 2.491 10 10 CECE CCN(C(=O)CN(C)[C@H](C)c1ccccc1O)C1CC1 2192606166 UGMJSQPGELSSBT-GFCCVEGCSA-N 276.380 2.396 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)[C@H](O)CC2(C)C)c(Cl)c1 2188680655 PUILLKFYBDGNEI-OWYVNGRQSA-N 299.798 2.104 10 10 CECE C[C@H]1CC[C@H](c2noc(-c3cc(O)c(O)c(O)c3)n2)O1 2188922787 JDOWITBLPNDOQR-QUBYGPBYSA-N 278.264 2.093 10 10 CECE NCc1ccc(N2C[C@@H]3CCO[C@@H]3C2)c(Cl)c1 1907022509 ZDFPADWGPPWSNG-GXFFZTMASA-N 252.745 2.024 10 10 CECE CC(C)(OC[C@@H](O)COc1ccc(N)cc1)C(F)(F)F 2193592586 IQXNYSQFBKUXDS-JTQLQIEISA-N 293.285 2.366 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@@H]2CCC(=O)NC2)cc1 2183442169 BYMGRTMKAJJGRV-IUODEOHRSA-N 275.396 2.072 10 10 CECE COCCN(c1ccc(CO)cc1[N+](=O)[O-])C1CCC1 2197121955 LQLYZJZXXALAFJ-UHFFFAOYSA-N 280.324 2.092 10 10 CECE COc1ccc(CNC[C@]23C[C@](C)(CCO2)C3)c(O)c1 2193684938 KIZYZARHJDUDFR-IYBDPMFKSA-N 277.364 2.450 10 10 CECE COc1ccc(O)c(CN2CC[C@@H]3CCC[C@]32CN)c1 2197339924 KXUYXFIVYMHSIO-BBRMVZONSA-N 276.380 2.104 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)C3CC4(CC4)C3)ccc21 2184002391 AIRIVKFYYTWLLN-JKSUJKDBSA-N 272.392 2.230 10 10 CECE C[C@H]1CCN(Cc2c(O)cccc2F)[C@@H](CN)C1 2042633087 PELYYGQFGRZAMG-WDEREUQCSA-N 252.333 2.091 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@H](N4CC=CC4)C3)ccc21 2184733862 MDXJJIVYFHDGFY-NVXWUHKLSA-N 270.376 2.117 10 10 CECE CN(C[C@@H]1[C@@H]2CCOC[C@H]21)c1ccc2c(c1)CC[C@H]2N 2184730523 WSZQQLZNLDSMOF-YLFCFFPRSA-N 272.392 2.351 10 10 CECE CN1CCc2cc([C@H](CC(C)(C)F)NN)ccc21 2044756104 HULIBQMCHOBBAZ-LBPRGKRZSA-N 251.349 2.322 10 10 CECE CC[C@](C)(OC)[C@@H](NN)c1ccc(N(C)C)cc1 2044754379 KRDBJZSNRBUPBN-KBPBESRZSA-N 251.374 2.072 10 10 CECE CN1CCc2cc([C@H](N)C[C@@]34CCOC[C@@H]3C4)ccc21 2194486387 MCPCSQSOCQIYIG-UXLLHSPISA-N 272.392 2.495 10 10 CECE CN[C@H](C)c1ccc(N2CCO[C@@H]3C[C@H]32)c(F)c1 2051758717 LYNDJECZBDTYGY-OWYVNGRQSA-N 250.317 2.084 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCC[C@@H]2CC[C@@H]21 2052301250 YARUROGNTXUKKI-SCVCMEIPSA-N 252.318 2.008 10 10 CECE Nc1ccc(OCCOC[C@@H]2CCCOC2)cc1 2052510847 RVNHIJWOHXLLCF-GFCCVEGCSA-N 251.326 2.091 10 10 CECE CN1CCc2cc(CN[C@H]3C[C@]34CCCOC4)ccc21 2198315297 BCEDCTBGNRDXST-IRXDYDNUSA-N 272.392 2.338 10 10 CECE CO[C@H](C)CCN(C)c1ccc([C@H](C)O)c(O)c1 2059358980 JPOIPSWZSZJFCS-MNOVXSKESA-N 253.342 2.307 10 10 CECE C[S@](=O)CC1(C)CN(c2ccc3c(c2)CCC[C@@H]3O)C1 2186351892 OPAMDHWXPURFGQ-YWZLYKJASA-N 293.432 2.261 10 10 CECE C[C@@H]1Cc2cc(N3CCN[C@H](C(F)(F)F)C3)ccc2O1 2186682835 RXALWULAODBJFA-RNCFNFMXSA-N 286.297 2.351 10 10 CECE C[C@@H](O)c1ccc(N2CCOC[C@@H]2CF)c(F)c1 2062386403 MHIGEROQEXDDBA-KOLCDFICSA-N 257.280 2.054 10 10 CECE Nc1ccc(CCOc2cccc(C(=O)O)c2N)cc1 2199009546 ICUCWGRPMRNKJP-UHFFFAOYSA-N 272.304 2.171 10 10 CECE C[C@H](NS(=O)(=O)C[C@@H]1C[C@H]1C)c1ccccc1O 2072485971 JPQXGYMGIIRWRA-VWYCJHECSA-N 269.366 2.029 10 10 CECE Cc1cc(=NCc2ccc(N(C)C)cc2)[nH]cc1N 2104182917 JFRUZBOHLLCWNB-UHFFFAOYSA-N 256.353 2.072 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@H](CN3)C2)cc1Cl 2104350969 IDCHMXWNWGQUAJ-ZJUUUORDSA-N 282.771 2.155 10 10 CECE CNCCC1CCN(Cc2c(O)cccc2F)CC1 2104510273 FDPPPZQBMIAKDH-UHFFFAOYSA-N 266.360 2.353 10 10 CECE Oc1cccc(F)c1CN1CCC[C@@H]1[C@@H]1CCCN1 2104510605 JSLIXKQWTPUXKC-UONOGXRCSA-N 264.344 2.248 10 10 CECE COc1ccc(N2C[C@@H](N)[C@@H](C(F)(F)F)C2)c(C)c1 2106390821 USBVKFDUYROMSC-WDEREUQCSA-N 274.286 2.329 10 10 CECE NC[C@H]1C[C@H](F)CN1c1ccc(OC(F)(F)F)cc1 2106354559 TUEZGJWQTIAKEJ-WCBMZHEXSA-N 278.249 2.461 10 10 CECE CN1CCc2cc([C@@H](N)CN3CCCCC3)ccc21 2106798097 HMAWBDQVYKKORX-HNNXBMFYSA-N 259.397 2.165 10 10 CECE CN1CCc2cc([C@@H](O)c3cnn(C)c3Cl)ccc21 2106793869 RICLZVFAGWDQGC-CYBMUJFWSA-N 277.755 2.148 10 10 CECE CN1CCc2cc([C@@H](N)c3ncccc3F)ccc21 2106797239 YOENKAWFVUWSDS-CQSZACIVSA-N 257.312 2.261 10 10 CECE CCN(CC)c1ccc([C@](C)(O)[C@@]2(C)CCN2)cc1 2107270445 PCUWFAGILHOKIX-CVEARBPZSA-N 262.397 2.492 10 10 CECE CC[C@]1(N)CCCN(Cc2cc(F)cc(F)c2O)C1 2087766704 RQNDKNYGOBICDI-AWEZNQCLSA-N 270.323 2.374 10 10 CECE CC(F)(F)[C@@H]1C[C@@H]1CS(=O)(=O)Nc1ccc(N)cc1 2108377323 RTIZLWCZLNJHCP-LDYMZIIASA-N 290.335 2.302 10 10 CECE CN(C)CC1(CNCc2ccc(N)cc2)CCCC1 2108676317 RUQPRBRUFLFQSY-UHFFFAOYSA-N 261.413 2.480 10 10 CECE CCNCc1ccc(N2CC[C@H]3COCC[C@H]32)cc1 2088745874 CDGKSXNDFMEIQA-GOEBONIOSA-N 260.381 2.411 10 10 CECE CCCN(CCC(=O)O)[C@H](C)c1ccc(O)cc1O 2088873595 FFMPIKRPYMTTRG-SNVBAGLBSA-N 267.325 2.346 10 10 CECE C[C@@H]1CCOCC[C@H]1Nc1c(N)cccc1C(=O)O 2109090071 PGYDAVWWPOHHQY-BXKDBHETSA-N 264.325 2.194 10 10 CECE C[C@H](N)c1ccc(N2CCCNC(=O)CC2)cc1Cl 2089103982 OJDRMQYIDBQPAI-JTQLQIEISA-N 281.787 2.076 10 10 CECE CN1CC(N(C)c2ccc(C=CC(=O)O)cc2Cl)C1 2089239640 PKZFRHVXLWRJIT-UHFFFAOYSA-N 280.755 2.188 10 10 CECE C[C@H]1N(S(=O)(=O)Cc2ccc(N)cc2)CCC1(C)C 2090511178 FVHDAWVKJNQNGQ-LLVKDONJSA-N 282.409 2.219 10 10 CECE C[C@H](O)[C@@H]1CCCN(CCCc2ccc(N)cc2)C1 2090607268 NTIWRWKJWTUSNA-DZGCQCFKSA-N 262.397 2.294 10 10 CECE O=C(NC1[C@H]2CCCCC[C@H]12)c1cccc(O)c1O 2110969671 GFBGKXBORYMYDI-UWVGGRQHSA-N 261.321 2.406 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@H](O)C(C)C)c1 2111296835 LNJFFMGMBOYFBQ-HNNXBMFYSA-N 265.353 2.044 10 10 CECE CN(C)c1ccc([C@H](O)[C@@H](N)Cc2cccs2)cc1 2091350640 CEHBLZNXUHMVJY-GJZGRUSLSA-N 276.405 2.418 10 10 CECE Cc1ncc(NCCc2ccc(O)c(O)c2)nc1C 2091751731 KRNQFUZQBRZHDZ-UHFFFAOYSA-N 259.309 2.159 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@](C)(O)COCC 2091864322 SNOJRRFDBJDQAG-LSDHHAIUSA-N 267.369 2.220 10 10 CECE COc1ccc(N2CCC(C)(C)[C@H](CO)C2)c(N)c1 2092239836 JULINFCAGBQWDM-NSHDSACASA-N 264.369 2.122 10 10 CECE CCN[C@H](C)c1ccc(N(C)[C@H](C)CC(N)=O)cc1 2094990884 RXEWJOLSCPHFOL-VXGBXAGGSA-N 263.385 2.057 10 10 CECE COc1cccc(CN(C)C[C@H]2OCC[C@@H]2C)c1O 2096126042 KEPDBORTQVKQJS-SMDDNHRTSA-N 265.353 2.258 10 10 CECE CCCn1cncc1CN(C)c1ccc(CO)cc1 2096688314 KANJTNAIBZICSW-UHFFFAOYSA-N 259.353 2.422 10 10 CECE C[C@]1(NC(=O)CCOc2ccc(N)cc2)C=CCC1 2112774225 SPTYCGXNDILQLS-HNNXBMFYSA-N 260.337 2.263 10 10 CECE CC[C@@H]1CN(c2ccc(OC)cc2N)C[C@H]1N(C)C 2114130325 HSMGEHPVNHBLGW-IAQYHMDHSA-N 263.385 2.054 10 10 CECE C[C@@H](O)c1ccc(N2CC[S@](=O)C(C)(C)C2)c(F)c1 2114442049 PKKHBBDOBIFRII-DGIBIBHMSA-N 285.384 2.226 10 10 CECE CCN(CC)c1ccc([C@@H](N)C2COCCOC2)cc1 2203643829 YVIRQKPDXKEAAR-MRXNPFEDSA-N 278.396 2.196 10 10 CECE CNCc1ccc(N(C)C2(CO)CC(C)C2)cc1OC 2204558161 YUGLYROYGVCOEX-UHFFFAOYSA-N 278.396 2.012 10 10 CECE COc1cc(N2CC[C@@H](O)C2)ccc1CNCC(C)C 2204541426 MWDHVSVMELYBCI-OAHLLOKOSA-N 278.396 2.012 10 10 CECE Cc1ccc(CN[C@H]2CCc3cn(C)nc3C2)c(O)c1 2204636151 WVPDZHJYIRHQPI-AWEZNQCLSA-N 271.364 2.081 10 10 CECE C[C@H](N)c1ccc(N2CCN(CP(C)(C)=O)CC2)cc1 2205382124 BDCXMYHXPMPVPU-ZDUSSCGKSA-N 295.367 2.409 10 10 CECE CC[C@H]1CN(c2c(F)cc([C@H](C)O)cc2F)C[C@H]1CO 2205684540 SHCFKDOEJVASOR-NHCYSSNCSA-N 285.334 2.473 10 10 CECE CSc1ncc(CNC(=O)C[C@H]2C[C@H](N)C2(C)C)s1 2269096194 RCGONJBAKJVDEU-SCZZXKLOSA-N 299.465 2.245 10 10 CECE COC[C@]12C[C@](CN3CCC(CN=[N+]=[N-])CC3)(CO1)C2 2206035213 NEEBPXWHXWMFCG-OKILXGFUSA-N 280.372 2.204 10 10 CECE C[C@H]1C[C@]1(F)Cn1cc(COc2ccc(N)cc2)nn1 2206369936 OWBDNBQDWSSFDO-HZMBPMFUSA-N 276.315 2.187 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2COC3(CCC3)[C@@H]2O)c1 2206470992 LBHVQPILHJHOGO-CORIIIEPSA-N 277.364 2.034 10 10 CECE Cc1ncnc(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)c1C 2206419474 UWYBXECFQIUERG-LLVKDONJSA-N 274.328 2.398 10 10 CECE Cc1cc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)ccc1[C@@H](C)N 2269660902 BMLFWIAPVVHNSX-FWYOQMDTSA-N 259.397 2.011 10 10 CECE CCN1CCN(c2ccc([C@H](C)NC)c(C)c2)CC1 2269662800 OEZQCOBUBSUVQC-AWEZNQCLSA-N 261.413 2.417 10 10 CECE COc1cccc(CNC[C@@]23CCC[C@]2(CO)C3)c1O 2208165900 WOLGYCZVGWRXKA-JKSUJKDBSA-N 277.364 2.043 10 10 CECE COCC[C@@H](COC)NCc1cnc(SC)s1 2208605844 WJBDLRCSBGJTKB-VIFPVBQESA-N 276.427 2.006 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)COC1CCCC1 2218745910 ORCMHVQDQBZQFQ-GHMZBOCLSA-N 252.318 2.293 10 10 CECE COc1ccc(N(C)[C@H]2CCC[C@@H]2O)c(OC)c1 2219646027 WODAQUXEXJWEAF-AAEUAGOBSA-N 251.326 2.053 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](O)C[C@H]3C2)cc1F 2219610797 VAEDDHPWLOLALB-IAZYJMLFSA-N 251.301 2.041 10 10 CECE COc1ccc(N2CCC(F)(CO)CC2)cc1F 2219620781 YEJXSPVTBQVQFL-UHFFFAOYSA-N 257.280 2.135 10 10 CECE CC[C@@H](O)CN(CC)c1ccc2c(c1)OCCO2 2219604572 FQMVBHAHWAPTLH-GFCCVEGCSA-N 251.326 2.055 10 10 CECE Nc1ccc(NC(=O)[C@H]2OCC[C@@H]2C(F)(F)F)cc1 2231811083 HZSBYHMXEWNSPX-UWVGGRQHSA-N 274.242 2.175 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)CC1[C@@H]2COC[C@@H]12 2232103409 YVQPJXZZWLWBTQ-CQDKDKBSSA-N 261.365 2.377 10 10 CECE CC[C@H](C)NCc1ccc(N(C)C[C@H](C)O)cc1 2223537469 OJADENFOFMKWAW-STQMWFEESA-N 250.386 2.392 10 10 CECE COC1(CF)CN(c2ccc([C@@H](C)N)cc2C)C1 2223981901 DPTWXHKYFOCCLP-LLVKDONJSA-N 252.333 2.189 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@H]2CCC[C@@H]2C(=O)O)CC1 2234172779 UWZHPMNEKCCTSL-QWRGUYRKSA-N 280.328 2.036 10 10 CECE CCN(c1c(F)cc(CN)cc1F)[C@H]1CCC[C@H]1O 2224410508 PCYSEZGIJKGHGY-QWHCGFSZSA-N 270.323 2.163 10 10 CECE COC[C@]12CN(c3ccc(OC)cc3C=O)C[C@]1(C)C2 2235989937 QHUOMEBUAWFQLA-HOTGVXAUSA-N 275.348 2.371 10 10 CECE CNCc1cc(OC)ccc1N1CCC[C@H]1CCCO 2235968463 RTKGJVMMTZMIPL-AWEZNQCLSA-N 278.396 2.156 10 10 CECE COc1ccc(N2CCC(C)(C)[C@H](CO)C2)c(CO)c1 2236000138 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37659086 DGVRKTGITSZDSF-GHMZBOCLSA-N 262.353 2.104 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@H]2CNC[C@@H]2CC1 311731952 RFRZJBYYRSGQIF-RYUDHWBXSA-N 280.799 2.477 10 10 CECE C[C@@H]1CN(c2ccc(CN)cc2Cl)C[C@@H](C)O1 62792799 CABSJAQIAJUZQX-NXEZZACHSA-N 254.761 2.412 10 10 CECE CN[C@]1(CO)CCC[C@H](Sc2nccs2)C1 86617649 UURSRCGGWKKRHN-GXSJLCMTSA-N 258.412 2.128 10 10 CECE C[C@@H](CN1CCCCCC1)NC(=O)c1cccc(O)c1O 193168811 GGRGDEOEYIQPEE-LBPRGKRZSA-N 292.379 2.092 10 10 CECE O=C(CCCc1cccnc1)NCc1cccc(O)c1O 1352670936 PAJICKYZABYNBX-UHFFFAOYSA-N 286.331 2.132 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@@H]1CCCN1 234291692 AJBSWOWJQPQQLM-JTQLQIEISA-N 254.761 2.229 10 10 CECE CC[C@@H](C)N(CC(=O)O)[C@@H](C)c1c(O)cccc1O 233843485 MSSWEUGDTWBTDW-ZJUUUORDSA-N 267.325 2.344 10 10 CECE CNCc1ccc(N2CCC[C@@H]2CO)cc1Cl 234441362 JEXNVRMYKOCDHW-GFCCVEGCSA-N 254.761 2.021 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3CC[C@H](C2)O3)c(F)c1 90906368 NSIKVVNZONDKEL-JLLWLGSASA-N 250.317 2.213 10 10 CECE CCCO[C@@H]1CCCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 249797863 QMFHACSEAKFCDY-DOMZBBRYSA-N 289.379 2.034 10 10 CECE CO[C@@H]1CN(c2ccc([C@@H](C)N)c(Cl)c2)C[C@H]1OC 300093084 IRCBHXAYJYRCCX-OWYVNGRQSA-N 284.787 2.210 10 10 CECE C[C@H](CN(C)[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 251114240 PQKBLHFQODIMKE-VXGBXAGGSA-N 264.369 2.466 10 10 CECE Cc1cc(CNCc2ccc(F)c(F)c2O)on1 700767673 UMVATWBXRAARBH-UHFFFAOYSA-N 254.236 2.257 10 10 CECE NCC[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 708484293 GKQYYMHKVVXJDL-JTQLQIEISA-N 270.323 2.231 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@@H](N)[C@H]3C2)cc1OC 2162621639 JXIMIVSUHALRTR-FPMFFAJLSA-N 276.380 2.267 10 10 CECE COc1ccc(N2C[C@H]3CCC[C@]3(CN)C2)c(OC)c1 2162631520 NAPHXVJHNRVYQN-WBMJQRKESA-N 276.380 2.269 10 10 CECE CNCCN(CC(F)(F)F)c1ccc2c(c1)CCN2C 2163075070 YYVBMYRLAXUPLB-UHFFFAOYSA-N 287.329 2.267 10 10 CECE CN(C)c1ccc([C@H](NN)c2nsc(C3CC3)n2)cc1 2163482460 AMVMTALIKXHHMS-LBPRGKRZSA-N 289.408 2.034 10 10 CECE C[C@@H]1CC(CNCc2ccc(O)c(O)c2)C[C@@H](C)O1 724293597 XSHOLSIHYPTEQV-GHMZBOCLSA-N 265.353 2.391 10 10 CECE Nc1ccc(OCC(=O)OC2C[C@@H]3[C@@H](C2)C3(F)F)cc1 2163941088 JQALBEDTMNVGCN-VXGBXAGGSA-N 283.274 2.235 10 10 CECE CCN(CC)c1ccc(CN2CC[C@H](C(=O)NC)C2)cc1 817414581 HWVBLJWIXOOEKL-HNNXBMFYSA-N 289.423 2.101 10 10 CECE CC(=O)C(=O)COc1c(C=O)ccc2ccccc12 814780603 AFTRFEFWZHMINE-UHFFFAOYSA-N 256.257 2.189 10 10 CECE C[C@H](N[C@H]1CCNC[C@@H]1C)c1ccc(N(C)C)cc1 817972404 WVJRJMVXTJUGLR-XEZPLFJOSA-N 261.413 2.401 10 10 CECE CC[C@H]1CC[C@@H]1N(C)C(=O)c1cc(O)c(O)c(O)c1 2132419892 XJVMYSKFJSKFTR-WPRPVWTQSA-N 265.309 2.064 10 10 CECE CCCN[C@@H](CC)c1ccc(N(C)[C@H](C)C(N)=O)cc1 723192098 OJEHQOTWLAGTIW-DOMZBBRYSA-N 277.412 2.447 10 10 CECE COC[C@H](O)CN(Cc1ccccc1O)C1CCCC1 733613500 YZQZTTFXDXPHIA-OAHLLOKOSA-N 279.380 2.144 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@@]2(C)CCC(=O)N2)cc1 835059820 DQRZEWJGPKASHI-LAQIPUCWSA-N 287.407 2.024 10 10 CECE C[C@H](NC/C=C/c1ccc(N(C)C)cc1)[C@@H](C)C(=O)O 901444195 DRDFDYRKJBPEAC-PBJSTTKNSA-N 276.380 2.465 10 10 CECE CN(C)c1ccc(/C=C\CNC[C@H]2CCCN2C)cc1 835038925 ZQHWQBKPEHHXSG-XQDHMALISA-N 273.424 2.450 10 10 CECE COC1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 843581026 MDWFUSXTLATWQC-LLVKDONJSA-N 262.353 2.109 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@H]1CC[C@H]2C[C@@H]2C1 910943413 BUPWMHGDFRKEMY-HOSYDEDBSA-N 261.321 2.150 10 10 CECE Cc1cc(O)c(CN[C@@H](CO)CCF)c(Cl)c1 846096096 FMDLONYCMMLLSA-SECBINFHSA-N 261.724 2.164 10 10 CECE COc1ccc(N(C)C[C@H]2CCC3(COC3)O2)cc1F 929827494 ULCKTGFTCONWHF-GFCCVEGCSA-N 281.327 2.219 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CCS[C@@H](C(=O)O)C1 699309013 GMUGQUMHUXLADR-SMDDNHRTSA-N 294.420 2.316 10 10 CECE CC[C@H](c1ccccc1O)N1CCS[C@H](C(=O)O)C1 699291712 ZPCIOBJCSFTNMP-YPMHNXCESA-N 281.377 2.345 10 10 CECE CC[C@H](NC[C@H]1CN(C)C[C@H](C)O1)c1ccccc1O 697320998 KSOJBKWHOFTYFI-YDHLFZDLSA-N 278.396 2.152 10 10 CECE Cc1ccc([C@H](C)NC[C@@](C)(O)C(F)F)c(O)c1 698676448 GWLGJKUHEJZMTB-TVQRCGJNSA-N 259.296 2.367 10 10 CECE Cc1cc(C)cc(NC(=S)NNc2nnc(C)n2C)c1 863205150 DYFUKVJSSOGCMY-UHFFFAOYSA-N 290.396 2.054 10 10 CECE COCCCOc1ccccc1NC[C@H](O)CC(C)(C)O 872210556 DGXVVUMMLMDALY-CYBMUJFWSA-N 297.395 2.036 10 10 CECE Nc1ccc(OCCC(=O)OC[C@@H]2C[C@H]2CF)cc1 1875933383 OVZGZDLRAJBYSD-QWRGUYRKSA-N 267.300 2.187 10 10 CECE CCN(C[C@@H]1CCCNC1)c1ccc(OC)cc1N 1876294695 SCZDZUSSAZYUIA-GFCCVEGCSA-N 263.385 2.103 10 10 CECE Cc1cc(O)c(CN[C@H](C)C2(S(C)(=O)=O)CC2)cc1C 796490941 OVRFXUORQJAUDN-GFCCVEGCSA-N 297.420 2.064 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@]23C[C@H](CCO2)C3)CC1 1886796471 TYGBEWXBTVPVNP-GMXVVIOVSA-N 264.329 2.247 10 10 CECE CCOc1cccc([C@H]2CN[C@H](C)CN2CC)c1O 83479578 ZKWVLCRSSNICGD-DGCLKSJQSA-N 264.369 2.146 10 10 CECE COc1ccc2c(c1O)[C@@H](c1ccncc1)NCC2 83620637 UCNUZACDZIPOON-CQSZACIVSA-N 256.305 2.031 10 10 CECE CCCN[C@](C)(C[C@@H](C)Sc1nccs1)C(N)=O 84351575 VZCXBVIUKHILKL-BXKDBHETSA-N 287.454 2.257 10 10 CECE CC[C@@H]1CN([C@@H](C)C(=O)O)c2ccc(OC)cc2N1 76929719 QHCKEVIYTOZIID-VHSXEESVSA-N 264.325 2.179 10 10 CECE CC[C@@H]1CN(CCC(=O)O)c2ccc(OC)cc2N1 76929765 KBNSOXQEQRBZFW-SNVBAGLBSA-N 264.325 2.180 10 10 CECE [N-]=[N+]=N[C@@]1(C(=O)O)CCN(C(=O)OCc2ccccc2)C1 1887598582 OFOWWQIWXOTEPW-ZDUSSCGKSA-N 290.279 2.163 10 10 CECE CN(C)c1nc(CNCc2cc(F)ccc2O)cs1 1963332491 MNNSARIPWZOPTG-UHFFFAOYSA-N 281.356 2.344 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@@H](C)CC[C@H]1C 90256931 CLYZDVCTBPZGLW-UMNHJUIQSA-N 254.334 2.254 10 10 CECE Oc1cccc(Cl)c1CN1CCO[C@@]2(CCOC2)C1 274416722 KHIAVCIXDUVKGN-AWEZNQCLSA-N 283.755 2.037 10 10 CECE COc1ccc(N(C)CC(=O)Nc2nccs2)cc1 1195818510 FHOOGHNJPWVRHO-UHFFFAOYSA-N 277.349 2.227 10 10 CECE CC(C)CN(CC(=O)N(C)c1ccc(N)cc1)C1CC1 42554161 DHKVFURHMIMIEK-UHFFFAOYSA-N 275.396 2.352 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@@H](C)NN2CCC2)c1 686778987 HFRIUIDUNAJKEI-LLVKDONJSA-N 277.368 2.402 10 10 CECE C[C@H](NCc1ccsn1)c1ccc(O)cc1O 705766688 ASMSTVYKHQNSKK-QMMMGPOBSA-N 250.323 2.405 10 10 CECE C[C@@H]1CN(C)CCN1Cc1c(O)cccc1Br 707156099 SCZLTCNZEPJMRD-SNVBAGLBSA-N 299.212 2.291 10 10 CECE CCN(c1ccc(OC)cc1[N+](=O)[O-])[C@@H](C)CC(=O)O 61182147 QRYOURXSUQTTSC-VIFPVBQESA-N 282.296 2.293 10 10 CECE COC[C@H](CN(C)c1ccc([C@H](C)N)cc1Cl)OC 691268181 YDDCCBMJXHEUIT-JQWIXIFHSA-N 286.803 2.457 10 10 CECE Cc1ccc(O)c([C@@H](C)N(C)CCCS(C)(=O)=O)c1 694182224 BXYFSXWMLYIMQD-GFCCVEGCSA-N 285.409 2.128 10 10 CECE Cc1nnc(CN(C)c2c(F)cc(CN)cc2F)s1 697818351 HCTCWNMRKHTBQE-UHFFFAOYSA-N 284.335 2.220 10 10 CECE C[C@H](N)c1ccc(N2CCN(C)C(=O)C2(C)C)c(Cl)c1 94866111 NPLMWSWBFYWPOV-JTQLQIEISA-N 295.814 2.417 10 10 CECE CC[C@@H](N)c1ccc(N2CC(N(C)C3CC3)C2)cc1 2116383490 XUSSRLIPJPPUGY-MRXNPFEDSA-N 259.397 2.379 10 10 CECE CC(C)CNCc1ccc(N2CCO[C@@H]3C[C@H]32)cc1 2115158487 KPBLUBOJYITHTQ-HZPDHXFCSA-N 260.381 2.410 10 10 CECE Cc1ccc(NN=NCCN2CCOCC2)c(C)c1 1860495242 YTUZUJHEMHWQIT-UHFFFAOYSA-N 262.357 2.415 10 10 CECE Cc1ncsc1CN(C)C(=O)Cc1ccc(O)c(O)c1 1465036158 WTMPXGDEAPSRIT-UHFFFAOYSA-N 292.360 2.064 10 10 CECE COc1ccc(N2CCN[C@H](CC(F)(F)F)C2)cc1 2119521918 KHUMYEQZLATTHY-SNVBAGLBSA-N 274.286 2.426 10 10 CECE COc1ccc(N2CCC[C@H](ON)C2)cc1Cl 215574582 HAXREMNVIHGJGX-JTQLQIEISA-N 256.733 2.208 10 10 CECE COCc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 1618295775 STODUWAFUWWVHG-UHFFFAOYSA-N 287.315 2.425 10 10 CECE COc1ccc(N(C)CC23CC(CCO2)C3)c(N)c1 2122921613 ZAVQWWBITLOFJR-UHFFFAOYSA-N 262.353 2.283 10 10 CECE CC(C)(C)OC(=O)COCCCOCCN=[N+]=[N-] 1857780106 IZUAPLLIWWJLQI-UHFFFAOYSA-N 259.306 2.062 10 10 CECE CS[C@H](CNCc1ccc(O)cc1O)C1CC1 2212995545 BEBPNOSRJBXVNK-CYBMUJFWSA-N 253.367 2.329 10 10 CECE CCOC(=O)COCCN(CC)c1ccc(OCC)cc1 1657729657 WAHFKOUXPSDRFW-UHFFFAOYSA-N 295.379 2.491 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)Nc1ccc([N+](=O)[O-])nc1 1650959728 BEIRWKZMDXJMMD-SECBINFHSA-N 289.291 2.444 10 10 CECE CS[C@@H]1CC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1587268384 DHMWIMKTPDEHII-WDEREUQCSA-N 281.377 2.041 10 10 CECE C[C@H](CSc1nccs1)CN1CCOCC1 1652615907 ICNQDCWLTSLWIG-JTQLQIEISA-N 258.412 2.204 10 10 CECE C[C@H](NC1CN(CC(F)(F)F)C1)c1ccccc1O 2125926110 MJERQESEOAIDRF-VIFPVBQESA-N 274.286 2.289 10 10 CECE CC(C)CNCc1ccc(N2C[C@H](O)[C@H]2C)c(F)c1 2126120889 XRGSHAVFSFSOJB-ABAIWWIYSA-N 266.360 2.141 10 10 CECE CN(c1c(F)cc(CO)cc1F)[C@H]1CO[C@H]2C[C@@H]1C2 2126694944 ITDBWLNUVKWCIC-CWSCBRNRSA-N 269.291 2.071 10 10 CECE COc1cc(O)c2c(c1)C(=O)c1ccccc1C2=O 13481208 LRCKMFKYRNMGRL-UHFFFAOYSA-N 254.241 2.176 10 10 CECE biogenic,in-vitro Nc1ccc(CCC[S@](=O)CCOCC2CC2)cc1 2127763941 NMFCSWAUPHHUTA-IBGZPJMESA-N 281.421 2.377 10 10 CECE Oc1c(F)cccc1CNc1ccc(-n2cncn2)nc1 164967511 PTPMKMGVJMFQBG-UHFFFAOYSA-N 285.282 2.119 10 10 CECE O=C1N=C(NO)S/C1=C\c1ccc(Br)cc1 6191809 JOVOKLNKMMXROH-YVMONPNESA-N 299.149 2.398 10 10 CECE CC(C)OCCN(C)c1ccc([C@H](C)N)c(O)c1 157993555 CZQBPTFWFIENKB-NSHDSACASA-N 252.358 2.273 10 10 CECE C[C@@]1(CO)CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128268236 DDFZSCBORQESLJ-HZPDHXFCSA-N 261.365 2.265 10 10 CECE C[C@@H]1[C@@H](O)CCCN1c1ccc2c(c1)CCC[C@H]2N 2128275745 WDLSAHSXCMYXNQ-LYRGGWFBSA-N 260.381 2.372 10 10 CECE CN1CCCN(c2ccc3c(c2)CCC[C@H]3N)CC1 2128278257 CRVGCCLZMCHUHE-MRXNPFEDSA-N 259.397 2.165 10 10 CECE COC[C@@]12C[C@@H]1CN(c1ccc3c(c1)CC[C@H]3N)C2 2128300027 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2.154 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@]3(CCO3)CC[C@@H]2N)cc1 2279053732 JEEREORIAJPVRE-ARFHVFGLSA-N 276.380 2.170 10 10 CECE COc1ccc(N2CC[C@]3(CCN3)C2)c2c1CCC2 2269171147 IYETUMBGCKKFFY-MRXNPFEDSA-N 258.365 2.126 10 10 CECE COC[C@]1(C)[C@H]2C[C@@H]2CN1c1ccc(CN)c(F)c1 2269137666 LHGZSSRXMGJRMS-OSAQELSMSA-N 264.344 2.146 10 10 CECE CCN1CC(CN(C)c2ccc([C@@H](C)N)c(C)c2)C1 2269664246 YIDZHLICOUEARB-CYBMUJFWSA-N 261.413 2.403 10 10 CECE Cc1cc(N(C)CC2[C@@H]3COC[C@@H]23)ccc1[C@@H](C)O 2269681165 JLSCIQWYQNTZJE-RLCCDNCMSA-N 261.365 2.377 10 10 CECE CCNCc1cc(F)c(N2CC[C@]3(O)C[C@@H]3C2)c(F)c1 2280019322 ZJZCQLJHBABRNS-ABAIWWIYSA-N 282.334 2.035 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@H]2CCNC[C@@H]21 2290266417 UTIVAKGCZSMBGF-XUJVJEKNSA-N 276.380 2.233 10 10 CECE O=C(N[C@H]1CC(F)(F)C12CCC2)c1ccc(O)c(O)c1 2280899975 MODQYEDYYLICTL-NSHDSACASA-N 283.274 2.406 10 10 CECE COc1ccc(N2C[C@H]3C[C@H](N)C[C@H]2C3)c2c1CCC2 2284594323 VMHGRCAYWGTPLI-RWMBFGLXSA-N 272.392 2.500 10 10 CECE COc1ccc(N2CC[C@@](C)(O)[C@](C)(O)C2)c(C)c1C 2284602586 SDXHYGSEFHGZJE-HZPDHXFCSA-N 279.380 2.024 10 10 CECE CCS(=O)(=O)C[C@@H](C)N(C)c1ccc([C@H](C)N)c(C)c1 2285133803 QYTGUVGBEIDZBR-OLZOCXBDSA-N 298.452 2.274 10 10 CECE COc1ccc(N2C[C@@H](N)CC(F)(F)C2)c(OC)c1C 2295418889 LMXJXGVZYCXUPI-JTQLQIEISA-N 286.322 2.185 10 10 CECE CC[C@@H](NC)c1ccc(N2CCC[C@@H]2CC(N)=O)cc1 2285577719 BRVZICNAHVUWGO-HUUCEWRRSA-N 275.396 2.201 10 10 CECE COc1cc(OC)c(N2C[C@H]3CNC[C@@H](C3)C2)cc1Cl 2285934753 GCLMRTUGTASYNJ-GHMZBOCLSA-N 296.798 2.403 10 10 CECE c1cc(N2CCNCC2)ccc1CN1CCCC12CC2 2286068762 VAUZOLSNHDDYQN-UHFFFAOYSA-N 271.408 2.225 10 10 CECE CP(C)(=O)[C@H]1CN(c2ccc3c(c2)CC[C@H]3N)CCO1 2289186334 AVTIQUYCPGXQAJ-CABCVRRESA-N 294.335 2.418 10 10 CECE CC(C)(C)C[C@H](O)CNC(=O)C=Cc1ccc(O)c(O)c1 2308001418 GZYGCCCVGBFQQW-LBPRGKRZSA-N 293.363 2.024 10 10 CECE Cc1cc(N2CCOC[C@@H](F)C2)ccc1[C@H](C)O 2315068262 OUPKFZRGORKKEX-RYUDHWBXSA-N 253.317 2.223 10 10 CECE CSc1cc(N2CC[C@@H](O)C2(C)C)ccc1CN 2328545295 XSDBKEPGQAMDHI-CYBMUJFWSA-N 266.410 2.217 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(CO)cc1F 2329971511 VPRHYXHDMLYIAS-ZOWXZIJZSA-N 265.328 2.322 10 10 CECE Nc1ccc(CN2[C@H]3CCCC[C@H]3C[C@@H]2CO)cc1 2333970032 ZLUJLSSEYBDLRN-IMJJTQAJSA-N 260.381 2.394 10 10 CECE C[C@@H](N[C@@H]1CC[C@@H]2C[C@H]1CO2)c1cc(O)ccc1O 2334121058 VAJQGGDYGGUPRY-IQOUGMIPSA-N 263.337 2.316 10 10 CECE C[C@@H](NC[C@@H]1COCC1(C)C)c1cc(O)ccc1O 2336146700 WGDMAOPQCIGBGC-GHMZBOCLSA-N 265.353 2.421 10 10 CECE C[C@H](N[C@H]1COC2(C)CC1C2)c1c(O)cccc1O 2337723053 ZTDFMYSBFLFJQO-PAPNWUEJSA-N 263.337 2.316 10 10 CECE CC1(C)C[C@@H](O)CN1c1ccc(CN)c(C2CC2)c1 2339145115 GIZWRICIAIKTNX-CQSZACIVSA-N 260.381 2.372 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)c(C)c2C)C[C@@H]1F 2340861553 LEHHAFUBIHWCLZ-WHOFXGATSA-N 266.360 2.496 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC[S@](=O)[C@@H](C)C2)c1C 2341065415 VMSIAPCBKHWSOX-VARDARPISA-N 281.421 2.314 10 10 CECE Oc1cc2c(cc1O)CN(C[C@@H]1CCCCO1)CC2 2341215681 BMKHRMIUEMZOPG-ZDUSSCGKSA-N 263.337 2.025 10 10 CECE C[C@@H]1[C@H](O)CCN(c2ccc3c(c2)CC[C@H]3O)[C@@H]1C 2344546957 QFTIKQYHXHDZOY-IRHXVLAXSA-N 261.365 2.262 10 10 CECE CSc1cc(N2CC[C@H]3CCO[C@@H]3C2)ccc1CN 2353857887 BYNMCOJAPXVEDA-SMDDNHRTSA-N 278.421 2.482 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1C[C@@H](N)[C@H](C(F)F)C1 2354379390 YXBHYYGCHYKYMK-ZLKJLUDKSA-N 283.366 2.338 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H]3C[C@@H]4C[C@@H]4CO3)ccc21 2355828886 VFHDQXZPSHQOCQ-XOSAIJSUSA-N 272.392 2.494 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3[C@H]2CCCN3C)cc1O 2356100488 FCLWYZIVJHCHRB-KCPJHIHWSA-N 276.380 2.118 10 10 CECE C[C@@H]1CCC[C@](CO)(NC(=O)CCc2ccc(N)cc2)C1 53112464 CDZCAWYHDQCFSY-DYVFJYSZSA-N 290.407 2.259 10 10 CECE Nc1ccc(CCc2nc(C(F)(F)F)no2)cc1 138261218 WLTZTZDLSACAHR-UHFFFAOYSA-N 257.215 2.456 10 10 CECE CC1(C)[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3O)C[C@H]21 172964590 LKAKYYRPTSDLRT-VXGBXAGGSA-N 262.309 2.388 10 10 CECE Nc1ccc(NC(=O)NCc2ccc3c(c2)OCO3)cc1 61675143 ANAOOZQJZCAGME-UHFFFAOYSA-N 285.303 2.319 10 10 CECE CCN(CC)CCNCc1cccc(Cl)c1O 127870221 BEACPTKWXLACKL-UHFFFAOYSA-N 256.777 2.477 10 10 CECE COCCN(CCC(=O)Nc1ccc(N)cc1)CC(C)C 42367185 CTWLPJPJHBSKPN-UHFFFAOYSA-N 293.411 2.202 10 10 CECE Cc1cc(C(=O)NC[C@H](C)N)c(C)n1-c1ccccc1 194914799 JNHOKHVGOJOSOQ-NSHDSACASA-N 271.364 2.171 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])CCC[C@@H]1C 90259789 QPXBBCMFBYTZMZ-CMPLNLGQSA-N 254.334 2.398 10 10 CECE CCCNCc1ccnc(-c2ccc(O)c(O)c2)n1 233114383 LYJIGVQANCJWHS-UHFFFAOYSA-N 259.309 2.054 10 10 CECE COc1cccc(CNC(=O)[C@@H]2[C@H]3CCCC[C@H]32)c1O 246553126 RBKAXBVYXHYILJ-IMRBUKKESA-N 275.348 2.453 10 10 CECE Cc1ccc(-c2cn3c(n2)CCC[C@H]3C(=O)O)n1C 606597733 PQEPUZHOFSWKHL-LBPRGKRZSA-N 259.309 2.159 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1N 251556581 RLYSAUKAPKHKRX-APCWTUGXSA-N 288.391 2.285 10 10 CECE CN1CCc2cc(CNC[C@@H]3CCC[C@H]3C(=O)O)ccc21 250370760 IKSSICFYLKOJCA-LSDHHAIUSA-N 288.391 2.269 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCC[C@H]2C(=O)O)c1 251698038 MXOYUCGGSCOUGJ-SKDRFNHKSA-N 265.309 2.011 10 10 CECE Cc1ccc(C(=O)N2CC[C@]3(CCCOC3)C2)c(O)c1O 368600067 ATYCVVJUYWEJRO-MRXNPFEDSA-N 291.347 2.049 10 10 CECE O=C1CN(Cc2cc(Cl)c(F)cc2O)CN1CC1CC1 294650838 KVCUOZQPOQKYQW-UHFFFAOYSA-N 298.745 2.196 10 10 CECE CCOC(=O)c1ncc(C(=O)Nc2ccc(N)cc2)s1 2162278395 JFWOHZHNNJOPSD-UHFFFAOYSA-N 291.332 2.154 10 10 CECE C[C@H]1C[C@@H]1COc1ccc(N2CCNCC2)c(F)c1 722644035 KKBFVVNNEGNJRR-NWDGAFQWSA-N 264.344 2.270 10 10 CECE CN1CCc2cc([C@]3(O)CCC[C@H](N(C)C)C3)ccc21 2163065506 AVOQTZJRJVFMCW-RDJZCZTQSA-N 274.408 2.371 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@]2(OC)CCOC2)cc1 2163100176 ONNZLXBECDLSGV-CVEARBPZSA-N 279.380 2.372 10 10 CECE OC[C@H]1C[C@@H](NCc2c(O)ccc3ccccc23)C1 707702413 IDQDWSXTTRJACC-BJHJDKERSA-N 257.333 2.406 10 10 CECE CN1CCCc2cc([C@@](C)(O)c3cn(C)cn3)ccc21 2163102686 MWDPXTAEEVWHOE-MRXNPFEDSA-N 271.364 2.058 10 10 CECE CN1CCc2cc([C@@H](N)[C@@](C)(O)c3cnsc3)ccc21 2163135265 IFMZAOWGIIMFLL-CABCVRRESA-N 289.404 2.043 10 10 CECE CCN[C@@H](C)c1ccc(N2CC([C@@H](C)O)C2)c(F)c1 719788177 WOWXRAJWGLKGPU-WDEREUQCSA-N 266.360 2.313 10 10 CECE CC1(C)CO[C@H](CCNCc2cccc(O)c2O)C1 717330843 LBNQGKIDCHBXLP-GFCCVEGCSA-N 265.353 2.393 10 10 CECE FC(F)(F)Oc1ccc(N2CC[C@@H]3CNC[C@@H]32)cc1 2132371589 RZLPPGAGTSMCGN-SKDRFNHKSA-N 272.270 2.383 10 10 CECE CC[C@H](N[C@@H]1CNCCC1(F)F)c1ccccc1O 817979622 CATUTYKTUNFHNL-WCQYABFASA-N 270.323 2.430 10 10 CECE Cc1cc(O)c(CN2C[C@H](C(N)=O)CC[C@@H]2C)cc1Cl 824575869 SMTBUAYEVCWKIP-WDEREUQCSA-N 296.798 2.440 10 10 CECE O=C1Nc2cc(N3CCC(C4CC4)CC3)ccc2[C@@H]1O 724686711 JLUOYCQFZFPLKP-HNNXBMFYSA-N 272.348 2.299 10 10 CECE CO[C@@H]1CC[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)C1 824670020 TVXKXBWVTCRZAS-CHWSQXEVSA-N 294.370 2.323 10 10 CECE CN(C)CC[C@H]1CCN(c2ccc(CO)cc2F)C1 700836394 PNZVBADWGSLEMZ-LBPRGKRZSA-N 266.360 2.096 10 10 CECE CC(C)COCCCNC(=O)NCc1c(O)cccc1F 913942419 IHRGLYYCWXREGN-UHFFFAOYSA-N 298.358 2.393 10 10 CECE CC[C@@H](NC[C@]1(CO)CCCOC1)c1ccccc1O 700936369 QHTNEYMUFLHANX-ZBFHGGJFSA-N 279.380 2.222 10 10 CECE C[C@@H](NCCCn1ccnn1)c1ccc(Cl)cc1O 841754711 UZDPUPTUINSBGI-SNVBAGLBSA-N 280.759 2.378 10 10 CECE CO[C@@](C)(CO)CN[C@@H](C)c1ccc(C)c(C)c1O 848559907 VUXDZRXDWIVJDM-SWLSCSKDSA-N 267.369 2.057 10 10 CECE COCC1(CCNCc2c(O)cccc2OC)CC1 842728151 ATYGVFXDRQSGJB-UHFFFAOYSA-N 265.353 2.307 10 10 CECE C[C@@H](NCc1c2c(nn1C)CCOC2)c1ccccc1O 922329625 OSCREMGQXULLBL-LLVKDONJSA-N 287.363 2.049 10 10 CECE COC[C@H](C)[C@@H](C)C(=O)NCc1c(O)cccc1F 928705581 KBKVXMQUFCMTOP-VHSXEESVSA-N 269.316 2.066 10 10 CECE NCc1ccc(N2CCO[C@H](CC(F)(F)F)C2)cc1 699125979 FANIGWZITNIWHN-GFCCVEGCSA-N 274.286 2.303 10 10 CECE O=C(NCc1c(O)cccc1F)[C@@H](F)C(F)(F)F 928707515 FLKRUISCAXLXOQ-MRVPVSSYSA-N 269.169 2.048 10 10 CECE CCC1CN(c2cc3c(cc2Cl)[C@H](NC)C(=O)N3)C1 697514896 CKXISRIKQXUQQW-ZDUSSCGKSA-N 279.771 2.399 10 10 CECE C[C@@H](NCc1ccc(F)c(F)c1O)c1ccnn1C 877761329 FNLSRCUDCWNBMH-MRVPVSSYSA-N 267.279 2.255 10 10 CECE Nc1ccc(NC(=O)N[C@@H](CO)c2cccs2)cc1 1876136702 HEYBKYISLDTQBD-NSHDSACASA-N 277.349 2.185 10 10 CECE Nc1ccc(NC(=O)N2CCc3cccnc32)cc1 1876153262 QMLQTIOFVOMQTD-UHFFFAOYSA-N 254.293 2.258 10 10 CECE COc1ccc(O)c(CNCC[C@@H](OC)C(F)(F)F)c1 787417746 PJTMYWNLNSJKNW-GFCCVEGCSA-N 293.285 2.458 10 10 CECE Cc1nc(Cl)c(N)c(=N[C@H](C)c2ccccc2O)[nH]1 1877578162 JHFSVBCPCRWYEM-SSDOTTSWSA-N 278.743 2.321 10 10 CECE CC(C)Cn1ccc(C(=O)N2Cc3cccc(O)c3C2)n1 899173193 KTHPYJVBFLBHOW-UHFFFAOYSA-N 285.347 2.401 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1n[nH]c2ccccc12 1135394738 DLLVWMGYUTYKKW-UHFFFAOYSA-N 283.287 2.155 10 10 CECE CCc1cccc(CN2CCNC(=O)CC23CCC3)c1O 895927666 UTTJINOZNYWXJA-UHFFFAOYSA-N 288.391 2.199 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCC[C@H](CO)C2)c(F)c1 1880486453 GHSYCQBERUGJHG-ZJUUUORDSA-N 271.307 2.227 10 10 CECE CN1CCc2cc([C@@H](NN)C3(CCF)CC3)ccc21 1881945224 FICHEVUDXCTOPR-CQSZACIVSA-N 263.360 2.323 10 10 CECE CN1CCCc2cc(CNCc3ncco3)ccc21 1964042093 DTERBRHNCGYNAY-UHFFFAOYSA-N 257.337 2.347 10 10 CECE COc1ccc(O)c(CN(C)C[C@@H]2CC[C@@H](C)O2)c1 1885292566 LBPZWLVTTYEWJR-RISCZKNCSA-N 265.353 2.400 10 10 CECE CCN(CC)C(=O)CCN(C)c1ccc(OC)cc1 1962725371 SRDXGVSVCZAMTE-UHFFFAOYSA-N 264.369 2.390 10 10 CECE Cc1cc(NS(=O)(=O)C[C@H]2CCCCO2)c(C)cc1O 1963036273 KBDNXILFGVDZHD-GFCCVEGCSA-N 299.392 2.320 10 10 CECE C[C@@H]1OCC[C@H]1CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1885775777 DMYLRVSMFBJFTE-TUAOUCFPSA-N 266.345 2.350 10 10 CECE Oc1cccc2c1[C@@H]([C@H](O)Cc1ccccc1)NCC2 83659976 VRWIWBPQLNRFIV-NVXWUHKLSA-N 269.344 2.183 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)cc2)CC[C@H]1N(C)C 693639972 BDAACCQGQDONBX-WOSRLPQWSA-N 261.413 2.483 10 10 CECE C[C@@H](CNCc1ccc(F)c(F)c1O)N(C)C1CC1 703342434 WBGWYIQHTMPIEA-VIFPVBQESA-N 270.323 2.243 10 10 CECE C[C@H](NCc1ccc(F)c(F)c1O)C1CCN(C)CC1 703417075 HTSKKFBVXFYTIF-JTQLQIEISA-N 284.350 2.490 10 10 CECE CC1(C)SCCN(Cc2ccc(N)cc2)[C@@H]1C(=O)O 1891268561 IEECPODOCQKBJI-GFCCVEGCSA-N 280.393 2.049 10 10 CECE CCCC[C@](C)(CO)NC(=O)c1cc(O)cs1 1328354731 AKEYJYJYUCGZEQ-GFCCVEGCSA-N 257.355 2.125 10 10 CECE CSC[C@@H]1CCN(CCOc2ccc(N)cc2)C1 706675689 UNQZUUAGPGPBBN-GFCCVEGCSA-N 266.410 2.333 10 10 CECE CC(C)c1oncc1C(=O)NCc1c(O)cccc1O 1178918005 VWGKDTNVPITOMH-UHFFFAOYSA-N 276.292 2.139 10 10 CECE Oc1c(F)cc(F)cc1CNCC[C@@H]1CCCO1 708559351 RBQGRNVDZPAIME-NSHDSACASA-N 257.280 2.329 10 10 CECE COC(C)(CCN[C@@H](C)c1ccc(O)cc1O)OC 711033750 AATBUNVRAIJFKS-JTQLQIEISA-N 269.341 2.148 10 10 CECE CCNCc1ccc(OC)c(CN2C[C@H](C)OC2=O)c1 688552330 WBGBATBRSGMKPM-NSHDSACASA-N 278.352 2.145 10 10 CECE CC1(C)CO[C@@H](CCNCc2ccc(O)cc2O)C1 717331415 OHDLJBIOHANPRX-ZDUSSCGKSA-N 265.353 2.393 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2COC3)cc1C 695038739 CGCDDPMIHCUXTK-HOTGVXAUSA-N 260.381 2.472 10 10 CECE CN1CCc2cc(CNC[C@H]3CCCC[C@@H]3O)ccc21 85963644 ZULJOGHZGNSEJU-WBVHZDCISA-N 274.408 2.320 10 10 CECE CCc1nnsc1C(=O)N(CC)Cc1ccc(N)cc1 87443800 JKTSUIVZAZDPON-UHFFFAOYSA-N 290.392 2.345 10 10 CECE C[C@H]1CC[C@@H](C)CN1CC(=O)N(C)c1ccc(N)cc1 88700031 GILSJZQOFNPSMD-OLZOCXBDSA-N 275.396 2.352 10 10 CECE C[C@@]1(C(F)F)CN(C(=O)Nc2ccc(N)cc2)CCO1 698841250 KVNQFULZOHNBTB-ZDUSSCGKSA-N 285.294 2.157 10 10 CECE Oc1cccc2c1CN(C(=S)NCC1CCC1)C2 1331940111 PHVKDUYWDWQFDO-UHFFFAOYSA-N 262.378 2.382 10 10 CECE CCC(=O)NCC[C@H](C)NCc1ccc(OC)c(C)c1 1267117593 UMIIKQREOFJPQG-ZDUSSCGKSA-N 278.396 2.398 10 10 CECE C/C(=C\c1cccnc1)C(=O)N1CC(=O)Nc2ccccc21 1352182863 HPXSDMFOLNHCSF-FMIVXFBMSA-N 293.326 2.470 10 10 CECE CC(C)NCc1ccc(N2C[C@H]3OCC[C@@H]3C2)cc1 2115400275 FSYYXNRAGUPOSA-GDBMZVCRSA-N 260.381 2.410 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2cnn(C)n2)cc1Cl 2115787277 ILLULHLFUSVAJO-SECBINFHSA-N 279.775 2.125 10 10 CECE CCn1ncc(Cl)c1C(=O)NCc1ccccc1O 1294925933 VIELEDHSSQZOMU-UHFFFAOYSA-N 279.727 2.192 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)c(Cl)c1 2117692057 XXLWNKLKNHZRAH-IXOXFDKPSA-N 280.799 2.424 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@]2(C)COC)cc1O 2119469319 WTNVRDYDLJBWCB-XHDPSFHLSA-N 264.369 2.288 10 10 CECE C[C@@H]1CN(CCOCCc2ccc(N)cc2)C[C@H]1C 2119733914 PHWJTNYCZFBJMV-ZIAGYGMSSA-N 262.397 2.416 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2[C@H]3CCCO[C@H]32)CC1 2119912349 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Cc1cccc(CNCCS(=O)(=O)C(C)(C)C)c1O 1875831360 NUQHRLOFMRAVPM-UHFFFAOYSA-N 285.409 2.004 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@H](O)CC(C)(C)C2)c1O 879619926 GDXRIVNBVLVDHQ-CYBMUJFWSA-N 295.354 2.327 10 10 CECE COC(=O)[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 775651124 ZXMCCACVZSIEIQ-QMMMGPOBSA-N 287.718 2.180 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)[C@@H]2CCC[C@H]2C1=O 1877587749 GAUZNPWDYHRNAT-YUSALJHKSA-N 259.305 2.238 10 10 CECE COC(=O)[C@H]1[C@H](CN[C@@H](C)c2ccccc2O)C1(F)F 895460065 ITSWAJXVJGFKED-PTOFAABTSA-N 285.290 2.097 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)CC2(C)COC2)c(F)c1 1880480746 YTGSXGVKODGUMD-SECBINFHSA-N 271.307 2.491 10 10 CECE O=C(O)C=Cc1ccc(N2[C@H]3COC[C@H]2C3)cc1Cl 1899385730 BJULLMMPYCJFEO-VXGBXAGGSA-N 279.723 2.415 10 10 CECE O=C(NCc1ccc(O)cc1O)c1onc2ccccc12 1142537257 GDIOQOLSGUSBKT-UHFFFAOYSA-N 284.271 2.169 10 10 CECE Nc1ccc(CC(=O)NC2([C@H]3CCCCO3)CC2)cc1 1358362089 CSDGKYJRBMQGOR-CQSZACIVSA-N 274.364 2.029 10 10 CECE C[C@H](NCc1ccc(Cl)cc1O)c1nncn1C 1964034199 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CC(C)(C)N1CC[C@H]1CNCc1c(O)cccc1F 1965909953 JGHBJZCGEATTMQ-NSHDSACASA-N 266.360 2.494 10 10 CECE COc1ccc(O)c([C@@H](C)NCCc2ncccn2)c1 1966190006 BKMRCRBYCCHNLI-LLVKDONJSA-N 273.336 2.084 10 10 CECE CN[C@@H]1CCCc2cc(N(C)CC[S@@](C)=O)ccc21 2128280042 WSUAHJLRSUEGOP-DNVCBOLYSA-N 280.437 2.098 10 10 CECE CN(C)[C@H]1CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128270693 JBCIKIYXXDSBGU-HOCLYGCPSA-N 259.397 2.163 10 10 CECE CCN(CCF)CCCC(=O)Nc1ccc(N)cc1 2128264033 FHCBQANITVJTEF-UHFFFAOYSA-N 267.348 2.279 10 10 CECE C[C@@H]1C[C@H](O)CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128322446 OKUGJOBPCDJQDY-DJSGYFEHSA-N 261.365 2.263 10 10 CECE C[C@@H]1C[C@@H](CO)CN(c2ccc3c(c2)CC[C@@H]3N)C1 2128322774 SSKIYEBFOMMRFF-HSMVNMDESA-N 260.381 2.087 10 10 CECE CN[C@H]1CCc2cc(N3CCOC[C@H]3CF)ccc21 2128312655 KSZWJYOBDRPYGK-HIFRSBDPSA-N 264.344 2.068 10 10 CECE Oc1ccc(CNC[C@H]2CCCCS2)c(O)c1 157955032 VARAFZNONIYPBV-GFCCVEGCSA-N 253.367 2.473 10 10 CECE NCC1(CO)CCN(c2ccc3c(c2)CCCC3)CC1 2202901326 AMLNBQOMWQIURQ-UHFFFAOYSA-N 274.408 2.103 10 10 CECE N#Cc1ccc2c(c1)NC(=O)CN2c1ccc(N)cc1 259167188 HEQMFGLZAQNUOW-UHFFFAOYSA-N 264.288 2.231 10 10 CECE CC[C@H](C)N1Cc2ccc(N3CCNCC3)cc2C1 259162628 CLTDVZDDBUVXIL-ZDUSSCGKSA-N 259.397 2.210 10 10 CECE N#Cc1c(-c2ccc3c(c2)CCCO3)cc(O)nc1O 259362942 QGAYGQDVXCOOTD-UHFFFAOYSA-N 268.272 2.356 10 10 CECE OCc1ccc(N2CCC[C@]3(CC[C@@H]3O)C2)c(F)c1 2129551774 IIFPIXCGELAIGQ-GJZGRUSLSA-N 265.328 2.059 10 10 CECE Cc1ccc(NC(=O)CN2CC(N=[N+]=[N-])C2)cc1F 1912190867 KPKAPHDZFCEWOS-UHFFFAOYSA-N 263.276 2.067 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)Nc1ccc2c(c1)CCC2 1912179763 UHOUKOATJLRABM-UHFFFAOYSA-N 273.340 2.356 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CC(=O)N2CCCCCC2)C1 1912168057 RHEMAHZLBZGCGG-CYBMUJFWSA-N 279.388 2.411 10 10 CECE C[C@H](C(=O)NCc1ccco1)N1CCC(N=[N+]=[N-])CC1 1912197339 RZMXBLVVPKCSMA-SNVBAGLBSA-N 277.328 2.059 10 10 CECE Cn1cc(Br)c(CN2CC[C@@H](CN=[N+]=[N-])C2)n1 1912190441 DHVLOLBDYGKOJC-QMMMGPOBSA-N 299.176 2.315 10 10 CECE CCC1C[C@H]2C(=O)N(CCCCN=[N+]=[N-])C(=O)[C@@H]2C1 1912169893 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CCOC[C@@H](C)O[C@@H](C)C(=O)Nc1ccc(N)cc1 233750153 MJNZEJSARZQIJV-MNOVXSKESA-N 266.341 2.037 10 10 CECE CNCc1ccc(N2CCCC[C@H]2C(=O)NC)cc1Cl 234431844 XPZBYXAZMJCEOR-AWEZNQCLSA-N 295.814 2.164 10 10 CECE CN[C@@H](c1ccccc1O)c1cnn(C)c1Br 1942401134 PGNKHUHLCRSEDV-NSHDSACASA-N 296.168 2.197 10 10 CECE OC[C@H](NCc1cccc(Cl)c1O)C(F)(F)F 1942830587 DXHJAGJONWGPSC-QMMMGPOBSA-N 269.650 2.058 10 10 CECE C[C@H](NC[C@@H]1CCCCN1C)c1c(O)cccc1O 235525209 YCOFFPFLGQMTQF-RYUDHWBXSA-N 264.369 2.233 10 10 CECE C[C@@H]1C[C@](O)([C@@H](N)c2ccccc2O)CCS1 1946327859 HYDHLOOIULGEMM-ICCXJUOJSA-N 253.367 2.039 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](N)C3)c([N+](=O)[O-])c1 2151265803 IOUNQRXXGLROST-RTCCRHLQSA-N 277.324 2.062 10 10 CECE CCCNCc1cnc(SCCC(=O)OC)s1 1949567841 WXHWZPQZPFWPBE-UHFFFAOYSA-N 274.411 2.298 10 10 CECE Oc1c(F)cccc1CN[C@@H]1COCCC1(F)F 1972757087 FIGFBQIODFUSKJ-SNVBAGLBSA-N 261.243 2.045 10 10 CECE C[C@@H](NC[C@H]1CCCCNC1=O)c1ccc(F)cc1O 2144036797 OPPDGVCUPVSBOY-GHMZBOCLSA-N 280.343 2.098 10 10 CECE CNCc1ccc(N2C[C@@H]3[C@@H](CC[C@H]3OC)C2)c(F)c1 2144219147 DWTONYZEJSYEHH-WOSRLPQWSA-N 278.371 2.406 10 10 CECE C[C@@]12CSC[C@H]1CN(c1cc3c(cc1N)OCCO3)C2 2144750862 AFAMOBHESMIUEM-MEBBXXQBSA-N 292.404 2.229 10 10 CECE CN1CCCc2cc([C@H](O)[C@H](N)c3ccc[nH]3)ccc21 2148167754 FIPXYOVGSGWVMX-CVEARBPZSA-N 271.364 2.131 10 10 CECE Oc1ccc(Cl)cc1CN1CCOC[C@H]1[C@@H]1CCOC1 2144952553 HLRGJXLMRIFZQF-RISCZKNCSA-N 297.782 2.283 10 10 CECE CN(CCc1ccccn1)C(=O)Nc1ccc(N)cc1 35408025 HWPOCJXAJQABGJ-UHFFFAOYSA-N 270.336 2.370 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)[C@@H]3[C@H]4CCC[C@H]43)ccc21 2151282403 SHFWWLMRYMBKKA-BVIHXZOGSA-N 271.364 2.134 10 10 CECE Oc1ccc2ccccc2c1CNC[C@H]1COCCO1 38060421 PLPAEHCQKSXAEA-ZDUSSCGKSA-N 273.332 2.050 10 10 CECE Oc1c(F)cc(F)cc1CNCc1nccn1C1CC1 2148833621 IPBMXYKCTLXMQN-UHFFFAOYSA-N 279.290 2.492 10 10 CECE COc1ccc(O)c([C@H](C)N2CC(C)(C)[C@H]2C(=O)O)c1 2148965351 OXYKMZAFPYLDHK-TVQRCGJNSA-N 279.336 2.257 10 10 CECE CN(CC1CC(F)C1)c1cc2c(cc1N)NC(=O)CC2 2148938203 FBJWYRXJNWEJHD-UHFFFAOYSA-N 277.343 2.338 10 10 CECE C[C@@H](NC[C@H]1COCCCO1)c1ccc(N(C)C)cc1 2153986194 OFQHNOUJEFISBF-CJNGLKHVSA-N 278.396 2.209 10 10 CECE CCN(C)[C@@H]1CCN([C@@H](C)c2ccc(OC)cc2O)C1 2153955365 ITRFHTOJMJELBE-QWHCGFSZSA-N 278.396 2.488 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@H]2C[C@H](O)C2(C)C)c1 2154214009 JQADZFFAGDRUPH-RWSFTLGLSA-N 279.380 2.458 10 10 CECE CC[C@H]1COCCN(Cc2cc(C(C)=O)ccc2O)C1 2154322440 LFGPZIBWTBJULB-CYBMUJFWSA-N 277.364 2.453 10 10 CECE Nc1ccc(CCN[C@@H](CF)C(F)(F)F)cc1 2012939226 SHFKJECZRBDTHT-JTQLQIEISA-N 250.239 2.301 10 10 CECE Cc1c([C@@H](N)c2ccccc2O)c(Br)nn1C 2014533920 JNEKUPPPWMMJHD-NSHDSACASA-N 296.168 2.245 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1C[C@H]2CNC[C@H]1C2 2016914095 OIQSTNYPLNXUQE-YGOYTEALSA-N 251.761 2.332 10 10 CECE CNCc1ccc(N(CCOC)[C@@H](C)COC)c(C)c1 50562099 ANKJQZPMORLXMA-AWEZNQCLSA-N 280.412 2.202 10 10 CECE COc1ccc(N2C[C@H]3CCN[C@H]3C2)cc1Cl 2024010130 GAXPKZZYGUSPBP-SKDRFNHKSA-N 252.745 2.147 10 10 CECE Cc1cc([C@@H](NCCCN=[N+]=[N-])C(N)=O)sc1C 2026968267 PUEMVQUDSOTXEJ-SNVBAGLBSA-N 267.358 2.181 10 10 CECE CO[C@H]1CCN(c2ccc(CO)cc2F)C[C@H]1C 2031979512 URJOFGSWYGPWFV-YGRLFVJLSA-N 253.317 2.179 10 10 CECE CCNCC(C)(C)NCc1ccc(OC)c(C)c1 2033018747 NBSMZRGBHGRKKS-UHFFFAOYSA-N 250.386 2.481 10 10 CECE CCCNCc1cc(F)c(N2CCC(O)CC2)c(F)c1 62709627 SULHCRGANDLVHV-UHFFFAOYSA-N 284.350 2.426 10 10 CECE C[C@H](N[C@@H]1CCC[C@H](C(=O)O)C1)c1c(O)cccc1O 300438406 BNBOLCKSMJRTDC-GARJFASQSA-N 279.336 2.392 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)[C@H]1CC12CCCCC2 2039091824 LMTDQRYWQXYXID-ZJUUUORDSA-N 252.318 2.310 10 10 CECE COC(=O)[C@](C)(CCC1CC1)NCCCN=[N+]=[N-] 2040315374 DKCKMMOLVRVEPX-LBPRGKRZSA-N 254.334 2.398 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@H]3[C@H]2C3(F)F)cc1O 2040563682 QHCOUOHZJVXCTD-YGOYTEALSA-N 255.264 2.231 10 10 CECE COCCOC[C@H]1CCCN1CCCCN=[N+]=[N-] 2041046213 XPVWJEAUGIIUGD-GFCCVEGCSA-N 256.350 2.204 10 10 CECE Nc1ccc(CCN2CCC(O)(C(F)(F)F)CC2)cc1 312217929 CTZVZJCUJNCNHL-UHFFFAOYSA-N 288.313 2.201 10 10 CECE CC1(C)CN(c2ccc3c(c2)NC(=O)[C@H]3O)CC1(F)F 2158383974 SEUQDKTZLHPVMV-NSHDSACASA-N 282.290 2.154 10 10 CECE COc1ccc(O)c([C@@H](C)N2CC[C@@]3(CCNC3)C2)c1 312627062 ROPALUIVUVUBDC-MLGOLLRUSA-N 276.380 2.147 10 10 CECE CCOc1cccc(CN[C@H]2CCCCN(C)C2)c1O 2158576763 OSCAOKCGYICHGA-AWEZNQCLSA-N 278.396 2.365 10 10 CECE CN(C(=O)CN(C1CCC1)C1CC1)c1ccc(N)cc1 2161350621 DUGBGPRYMBXDNT-UHFFFAOYSA-N 273.380 2.249 10 10 CECE CCC1(C)CC(=O)N(CCc2ccc(N)cc2)C(=O)C1 2171253637 PDAKICKSLIYXRR-UHFFFAOYSA-N 274.364 2.377 10 10 CECE CCCNCc1ccc(N2CC[S@@](=O)[C@H](C)C2)c(C)c1 2171972530 PAAUQDVOHANDQK-JLTOFOAXSA-N 294.464 2.452 10 10 CECE Nc1ccc(OCCCN2CCOCC23CCC3)cc1 707231835 KCOXVFSEFSKLJG-UHFFFAOYSA-N 276.380 2.293 10 10 CECE CC[C@]1(C)COCCN1C(=O)Nc1ccc(N)cc1 707266492 URNXNBCYXAIZOE-CQSZACIVSA-N 263.341 2.302 10 10 CECE CC[C@@]1(C(=O)O)CCN(Cc2cc(F)cc(F)c2O)C1 708087323 AKIIEIHREXUHCH-CQSZACIVSA-N 285.290 2.357 10 10 CECE c1cc2c(cc1N1CCC3(CCNC3)CC1)OCCO2 2162674248 CJQLUQHSPNGOCC-UHFFFAOYSA-N 274.364 2.038 10 10 CECE C[C@H](N)c1ccc(N2CCC(C)(N(C)C)CC2)cc1O 709910791 PDFZAHJVOFOUIU-LBPRGKRZSA-N 277.412 2.332 10 10 CECE CN(CCC1CCC1)CC(=O)N(C)c1ccc(N)cc1 688701240 RHIBEMWRGKMWFA-UHFFFAOYSA-N 275.396 2.354 10 10 CECE NCc1cc(F)c(N2CCC[C@@H]3COC[C@@H]32)c(F)c1 690298408 VYEAIUXTVVJDCP-MFKMUULPSA-N 268.307 2.039 10 10 CECE C[C@@H]1NCCN([C@@H](C)c2ccc(N(C)C)cc2)[C@@H]1C 379464525 GSUDBAFLEKTVPV-MJBXVCDLSA-N 261.413 2.496 10 10 CECE C[C@H](NCc1cnc(O)[nH]1)c1ccc(N(C)C)cc1 379733985 CCUIVGFDXAQZQW-JTQLQIEISA-N 260.341 2.032 10 10 CECE COc1cc2c(cc1OC)N(C)C1(CCCC1)C(=O)N2 380954337 KZPVPZINRGTZAX-UHFFFAOYSA-N 276.336 2.405 10 10 CECE CCn1ncc(CN(Cc2ccc(N)cc2)C2CC2)n1 2172438774 NJQWSMKIOJOMFC-UHFFFAOYSA-N 271.368 2.045 10 10 CECE CCOc1cccc(CN[C@@H]2CCCC23OCCO3)c1O 715591359 BXNNITFKZIBJTO-CQSZACIVSA-N 293.363 2.176 10 10 CECE CCNCc1ccc(N2C[C@H](C)[C@](C)(CO)C2)cc1 694707738 RVVQTGAKRYTUST-BBRMVZONSA-N 262.397 2.251 10 10 CECE CC(C)[C@@H]1CN(c2ccc3c(c2)CCCO3)CCN1 383614218 BAHJHQIDSRJTDG-HNNXBMFYSA-N 260.381 2.446 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@H]2C)c(C)c1 384813745 IRNWXNOJVKEAHF-HIFRSBDPSA-N 262.397 2.454 10 10 CECE COc1nc([C@@H](O)CCc2ccc(N)cc2)cs1 695816445 AURUGNMTPVVSJI-LBPRGKRZSA-N 264.350 2.400 10 10 CECE CCN[C@H](C)c1ccc(N2CC(=O)N[C@H](C)C2)cc1Cl 387237959 JACVDQWJWJDTIO-GHMZBOCLSA-N 295.814 2.335 10 10 CECE Nc1cc(O)ccc1NS(=O)(=O)Cc1ccccc1F 396670056 RLEWTJMGEFAHNL-UHFFFAOYSA-N 296.323 2.055 10 10 CECE C[C@@H](O)c1ccc(N(C)CCN(C)C2COC2)cc1Cl 2173098947 BWZAETLJVJGDNC-LLVKDONJSA-N 298.814 2.160 10 10 CECE COC[C@H](N[C@@H](C)c1ccc(O)cc1O)C1CC1 397472638 XVDMEIIGRLYRAF-ZANVPECISA-N 251.326 2.173 10 10 CECE CN1CCCc2cc(CNCC3(N(C)C)CC3)ccc21 397821987 KFKKRLCBFAPSDV-UHFFFAOYSA-N 273.424 2.253 10 10 CECE C[C@@]1(C2CC2)CN(CCc2ccc(N)cc2)CCO1 822256388 NUQQXRBHDIFRIV-INIZCTEOSA-N 260.381 2.312 10 10 CECE CCNCc1ccc(N2CCO[C@@H]([C@H](C)O)C2)c(Cl)c1 2174146269 ASRIBXJGAICDRB-XHDPSFHLSA-N 298.814 2.036 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2COCCC2(F)F)cc1O 2168227415 KFFDXWLDVMSBEN-ZANVPECISA-N 287.306 2.306 10 10 CECE FC1(F)Oc2ccc(N3C[C@@H]4CNCC[C@H]4C3)cc2O1 2168776128 WQOILMYVNYAMML-UWVGGRQHSA-N 282.290 2.054 10 10 CECE CCN1CCc2cc([C@H](O)C3[C@H]4CC(N)C[C@H]34)ccc21 2169208011 HNSZRFGOAASMAT-YJDQRHKKSA-N 272.392 2.086 10 10 CECE COc1ccc(N2C[C@H]3CCCC[C@]3(N)C2)cc1OC 2169636040 VXFNUQVSVQIEKQ-WBMJQRKESA-N 276.380 2.412 10 10 CECE CCNCc1ccc(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)c(F)c1 2176454223 MXCOTMSBKQKTEY-WOSRLPQWSA-N 278.371 2.406 10 10 CECE COc1cc(N)c(N(C)Cc2cc(C)no2)cc1OC 2170562291 ZOOIUMRBIBCXKT-UHFFFAOYSA-N 277.324 2.219 10 10 CECE CCNCc1ccc(N(C)C2COCCOC2)c(Cl)c1 2188058453 MOVAIDCUUIKCIP-UHFFFAOYSA-N 298.814 2.301 10 10 CECE CCN1CCc2cc([C@@H](O)[C@]3(CN)CC3(F)F)ccc21 2196696116 KFYKIVWYBYAUST-ZIAGYGMSSA-N 282.334 2.087 10 10 CECE Nc1ccc(OC[C@H](O)CO[C@@H]2CCCC[C@H]2F)cc1 2197027440 VFSZMXPUUNLSET-NWANDNLSSA-N 283.343 2.306 10 10 CECE OCc1ccc(N2C[C@@H]3COCC[C@H]32)c(C(F)(F)F)c1 2193275077 NNMIZFXDZSSOEE-ZYHUDNBSSA-N 287.281 2.423 10 10 CECE CN(C(=O)c1cc(O)c(O)c(O)c1)[C@H]1CCCC1(F)F 2188921265 AWMRZOLLUANGLC-JTQLQIEISA-N 287.262 2.063 10 10 CECE Nc1ccc(CN2CC[C@@H]3CC[C@H](C(=O)O)C[C@@H]32)cc1 2197563762 CVYQMPDJGGJHBX-YDHLFZDLSA-N 274.364 2.344 10 10 CECE COCC1(NCc2c(O)ccc3ccccc23)COC1 2189265313 YZZGPRNTJNLVMR-UHFFFAOYSA-N 273.332 2.050 10 10 CECE CCC(=O)N1CCN(c2ccc([C@@H](C)N)cc2Cl)CC1 2182601672 IFKMIYMECSZVNO-LLVKDONJSA-N 295.814 2.418 10 10 CECE CC(C)(CC(F)(F)F)NC(=O)COc1ccc(N)cc1 2190268454 HAKOYOJAGHGJML-UHFFFAOYSA-N 290.285 2.495 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@@H]3CN(C)C[C@H]3C2)c(F)c1 2194532085 OOSVUUSYTKKPMO-USWWRNFRSA-N 282.334 2.016 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@H](C3(O)CC3)C2)c(F)c1 2194519790 SDEUUZBSAHKXPE-KOLCDFICSA-N 283.318 2.369 10 10 CECE CN(Cc1cccnn1)c1ccc2c(c1)CCC[C@H]2O 2184693562 SHUGHGDIVGGONL-MRXNPFEDSA-N 269.348 2.483 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@@H]4C[C@@H](O)[C@H]4C3)ccc21 2184679909 NCCJNZJBPMJSCF-KKBVYLPWSA-N 272.392 2.100 10 10 CECE C[C@@H]1C[C@@H]2CN(c3ccc4c(c3)CC[C@H]4N)CCN2C1 2184725905 LSKXLQMURXDCIQ-SRCQZFHVSA-N 271.408 2.163 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](CO)CC[C@H]3C)ccc21 2184727877 RPQJDRPHFPHCRD-IIYDPXPESA-N 274.408 2.491 10 10 CECE C[C@H](N[C@@H]1CC(C)(C)[C@H]1O)c1ccc(F)cc1O 2043163146 WQEDTLUKWYRCPD-KDDOJWQBSA-N 253.317 2.341 10 10 CECE CCN[C@H](C)c1cc(F)c(N2CC(F)(CO)C2)c(F)c1 2194700606 UUUWREPAKQNTDF-SECBINFHSA-N 288.313 2.156 10 10 CECE COc1ccc(N2CCNCC(C)(C)C2)c(F)c1 2044338959 QEDRMTYMXXJLMT-UHFFFAOYSA-N 252.333 2.270 10 10 CECE COc1ccc(N2C[C@@H](N)C3(CCC3)C2)c(F)c1 2044348741 WBYSGVMHXDLYFK-CYBMUJFWSA-N 250.317 2.152 10 10 CECE OC1C[C@@H]2CN(c3ccc4c(c3)CCC[C@@H]4O)C[C@H]2C1 2185081685 CETJFRHCXQMRIX-XNJGSVPQSA-N 273.376 2.263 10 10 CECE C[C@H](N)c1ccc(N2CC3CC(F)(C3)C2)cc1O 2045324543 WWIDPHLLBMZVLE-IPWFMCSPSA-N 250.317 2.350 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3C[C@]3(O)C2)c(Cl)c1 2051365285 FAAWMBLFKKXRMG-PUYPPJJSSA-N 267.756 2.354 10 10 CECE C[C@@H](NCc1ccn2nncc2c1)c1ccccc1O 2186072930 YTGYMKZOJWWKAV-LLVKDONJSA-N 268.320 2.286 10 10 CECE CN[C@@H]1CCc2cc(N(C)[C@H]3CCOC[C@H]3F)ccc21 2186745113 GIESTIULDGJGJX-OAGGEKHMSA-N 278.371 2.457 10 10 CECE CCN1[C@@H](C)CN(Cc2cc(OC)ccc2O)C[C@H]1C 2186930084 RKQXNGBBQOIDGS-BETUJISGSA-N 278.396 2.315 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])C1CC2(C1)CC2(F)F 2187446602 NLWLABMIXUKHAX-INWMGODYSA-N 288.298 2.253 10 10 CECE C[C@H](c1ccccc1O)N(C)c1nccn2cnnc12 2192598384 OJNMCECBDZOVDS-SNVBAGLBSA-N 269.308 2.027 10 10 CECE COc1ccc(CN(C)CC[C@H]2CCCO2)c(O)c1 2101054707 WRASUIDCDJJPPH-CYBMUJFWSA-N 265.353 2.402 10 10 CECE COC1CC2(CC(NCc3cccc(O)c3O)C2)C1 2101043269 DGCSZWBHXLKEAS-UHFFFAOYSA-N 263.337 2.145 10 10 CECE NCc1ccc(N2CC=CCC23COC3)cc1Cl 2081869700 GAZCTQFZINLXBQ-UHFFFAOYSA-N 264.756 2.334 10 10 CECE Nc1ccc(CCC(=O)NC[C@@H]2C[C@H]2C(F)F)cc1 2103536609 MFUZJKNMRXBOGZ-CMPLNLGQSA-N 268.307 2.219 10 10 CECE CCN(CCN1CCC[C@H]1C)c1ccc(CN)cc1 2104899446 ZWONXVVCWXIMNW-CQSZACIVSA-N 261.413 2.456 10 10 CECE CN1CCc2cc([C@@H]3N[C@](C)(C(F)F)CO3)ccc21 2105086181 LIMSCJQCJMIYDC-OCCSQVGLSA-N 268.307 2.321 10 10 CECE C[C@H]1CNC[C@@H](C)N(c2ccc3c(c2)COCC3)C1 2106350702 NNLOHDJKJRYXQY-QWHCGFSZSA-N 260.381 2.194 10 10 CECE C[C@H]1Cc2cc(N3CC4(CCNCC4)C3)ccc2O1 2106378200 WOWRPUQDQRAJGR-LBPRGKRZSA-N 258.365 2.200 10 10 CECE COc1ccc(N2C[C@H]3CNC[C@H]3C2(C)C)c(C)c1 2106346332 RVPCBWDSOJWPRP-TZMCWYRMSA-N 260.381 2.438 10 10 CECE CCN1CCc2cc([C@@H](O)[C@]3(C)CCNC3)ccc21 2106792781 HIZDTFRTIJARSP-HZPDHXFCSA-N 260.381 2.102 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3NCC3(C)C)ccc21 2106829669 YWPPGCYQCOYAAP-CABCVRRESA-N 260.381 2.100 10 10 CECE CCCN[C@H](c1ccc(N(C)C)cc1)C1(O)CSC1 2106853568 SFYZBMBGSCQXKQ-CQSZACIVSA-N 280.437 2.271 10 10 CECE C[C@@H]1CC[C@@H](C[C@H](NN)c2ccc(N(C)C)cc2)O1 2106821470 VICDYRAPQKFECT-UGFHNGPFSA-N 263.385 2.215 10 10 CECE CN(C[C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)c1ccc(O)c(O)c1 2107709153 RUXZTLIGMKDBSH-WLLOZRIZSA-N 261.321 2.216 10 10 CECE C[C@@H](COC[C@@H](O)COc1ccc(N)cc1)C1CC1 2087990904 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253.252 2.244 10 10 CECE CN1CCc2cc([C@](C)(O)[C@H]3C[C@@H]4CCO[C@H]34)ccc21 2358112470 OFHDKNZWNOTEMB-CSFVBSKPSA-N 273.376 2.311 10 10 CECE Cc1ccc(O)c(CN2CCC[C@@H](Cn3cncn3)C2)c1 128504924 PABJSIYVFNWGDR-CQSZACIVSA-N 286.379 2.204 10 10 CECE CCO[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc(N)cc2)C1 42408469 CHSHVCRXFHGZKZ-WFASDCNBSA-N 291.395 2.097 10 10 CECE CN(C)[C@H](CNCc1cccc(O)c1O)c1ccccc1 41116476 AUXCUDTYDXHHBP-OAHLLOKOSA-N 286.375 2.490 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N1CCOC[C@H]1C 227042870 LYDFCSRMGGKNEG-TXNVCOODSA-N 261.321 2.318 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](CO)OC[C@@H]2C)cc1Cl 221139435 BLFHNSQCKZPQCY-GVXVVHGQSA-N 298.814 2.206 10 10 CECE CC[C@H](c1ccccc1O)N(C)CC(=O)NC(C)C 133383025 RCEOZQMHLPFQFQ-CYBMUJFWSA-N 264.369 2.300 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](O)C2)c(Cl)c1 227054713 ZEIUXNJHOMMBDU-GXSJLCMTSA-N 254.761 2.191 10 10 CECE COc1ccc(O)c([C@H](C)NCc2nnc3ccccn23)c1 192943421 SOUNGOKIKBRLKD-NSHDSACASA-N 298.346 2.294 10 10 CECE CC[C@](NCCN=[N+]=[N-])(C(=O)O)c1ccc(F)cc1 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2.128 10 10 CECE COc1csc(N(C)Cc2ccccc2O)n1 2017508953 XXNTWYSPLOLSRF-UHFFFAOYSA-N 250.323 2.494 10 10 CECE Cc1[nH]ncc1CCCNC(=O)Nc1ccc(N)cc1 50183825 VNQPVVPREYPNIN-UHFFFAOYSA-N 273.340 2.055 10 10 CECE O=[N+]([O-])c1cccc(CNCc2ccc(O)cc2O)c1 52926138 KMBOZOCRRGDYOR-UHFFFAOYSA-N 274.276 2.296 10 10 CECE COCCSCCNCc1cccc(F)c1O 2024836366 RGLSQKKMLJSQLU-UHFFFAOYSA-N 259.346 2.001 10 10 CECE CS[C@@H]1COC[C@H]1NCc1cc(Cl)ccc1O 2026371568 NJKMRMOAPHCCCJ-ZYHUDNBSSA-N 273.785 2.266 10 10 CECE C[C@H](N)c1ccc(N2CC3CC2(CF)C3)cc1O 2030291557 BCTHFGFGXVQEMJ-IPWFMCSPSA-N 250.317 2.350 10 10 CECE C[C@](O)([C@@H]1CCCSC1)[C@H](N)c1ccccc1O 2031149030 UWDGBSXVJVKDTP-HONMWMINSA-N 267.394 2.286 10 10 CECE CC[C@@](O)([C@@H](NC)c1ccccc1O)C(F)(F)F 2031155371 WNHJLXCGXXNTMI-WDEREUQCSA-N 263.259 2.356 10 10 CECE CC(C)(C)C(=O)Nc1ccnn1-c1ccc(N)cc1 61628779 QEYPVVKCTGIBRZ-UHFFFAOYSA-N 258.325 2.439 10 10 CECE N[C@@H]1CCCC12CN(Cc1cc(Cl)ccc1O)C2 2036979775 PAFPOTHUZRAYEE-CYBMUJFWSA-N 266.772 2.359 10 10 CECE 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Cc1ccc(O)c2c1[C@H](C)C[C@H]2N1CCO[C@H](C(=O)O)C1 86806095 RYTJVPMXYQZVFP-WZRBSPASSA-N 291.347 2.034 10 10 CECE CN(CCc1ccccc1)CC(=O)Nc1ccc(N)cc1 88193592 VSSQQYKAWQZIHB-UHFFFAOYSA-N 283.375 2.382 10 10 CECE Cc1cc(CNCCOC(N)=O)c(C)n1-c1ccccc1 135185368 BSYRSJWDVYSFMD-UHFFFAOYSA-N 287.363 2.279 10 10 CECE CCC[C@H](NCc1ccc2c(c1)CCN2C)C(=O)O 86733435 BACJEHQAOSDBIT-ZDUSSCGKSA-N 262.353 2.022 10 10 CECE CCO[C@H]1C[C@H]1NCc1cc(Br)ccc1O 381602600 ONXSHTKHTJUFFL-PWSUYJOCSA-N 286.169 2.422 10 10 CECE Nc1ccc(OCCSc2ncns2)cc1 87513688 QAVWAVIRMHZWDT-UHFFFAOYSA-N 253.352 2.291 10 10 CECE CC(C)C[S@](=O)[C@@H](C)C(=O)Nc1ccc(N)cc1 40970070 PXQVBJQKBABTGS-XTZNXHDOSA-N 268.382 2.001 10 10 CECE N[C@H](CF)c1c(Br)ccc(F)c1O 238683519 JNGHSSOULYHHPF-ZCFIWIBFSA-N 252.058 2.263 10 10 CECE CNCc1ccc(OC)c(CS[C@@H](C)[C@H](C)O)c1 234416247 SESFJTPMNGRUKT-QWRGUYRKSA-N 269.410 2.417 10 10 CECE Oc1cc(F)c(Br)c([C@@H]2CCCNC2)c1O 258533659 MASHYBMFMNNIIS-ZCFIWIBFSA-N 290.132 2.466 10 10 CECE NCCCCc1c(Br)cc(F)c(O)c1O 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[N-]=[N+]=NCCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 701316546 LHJSYPWGBXHFDT-UHFFFAOYSA-N 269.648 2.288 10 10 CECE CN1C[C@H]2CN(c3ccc(CN)cc3Cl)C[C@@]2(C)C1 702269653 FKFUEUUSOPLTSS-SWLSCSKDSA-N 279.815 2.187 10 10 CECE CO[C@H]([C@H](C)NCCc1ccc(N)cc1)C(F)(F)F 1889446052 VQHYYSYWKAGTBX-JOYOIKCWSA-N 276.302 2.367 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1cc(F)ccc1O 691690667 WOXZWVOSLXRYTH-SECBINFHSA-N 264.260 2.446 10 10 CECE CNCc1ccc(N2CC[C@H]3COC[C@@H]3C2)cc1C 690282774 AGBCLPGBEHLLNH-GJZGRUSLSA-N 260.381 2.187 10 10 CECE Cc1ocnc1CNCc1cc(F)cc(F)c1O 708480771 KUBRGTWKURUYEL-UHFFFAOYSA-N 254.236 2.257 10 10 CECE C[C@@H]1CN([C@@H](C)c2ccc(F)cc2O)C[C@H]1CN 708836925 RZCKONINRCCKLV-OUAUKWLOSA-N 252.333 2.119 10 10 CECE COC(=O)N(C)CCN(C)c1ccc([C@H](C)O)cc1F 690814368 HEUGXYGMYOCHFQ-JTQLQIEISA-N 284.331 2.013 10 10 CECE CNC(=O)[C@@H](CC(C)C)NCc1c(O)cccc1Cl 83552249 CZQWNJXNABTNKG-GFCCVEGCSA-N 284.787 2.296 10 10 CECE Oc1ccc(CNC[C@@H]2CCC3(CCC3)O2)cc1O 711516031 YXOQGMGIIFPVFQ-LBPRGKRZSA-N 263.337 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CECE COCCCSCC(=O)c1ccc(O)c(O)c1 104449154 WMONDUGHBMLEFR-UHFFFAOYSA-N 256.323 2.050 10 10 CECE CNCc1cc(F)c(N(C)CCCOC)c(F)c1 62719360 QZFNICQIGMGRCZ-UHFFFAOYSA-N 258.312 2.157 10 10 CECE COCCNCc1ccc(N(C)Cc2ccncc2)cc1 62735943 CPRMKCKMTHUCBV-UHFFFAOYSA-N 285.391 2.454 10 10 CECE Nc1ccc(N[C@@H](O)C(Cl)(Cl)Cl)cc1 306389169 WOSXLOXRVBKXAK-ZETCQYMHSA-N 255.532 2.369 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H](O)C3[C@@H](C)[C@@H]3C)ccc21 2357109440 QUPQZKBUYDHAHS-ZAGRPGIDSA-N 274.408 2.332 10 10 CECE C[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C(C)(C)CO1 181310483 QVBSGHBOGPGKJU-ZRQQLDRUSA-N 291.347 2.137 10 10 CECE CC[C@H](CCO)N[C@@H](C)c1ccc(F)c(F)c1O 187731548 CGMRTEOGJFGOCX-DTWKUNHWSA-N 259.296 2.482 10 10 CECE NC(=O)C[C@@H]1CCCCN1Cc1c(O)cccc1Cl 120662044 BJGJBIZRFAJNOX-JTQLQIEISA-N 282.771 2.276 10 10 CECE CCOC(=O)C[C@H](C)N(C)Cc1cc(C)ccc1O 183185275 YCVIHIMPEUOWEU-LBPRGKRZSA-N 265.353 2.474 10 10 CECE N[C@H](CCO)c1ccc(Br)c(Cl)c1O 218849285 KACXQUWSIDEFNA-SSDOTTSWSA-N 280.549 2.190 10 10 CECE C[C@@H]1c2ccccc2O[C@@H]1C(=O)NCc1ccc(O)c(O)c1 182531818 VUIRESSVRNFTPE-HWPZZCPQSA-N 299.326 2.279 10 10 CECE Cc1cc(N2CCC[S@](=O)CC2)ccc1/C=C\C(=O)O 321633088 ACWCYBUMJJPCHI-MNBNYPOFSA-N 293.388 2.052 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@@H](C)N(C)CC(=O)O)c1 86725680 TXEILWUBPIFWMV-SNVBAGLBSA-N 294.351 2.208 10 10 CECE CC(C)C[C@@H](C)NC(=O)COc1ccc(N)cc1 40303083 WSUBSNJKOGQALT-LLVKDONJSA-N 250.342 2.198 10 10 CECE Cc1cccc([C@H]2N[C@H](C(=O)O)C(C)(C)S2)c1O 83237023 AZYXKELAHGQTIK-MNOVXSKESA-N 267.350 2.267 10 10 CECE O=C(NC[C@H]1CCCCS1)c1ccc(O)c(O)c1 230176922 PBBOSRVDCUCKHV-SNVBAGLBSA-N 267.350 2.113 10 10 CECE CN(C)c1ccc([C@]2(C)C(=N)NC(=O)N2CC2CC2)cc1 94517067 XLNSFPIWKDUNAA-MRXNPFEDSA-N 286.379 2.380 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C3CC3)c(Cl)cc21 92750198 LXRUERMSUQBMKI-LBPRGKRZSA-N 265.744 2.151 10 10 CECE CN[C@H]1CCCN([C@@H](C)c2cc(F)ccc2O)C1 94621893 YEMNTDSKYSIISF-JQWIXIFHSA-N 252.333 2.276 10 10 CECE CCn1ncc(CN[C@H]2C[C@H](C)c3c(F)ccc(O)c32)n1 527922427 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2.131 10 10 CECE CCN(C(=O)[C@@H]1CCO[C@@H](C)C1)c1ccc(N)cc1 2126483018 QWCYDWBIJWUMLN-NWDGAFQWSA-N 262.353 2.437 10 10 CECE Nc1cc(=NCc2ccccc2O)[nH]cc1Br 2216926936 VLZRWIDGNMSRAA-UHFFFAOYSA-N 294.152 2.166 10 10 CECE C[C@@]1(NC(=O)c2cccc(O)c2O)CCC(F)(F)C1 1965273718 RSYPZKOAOSBPAQ-GFCCVEGCSA-N 271.263 2.406 10 10 CECE CC(=O)Oc1ccc2c(c1O)C(=O)c1ccccc1C2=O 13481199 ODHXQAROKZBNQO-UHFFFAOYSA-N 282.251 2.093 10 10 CECE Nc1ccc(CS(=O)(=O)CCOCCC2CC2)cc1 2127768344 MRBCCUUPGLCOMM-UHFFFAOYSA-N 283.393 2.000 10 10 CECE O[C@H]1CCCc2cc(N3CC4(CCOC4)C3)ccc21 2128274666 QAVGWXVHKUBDKD-HNNXBMFYSA-N 259.349 2.283 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3N)C[C@]1(C)CO 2128323150 VIXVSKXXGMXOFJ-XFBWCDHKSA-N 260.381 2.087 10 10 CECE Nc1ccc(CC(=O)NCCc2c(F)cccc2F)cc1 151599012 WAJGQGIVNSOKQU-UHFFFAOYSA-N 290.313 2.448 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(Sc3nccs3)cc21 155759427 WZTTUMFJLHBUMQ-JTQLQIEISA-N 277.374 2.271 10 10 CECE C[C@H]1CN(c2ccc([C@H](C)N)c(O)c2)C[C@@H](C)O1 157833159 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FPQAKGAQGAOMBX-UHFFFAOYSA-N 280.393 2.474 10 10 CECE CC[C@@H]1OCC[C@H]1C(=O)N[C@H](C)c1ccccc1O 827946375 GCTOGQKWMBSNGJ-QKCSRTOESA-N 263.337 2.385 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H]3C[C@H]2C[C@H]3O)c1O 933957859 QAJVTXUINOLDBP-LJWDBELGSA-N 295.766 2.203 10 10 CECE COC[C@@H]1C[C@@H]1[C@@H](N)c1ccc2c(c1)CCCN2C 2133500718 MWLABWNCOCQTBL-DZKIICNBSA-N 260.381 2.351 10 10 CECE COc1ccc(N2CC[C@H]3CCNC[C@@H]3C2)cc1C 2141645364 IHTSRCXJJCOEIU-ZIAGYGMSSA-N 260.381 2.439 10 10 CECE CC[C@H](N)[C@@H]1CCN(c2ccc(OC)c(OC)c2)C1 107938199 LOWKJNPOGKZXDU-YPMHNXCESA-N 264.369 2.267 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N1CCN2C(=O)CC[C@@H]2C1 211715919 XSFRBMLDZZDCLO-ZYHUDNBSSA-N 294.782 2.413 10 10 CECE CCN(c1ccc(CNC2CC2)cc1F)C1COC1 1915664636 RPLQNPJNFGFAEL-UHFFFAOYSA-N 264.344 2.303 10 10 CECE C[C@@H]1CCO[C@@H]1CCNCc1ccc(O)cc1O 1918137694 UICYFAUSVJDPIR-QMTHXVAHSA-N 251.326 2.003 10 10 CECE OCc1ccc(NCc2cc3c(cc2O)OCO3)cc1 139073192 VUZQZSDIXJLCEG-UHFFFAOYSA-N 273.288 2.225 10 10 CECE N[C@@H](c1ccccc1O)[C@@]1(O)CCOc2ccccc21 1920341306 OBMVFURGRNDOMR-JKSUJKDBSA-N 271.316 2.062 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC=C[C@H]1C(=O)O 2136385369 APDZTWHVGRPIHV-SKDRFNHKSA-N 265.284 2.307 10 10 CECE CNCc1ccc(N(C)C2CC(OC)C2)cc1OC 2139683968 DFDHQAJJNOOMGO-UHFFFAOYSA-N 264.369 2.028 10 10 CECE COCCNCc1ccc(N(C)CCCCCO)cc1 227084680 VUHBPGNIFGVGEH-UHFFFAOYSA-N 280.412 2.021 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1C[C@@]12CCOC2 1968787916 ADJMMRKNOYJNPQ-PVXIVEMSSA-N 275.348 2.338 10 10 CECE CO[C@H](C(=O)NCc1cccc(C)c1O)C1CCC1 2139746181 QDFTUPRMGPNSQP-AWEZNQCLSA-N 263.337 2.132 10 10 CECE C[C@H]1[C@H](CC(=O)O)CCN1Cc1ccc(F)cc1O 2139771604 CDGCNUGPCHTBRD-UWVGGRQHSA-N 267.300 2.216 10 10 CECE OCc1cc(NCc2cccc(O)c2O)ccc1F 1924851684 AHTFMVPODFOEEF-UHFFFAOYSA-N 263.268 2.341 10 10 CECE Cc1cnc(NN)cc1N(C)Cc1ccccc1O 2136923377 WVVXUEVXRVGZEN-UHFFFAOYSA-N 258.325 2.018 10 10 CECE O=C(NC1CCCCC1)[C@H]1CNc2ccccc2N1 229876181 WMSZKWSQPOKBNH-CQSZACIVSA-N 259.353 2.342 10 10 CECE CCO[C@@H]1CCCN(c2ccc(CN)c(F)c2F)C1 233767221 MOVDHINPTLCXFF-LLVKDONJSA-N 270.323 2.429 10 10 CECE CC[C@H](N)c1ccc(N(C)Cc2cnn(C)c2)cc1 234033379 QXHMGEDPCVQTQW-HNNXBMFYSA-N 258.369 2.466 10 10 CECE COc1ccc(N2C[C@H](N)C[C@]23CCOC3)cc1Cl 2138255963 QBSBOFLKOHNSOC-YGRLFVJLSA-N 282.771 2.045 10 10 CECE COc1ccc(O)c(CN2CC[C@@H](C(=O)O)C[C@@H]2C)c1 234966046 YJSBSFLZKLYBSD-WDEREUQCSA-N 279.336 2.086 10 10 CECE Cc1cc(CN)ccc1N1CCCC[C@@H]1C1OCCO1 1941975864 ZWWSPXNQRLZSKS-OAHLLOKOSA-N 276.380 2.186 10 10 CECE CC1(C)CN(c2ccc(CN)c(Br)c2)[C@@H]1CO 1944085956 JARHNTVHAYIMKZ-GFCCVEGCSA-N 299.212 2.115 10 10 CECE O=C(c1ccc(O)c(O)c1)N(CC(F)(F)F)C1CC1 236626845 NLESSHOIMLBTDZ-UHFFFAOYSA-N 275.226 2.265 10 10 CECE C[C@@H](C1CNC1)N(C)Cc1c(O)cccc1Br 1948871482 HVHKXDMDHKNRHN-VIFPVBQESA-N 299.212 2.194 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2C[C@](C)(O)C(F)(F)F 2143450671 MEPRFMJNOXCNSJ-RNCFNFMXSA-N 288.313 2.382 10 10 CECE CC(C)(C)OC(=O)C[C@H](N)c1cccc([N+](=O)[O-])c1O 1951374373 DZWKBSSPDADJAS-VIFPVBQESA-N 282.296 2.032 10 10 CECE CN(C)c1ccc([C@H]2C[C@H](C(=O)O)CCN2)cc1F 1952538506 LNRHWCFFOHZHRW-ZYHUDNBSSA-N 266.316 2.017 10 10 CECE COCCCN1CCc2cc(OC)c(OC)cc21 1970282803 XWTMTGHICPEZEG-UHFFFAOYSA-N 251.326 2.103 10 10 CECE COc1ccc([C@H](C)NCCc2cnn(C)c2)c(O)c1 148804217 BRABOUGJQALRNK-NSHDSACASA-N 275.352 2.028 10 10 CECE Cc1ccc(O)c(CN[C@@H]2COCCC2(F)F)c1 1972757680 KSYZSQAKKPKTJB-GFCCVEGCSA-N 257.280 2.214 10 10 CECE CC[C@@H](COC(F)(F)F)NC(=O)Cc1ccc(N)cc1 1974015911 ZIUPQLMEYHRDDH-NSHDSACASA-N 290.285 2.243 10 10 CECE CN1CC[C@@H](NCc2c(O)cccc2F)CC12CC2 1974263400 XNCNKGUSABOBHZ-LLVKDONJSA-N 264.344 2.248 10 10 CECE C[C@H](N[C@H]1C[C@@H]2CCCCN2C1)c1ccc(O)cc1O 2144850067 OXLRWUCHJGVNQE-AVGNSLFASA-N 276.380 2.375 10 10 CECE CCOCOc1ccc(N2CCCNCC2)c(C)c1 157406963 WTLMSUXNQHZZIZ-UHFFFAOYSA-N 264.369 2.168 10 10 CECE COC(=O)c1c(C)n(C)c2cc3c(cc12)N(C)CC3 260258369 ZOILKHSYRAESOY-UHFFFAOYSA-N 258.321 2.266 10 10 CECE COC(=O)[C@](C)(Cc1cccc(F)c1)NCCN=[N+]=[N-] 158529406 UBQSJJWYELKIOD-ZDUSSCGKSA-N 280.303 2.200 10 10 CECE CCCO[C@H]1CCCN(Cc2cc(N)ccc2O)C1 42408419 CQIYVSDWKYEKDV-AWEZNQCLSA-N 264.369 2.365 10 10 CECE CC(C)Cc1nc(CN(C)Cc2ccc(N)cc2)no1 2148892425 RHNWCTNXCGHBRE-UHFFFAOYSA-N 274.368 2.482 10 10 CECE Oc1cc(Br)ccc1CNC[C@H]1CC[C@@H]1O 1994692254 WJPVPTCUGWJIQF-KCJUWKMLSA-N 286.169 2.015 10 10 CECE CO[C@H]1CN(c2ccc(CN)c(C(F)(F)F)c2)C[C@@H]1F 2146478306 KFNOWXFLNVTCBZ-RYUDHWBXSA-N 292.276 2.337 10 10 CECE C[C@H]1C[C@@H](C)CN1[C@@H](CN)c1ccc2c(c1)CCN2C 164115774 JEOZCHZVCWBVGN-IGCXYCKISA-N 273.424 2.409 10 10 CECE O=c1c2c(ccn1CC[C@@H]1CCCC1(F)F)CCNC2 2150795345 KFFNERNAGRXAJN-LBPRGKRZSA-N 282.334 2.320 10 10 CECE CC[C@@H](O)CN(CC)c1ccc(CO)cc1Cl 1999378215 RVBVENZAQYVKLU-LLVKDONJSA-N 257.761 2.430 10 10 CECE C[C@H]1C[C@H]1CS(=O)(=O)Nc1ccc(O)c(Cl)c1 2000624412 QWDMJNYGHIJTAL-YUMQZZPRSA-N 275.757 2.443 10 10 CECE Cc1csnc1CNC(=O)CCOc1ccc(N)cc1 2153319713 YNTRDYHULREMAE-UHFFFAOYSA-N 291.376 2.119 10 10 CECE CN1CCc2cc(CNCC34CC(CCO3)C4)ccc21 2153962286 OCQBLIYFSMNNEX-UHFFFAOYSA-N 272.392 2.338 10 10 CECE C[C@@H](NC[C@@H]1CCCCN1C)c1ccc(O)cc1O 44561634 OJNHBWOLFCEWOS-NEPJUHHUSA-N 264.369 2.233 10 10 CECE COC(=O)c1cnc(Oc2ccc(N)cc2)s1 2011474697 PIRBUBYDJVNRBF-UHFFFAOYSA-N 250.279 2.304 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCCO2)[C@H]1[C@H]2CN[C@H]1C2 2160561192 UKKBEPCSQCCBNI-LCSDZXHASA-N 272.392 2.098 10 10 CECE C[C@H]1CCC[C@H](C)C12NC(=O)N(CCCN=[N+]=[N-])C2=O 48804700 SMRXYGOWNHWYIV-UWVGGRQHSA-N 279.344 2.434 10 10 CECE COC(=O)CC[C@H](N)c1ccc(N2CCCC2)cc1 95769464 ZMYDXUCFZBPSPQ-AWEZNQCLSA-N 262.353 2.240 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CN[C@@H]2CCC[C@H]12 2016904795 USIMMCYZFCXOGU-XXILOJSOSA-N 251.761 2.475 10 10 CECE Oc1cc(F)ccc1CN[C@@H]1CCCC2(C1)OCCO2 2024891423 XTZCPZRDZUOCNL-CYBMUJFWSA-N 281.327 2.307 10 10 CECE CCN[C@](CSc1nccs1)(C(=O)O)C(C)C 2026509563 AYILKOQPDMILNH-NSHDSACASA-N 274.411 2.324 10 10 CECE COc1ccc(N(CCCN)[C@H]2CCSC2)cc1 2027194370 IRJYNBBNJDEFDB-ZDUSSCGKSA-N 266.410 2.356 10 10 CECE CCN[C@@H](c1ccc2nncn2c1)c1ccccc1O 2159848023 NEJFEOIZQFMZNJ-HNNXBMFYSA-N 268.320 2.134 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)c1cnc(C)s1 2031152914 HCMKDNCUOAIIQF-CHWSQXEVSA-N 264.350 2.151 10 10 CECE Nc1ccc(OCCN2CC(CC(F)F)C2)cc1 2034862313 BJBRNTLXRRERDL-UHFFFAOYSA-N 256.296 2.235 10 10 CECE Cc1cc(N2CC[C@@H](O)C2)ccc1CNCC(C)C 62738273 MERSASHTOPLQCM-MRXNPFEDSA-N 262.397 2.312 10 10 CECE CC[C@@H]1CO[C@H](C)CN1c1c(F)cc(CN)cc1F 62712049 SIOBCFQXOJOQGW-MWLCHTKSSA-N 270.323 2.427 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)C[C@@H]1CCNC1 2036984115 ZVFZPKPEPVCGQI-WDEREUQCSA-N 252.333 2.134 10 10 CECE O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)[C@@H]1CNc2ccccc2N1 300318442 COQMKCBWCCMOBN-AZHAFVHUSA-N 271.364 2.197 10 10 CECE Nc1ccc(CN2CC(COC(F)(F)F)C2)cc1 2038700450 YZPKVQJWGVDOIH-UHFFFAOYSA-N 260.259 2.237 10 10 CECE CCN(Cc1cc2c(cc1O)OCO2)[C@@H]1CCCOC1 402770460 SUFSIBYKIGWAKM-GFCCVEGCSA-N 279.336 2.122 10 10 CECE C[C@@H](N)c1ccc(N2CCC(F)(F)[C@H](CO)C2)c(F)c1 403864644 QVCRZHBNRNFYAX-KOLCDFICSA-N 288.313 2.299 10 10 CECE 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CCCn1cnnc1CN(C)c1ccc(OC)cc1 2108884531 BXEADGMZJUCAQK-UHFFFAOYSA-N 260.341 2.333 10 10 CECE CC(C)[C@@H]1C[C@@H]1NC(=O)CCOc1ccc(N)cc1 2088859746 YDMYCZTZZDPPBM-KBPBESRZSA-N 262.353 2.198 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]3CCC[C@@H]32)c1 2089214302 RGWFQSNRKXHRHZ-TVYUQYBPSA-N 260.337 2.027 10 10 CECE CNCc1ccc(N2C[C@@H](C)CC[C@@H]2CO)c(F)c1 2110611417 HYEUMSRKVIUIBC-WCQYABFASA-N 266.360 2.142 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)[C@@H]2[C@H]3CCC[C@H]32)cc1 2111127695 JOYHHZRQLIGSJX-OTJKEOIZSA-N 260.381 2.159 10 10 CECE CCn1ncnc1CN(C)c1ccc(CO)c(Cl)c1 2111751300 AXYQRVXAWXGGFK-UHFFFAOYSA-N 280.759 2.080 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1ccnc(F)c1 2092472813 QCIYJFAKGBHLAB-UHFFFAOYSA-N 259.284 2.075 10 10 CECE Cc1cc(N2CCC[C@H](CCO)CC2)ccc1CO 2093304480 OAYXGSKRAJDIDZ-AWEZNQCLSA-N 263.381 2.476 10 10 CECE CC(C)NCc1ccc(N(C)CC(F)(F)CO)cc1 2094612160 ARYDFKSLVDOBPT-UHFFFAOYSA-N 272.339 2.248 10 10 CECE CN(CC(C)(C)CO)c1ccc(CNC2CC2)cc1 2094617222 FIDYDJYZPHEUTC-UHFFFAOYSA-N 262.397 2.393 10 10 CECE COc1ccc(CNCC23CC(CN2C)C3)cc1C 2095755032 HEPLDIFALZPWHG-UHFFFAOYSA-N 260.381 2.187 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CCSC[C@@H]1C(=O)O 2201053383 JMWBVAXBUYNKRE-SMDDNHRTSA-N 294.420 2.316 10 10 CECE Cn1ccc2c1CN(c1ccc(CN)cc1F)CC2 2114537778 KRFYRVSWKUMKOA-UHFFFAOYSA-N 259.328 2.186 10 10 CECE CCCN(c1ccc([C@@H](C)N)cc1)[C@@H]1CCS(=O)(=O)C1 2201909382 VNVUYEMYHPGYLB-IUODEOHRSA-N 296.436 2.110 10 10 CECE Cc1cccc(CNC(=O)[C@]2(N)CCCC2(C)C)c1O 2204624392 MEMMZVZVDYJYBE-MRXNPFEDSA-N 276.380 2.224 10 10 CECE C[C@H](NC(=O)c1cccc(O)c1O)[C@@H]1CC12CCC2 2268390778 RCFSDQKGWOFYSM-ONGXEEELSA-N 261.321 2.406 10 10 CECE CCN(CCSC)c1ccc(OC)cc1CN 2214852635 FSXWRKVRKNTSJN-UHFFFAOYSA-N 254.399 2.343 10 10 CECE COc1ccc(N2CCC[C@H](CCO)C2)cc1F 2219621005 ZKSGQJPLEGTTQV-LLVKDONJSA-N 253.317 2.433 10 10 CECE COc1ccc(N(C[C@H](C)O)C2CC2)c(F)c1F 2219772311 ZPSUENCLQIGYHV-QMMMGPOBSA-N 257.280 2.323 10 10 CECE CC(C)CN(C[C@H](C)O)c1ccc([C@@H](C)O)c(O)c1 2272341163 TUWGQGUJCKPVPO-NWDGAFQWSA-N 267.369 2.289 10 10 CECE CO[C@@]12CC[C@H]1CN(c1ccc([C@@H](C)N)cc1F)C2 2230468384 LZSWRYFLDZZFBK-IFUGULHKSA-N 264.344 2.461 10 10 CECE CC[C@H](C)NCc1ccc(N2CC(C)(O)C2)c(C)c1 2231459562 SHFYJEFDUVFQRU-ZDUSSCGKSA-N 262.397 2.454 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)c(C)c1 2232092172 OZOYGNPAARXGKK-AEIGPULVSA-N 260.381 2.235 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H](O)[C@@H](C2CC2)C1 2232095872 KGEVBONKPSMHLU-DJSGYFEHSA-N 260.381 2.222 10 10 CECE C[C@]1(C(=O)O)CC[C@H]1C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2234177333 RQVGGHSCISTFLQ-KWBADKCTSA-N 280.328 2.036 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](F)C[C@@H](O)C2)c(F)c1 2234670657 KFCGSWPJCALAHY-KGYLQXTDSA-N 284.350 2.405 10 10 CECE CCOc1ccc(N2C[C@@H]3C[C@H]3[C@H]2CO)cc1OCC 2234892833 FPCCDHCMVFXVMC-IACUBPJLSA-N 277.364 2.301 10 10 CECE CCN(CCOCCO)c1ccc(OC2CCC2)cc1 2234888488 HHPQWHPCRCLOGC-UHFFFAOYSA-N 279.380 2.453 10 10 CECE CC[C@]1(O)CCN(c2cc(OC)c(OC)c(OC)c2)C1 2235134975 PWHMMZCMYYSYSH-HNNXBMFYSA-N 281.352 2.064 10 10 CECE COc1ccc(N(C)[C@@H]2CCOCC2(C)C)c(CO)c1 2236001679 IPIORWJHNYKSBQ-OAHLLOKOSA-N 279.380 2.439 10 10 CECE COC[C@@H]1CN(c2ccc(OC)cc2CO)CC1(C)C 2236001945 KNNUNWZPGSGPAO-ZDUSSCGKSA-N 279.380 2.296 10 10 CECE COc1ccc(N2CCCC(C)(C)[C@@H]2CO)c(CO)c1 2236000806 BSJVFKWLNWIQDL-HNNXBMFYSA-N 279.380 2.175 10 10 CECE OC[C@@H]1CN(c2ccc(OC(F)(F)F)cc2)CCS1 2226539858 CQSGSOFPAAUJTC-NSHDSACASA-N 293.310 2.499 10 10 CECE CN1CCCc2cc(N3CC[C@@H]4C[C@@]4(O)C3)ccc21 2226653679 CVGYAMZQCAEVAF-CZUORRHYSA-N 258.365 2.030 10 10 CECE CCN1CCc2cc(N3CC[C@H](CCO)C3)ccc21 2226658520 PYMBIDPPZAOCPP-CYBMUJFWSA-N 260.381 2.278 10 10 CECE O[C@@H]1C[C@H]2CN(c3ccc(OCC(F)F)cc3)C[C@@H]12 2226740308 MMFHOSZWFHYUAG-ZWKOPEQDSA-N 269.291 2.148 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@H]2C(C)C)cc1OC 2226800478 UBBBJOMBMWSKNI-IUODEOHRSA-N 265.353 2.299 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@H](F)C2)c(CCN)c1 2227688252 OPSPCCCTGHKFGM-BXUZGUMPSA-N 266.360 2.381 10 10 CECE CO[C@@H]1CC[C@@H]1CN(C)c1ccc([C@H](C)N)c(O)c1 2227829006 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NC[C@]12C[C@H]1CN(c1ccc(OC(F)F)cc1)C2 2263910047 ALROBDARQUUQIL-ZANVPECISA-N 254.280 2.073 10 10 CECE Oc1ccc([C@H]2NCC3(CO2)CC(F)(F)C3)cc1O 2266926805 HGYJKIDRZAMDAZ-NSHDSACASA-N 271.263 2.132 10 10 CECE Cc1cc(N2CCN(C)[C@@H]3CC[C@@H]32)ccc1[C@@H](C)N 2269664471 AWFWBVGGNAAABE-WQVCFCJDSA-N 259.397 2.298 10 10 CECE Cc1cc(N2CCCCC2)ccc1C=C1NC(=O)NC1=O 2294034229 PUDNAIYXDHIHAA-UHFFFAOYSA-N 285.347 2.166 10 10 CECE OCc1cc(F)c(N2CCc3cccnc3C2)c(F)c1 2290249041 AZMWYZBMCUVDCE-UHFFFAOYSA-N 276.286 2.415 10 10 CECE CN(C[C@@H]1CCC1(C)C)C(=O)c1cc(O)c(O)c(O)c1 2280826352 BUTLXSNLUGFHPB-JTQLQIEISA-N 279.336 2.312 10 10 CECE CCOC[C@H]1CN(c2ccc([C@H](C)O)c(C)c2)CCO1 2285149103 ODKLHHUHSVWADE-DZGCQCFKSA-N 279.380 2.290 10 10 CECE CN1CCc2cc(CN(CC(=O)O)C3CCC3)ccc21 2288031150 UKWWUDPWZFXJKI-UHFFFAOYSA-N 274.364 2.118 10 10 CECE Oc1c(Br)cccc1CN[C@@H]1C[C@@H]2CO[C@H]1C2 2298567508 NDZOJMDUIMTDTE-AXTRIDKLSA-N 298.180 2.422 10 10 CECE CCOC(=O)c1cccc(NCc2ccc(N)cc2)n1 1162784793 WQBUXFQXWUQIQF-UHFFFAOYSA-N 271.320 2.453 10 10 CECE CN(C[C@H]1[C@@H]2CCO[C@@H]21)c1ccc(CN)c(Cl)c1 2309875288 JHYZVIXKNJUKKA-OBJOEFQTSA-N 266.772 2.270 10 10 CECE COc1cc(N(C)C[C@H]2C[C@@H](F)C2)ccc1CN 2327442553 KZMCZISUBREZMI-KLPPZKSPSA-N 252.333 2.338 10 10 CECE O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2Cc1cc(Cl)ccc1O 2329069623 KUIFEXFAMIKYBG-SDDRHHMPSA-N 281.739 2.483 10 10 CECE C[C@@H](N[C@@H]1CC[C@H]1N(C)C)c1ccc(N(C)C)cc1 2329141523 NZAMSQZXQBMASU-DAXOMENPSA-N 261.413 2.496 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CC[C@@H]2C[C@@H]2C1 2329708864 YZUQHZOZTZBIRC-JLLWLGSASA-N 261.321 2.358 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1C[C@@H]2[C@@H]1[C@@H]1CC[C@H]2O1 2331833581 UHDQETAXMVTWIM-LWOQNUMLSA-N 263.312 2.187 10 10 CECE CNCc1cc(OC)ccc1N1C[C@@H]2C[C@H]1[C@@H]1C[C@@H]21 2333715293 MUHVDQKZNCQUDB-ZIEJDFEHSA-N 258.365 2.259 10 10 CECE C[C@H](NC(=O)[C@@H]1COCC1(C)C)c1ccccc1O 2336201756 WQUFXPSTWVBZST-JQWIXIFHSA-N 263.337 2.242 10 10 CECE CN(C[C@@H](O)C1CC1)c1ccc(CO)c(C2CC2)c1 2339165868 LZRCDNDBIXZKAN-MRXNPFEDSA-N 261.365 2.263 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC[C@H]2C[C@]1(CN)C2 2340764337 AAULWWMQLORUMY-ZIBATOQPSA-N 264.344 2.406 10 10 CECE Cc1c([C@H](C)O)ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c1C 2340852114 DKVOOWGRYIGTKK-YXAMBPQSSA-N 261.365 2.316 10 10 CECE CC(C)CCC(=O)N1CCc2cc(O)c(O)cc2C1 2341194287 QJBKYEQGPYFDSS-UHFFFAOYSA-N 263.337 2.419 10 10 CECE CCSC[C@@](C)(C(=O)O)N(C)Cc1ccccc1O 2351138586 BJHLUVOAISWUTM-AWEZNQCLSA-N 283.393 2.420 10 10 CECE CSc1cc(N2CCC(CCO)CC2)ccc1CN 2353849760 QZNWAOOUUKMZEH-UHFFFAOYSA-N 280.437 2.466 10 10 CECE Nc1ccc(CCCN2[C@H]3CC[C@H](C3)[C@H]2C(=O)O)cc1 2355845762 SMEGERWSOLSIAS-SNPRPXQTSA-N 274.364 2.139 10 10 CECE C[C@@H]1CCC[C@@](CO)(NC(=O)CCc2ccc(N)cc2)C1 53112458 CDZCAWYHDQCFSY-CXAGYDPISA-N 290.407 2.259 10 10 CECE CCN1CCC[C@H]1CN(C)Cc1cc([N+](=O)[O-])ccc1O 177710522 NIZDJBUQIVKDOW-AWEZNQCLSA-N 293.367 2.217 10 10 CECE Cc1cc(O)c(O)cc1CCNC(=O)Cc1cccs1 170204674 FBYAUGHRAUJDAO-UHFFFAOYSA-N 291.372 2.369 10 10 CECE CO[C@H]1CCC[C@H](N2CCN(c3ccc(N)cc3)CC2)C1 70332618 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Cc1cc(N2CCOCCC23COC3)ccc1[C@@H](C)N 2285144506 TVGWTZWSOXBBIM-CYBMUJFWSA-N 276.380 2.010 10 10 CECE CCNCc1ccc(N2CCC[C@@H]2CC(N)=O)cc1Cl 2285580658 MOIUWMDPIZLPPU-GFCCVEGCSA-N 295.814 2.294 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@H](CO)c1ccccc1 2296326320 CQIFPGSGFCBGCB-MRXNPFEDSA-N 274.339 2.454 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3C[C@@H]4NCC[C@H]43)ccc21 2286383425 OWMNYOIUWOTNRS-IVSAIRAKSA-N 272.392 2.100 10 10 CECE Oc1c(CN[C@H]2CCCN(C3CC3)C2)ccc(F)c1F 2288796849 NHXHOYHNYNZINH-NSHDSACASA-N 282.334 2.387 10 10 CECE CC1(C)[C@H]2CO[C@@]1(C(=O)N1CCC(CN=[N+]=[N-])CC1)C2 2289161530 NWMSRKPDYLZRLE-BXUZGUMPSA-N 278.356 2.350 10 10 CECE C[C@@H](NC[C@@H]1C[C@H]2CC[C@@H]1O2)c1c(O)cccc1O 2296696305 IVVPKSZOSRJVIB-DEKYYXRVSA-N 263.337 2.316 10 10 CECE CCc1cnc(Sc2nccc(C(=O)O)n2)s1 2302623429 WWZCHDYYNGMMAT-UHFFFAOYSA-N 267.335 2.345 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1C[C@@H]2C[C@H]1C[C@H]2O 2310041009 RCVDAXLXIBZMLD-XYDQJSOLSA-N 267.756 2.295 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2C[C@@H]2CF)cc1O 2310935222 IHYDZBORVHQLRE-MXWKQRLJSA-N 253.317 2.487 10 10 CECE C[C@H]1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])O1 2312398162 FZBCTVWUQDFAHT-VLEAKVRGSA-N 252.318 2.292 10 10 CECE CCOCc1nnc(CN(CC)CCN=[N+]=[N-])s1 2315987769 ZHFNBCDUVGLEEN-UHFFFAOYSA-N 270.362 2.207 10 10 CECE C[C@]1(O)C[C@H]2C[C@H]1N(c1ccc(CN)cc1Cl)C2 2317402415 COJNJBIOJLOCRO-HONMWMINSA-N 266.772 2.148 10 10 CECE CC(C)[C@H](CO)N(C)CCCc1ccc(N)cc1 2318849119 LVYPOWKFSZGIOR-HNNXBMFYSA-N 250.386 2.150 10 10 CECE CS(=O)(=O)[C@H]1CC[C@@H](SCc2ccc(N)cc2)C1 2319426139 VOZWHDVUHIQSET-OLZOCXBDSA-N 285.434 2.468 10 10 CECE CNCc1ccc(OCCOCC(F)F)c(C)c1 2328151963 LYGOAQQKRSZNCS-UHFFFAOYSA-N 259.296 2.375 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CC[C@@H]3CN)ccc21 2329488052 XAEAULBBVBRRLH-IIAWOOMASA-N 260.381 2.087 10 10 CECE CN(CCc1ccc(N)cc1)C[C@H]1C[C@@H]2C[C@@H]2CO1 2331064168 CJKMKNJHFQJGAL-SQWLQELKSA-N 260.381 2.168 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@H]1OC[C@@H]2CCC[C@H]12 2333612524 SKMDVPKEHZEWCP-NGDQXYMTSA-N 264.329 2.149 10 10 CECE Nc1ccc(CN2CC[C@@H](O)C[C@@H]2C(F)(F)F)cc1 2336401792 DSUFLWMXGNATTF-VXGBXAGGSA-N 274.286 2.156 10 10 CECE CCN[C@H](C)c1ccc(N(C)CC2(O)CC2)cc1O 2340153018 SYSGPRXBQLKVIO-LLVKDONJSA-N 264.369 2.024 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2c1c(F)cc(CN)cc1F 2340780653 JKXUBFMWKBRZHD-OUJBWJOFSA-N 268.307 2.037 10 10 CECE Cc1c([C@@H](C)O)ccc(N(C)C[C@@H]2CCN2C)c1C 2340852629 YZAGHCSWTHTFOF-KGLIPLIRSA-N 262.397 2.497 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCN(C)[C@H]3C[C@@H]32)c1C 2341066225 ZLUGSNXDTJONAU-KCXAZCMYSA-N 260.381 2.249 10 10 CECE CC=CC=CC(=O)N1CCc2cc(O)c(O)cc2C1 2341198472 NTDXDEWXBYIVGJ-UHFFFAOYSA-N 259.305 2.115 10 10 CECE COc1cc(Cl)c(N2C[C@@H]3C[C@@]3(CO)C2)c(OC)c1 2342289279 DQXGIANKGCAPHW-XPTSAGLGSA-N 283.755 2.176 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@@H]2C[C@@H]3CO)cc1O 2354262317 WODSIHWLGJGZES-BLTAXRJOSA-N 276.380 2.022 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@H]2[C@@H]3CCCO[C@@H]32)c1 2355560792 FPUVGNRCMAEQGO-TYRIBLQHSA-N 277.364 2.476 10 10 CECE CC[C@@H](NC)c1ccc(N(C)[C@@H]2COC[C@H]2OC)cc1 2355628336 PSQMMWKFLIYBIC-BZUAXINKSA-N 278.396 2.207 10 10 CECE CNCc1ccc(OC)c(CN2C[C@H]3CC[C@@H]2C3)c1 50125234 QVPFMYAUZDSCCP-DZGCQCFKSA-N 260.381 2.399 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@@H]2[C@H]3CC[C@H](C3)[C@@H]21 2357251911 ZFPLLKSZORCADQ-DIKAOIQGSA-N 273.376 2.450 10 10 CECE CCN(CC(=O)c1ccc(O)c(O)c1)CC(C)C 37336259 VBGVTAPSEYJCPQ-UHFFFAOYSA-N 251.326 2.258 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)CNC1CCCC1 37495196 IVWWSUQIJZSYQT-UHFFFAOYSA-N 289.423 2.243 10 10 CECE Cn1cc([C@H]2CCN(Cc3cc(F)ccc3O)C2)cn1 180175664 KOZXXJKGCKGVKJ-NSHDSACASA-N 275.327 2.254 10 10 CECE CC(C)N(C(=O)COc1ccc(N)cc1)C(C)C 38055385 ZSXJNHOLVRADQD-UHFFFAOYSA-N 250.342 2.293 10 10 CECE CN[C@H]1C(=O)Nc2cc(N(C)CC3CCC3)ccc21 61458580 RUDPTIQTRHLGIU-CQSZACIVSA-N 259.353 2.136 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)CCC1CCC1 379885699 CYVKBKMKGCHLNJ-UHFFFAOYSA-N 260.363 2.187 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(N)=O)c1ccc(F)cc1Cl 236190216 IWXGMTKPFROJQI-SNVBAGLBSA-N 285.710 2.296 10 10 CECE CC(C)[C@H](O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 123824483 DEMNDPXRTMELBA-RHSMWYFYSA-N 292.423 2.191 10 10 CECE Oc1c(Br)cc([C@@H]2CCCN2)c(O)c1F 218684265 QHZSMVHEZXSRIC-ZETCQYMHSA-N 276.105 2.424 10 10 CECE CCCNCc1ccc(N(CC)CC(=O)N(C)C)c(F)c1 49024748 OXQVIFMCNYILCZ-UHFFFAOYSA-N 295.402 2.240 10 10 CECE CC(C)(CCNC(=O)Cc1ccc(N)cc1)CCC(=O)O 87662245 BSNWQBFLRVVUBE-UHFFFAOYSA-N 292.379 2.209 10 10 CECE CNCc1ccc(N(C)CCCCCO)c(C)c1 227084567 BZEJAFOSMBVKKV-UHFFFAOYSA-N 250.386 2.313 10 10 CECE C[C@@H](c1ccccc1O)N1CCC(OCCC(=O)O)CC1 86773712 NTZYWRKREVNFBJ-LBPRGKRZSA-N 293.363 2.409 10 10 CECE CCN[C@@H](C)c1ccc(N2CCCN(C(C)=O)CC2)cc1 42680140 JPLRAZFFMJTSMF-AWEZNQCLSA-N 289.423 2.416 10 10 CECE C[C@H](O)[C@H]1CCN(c2ccc([C@@H](C)N)cc2F)C1 226456494 HOOKDTWYBRIVGO-SCVCMEIPSA-N 252.333 2.053 10 10 CECE CCCNCc1ccc(N2CC[C@@H](NC(C)=O)C2)c(F)c1 228304672 KEKOKBOGPKZGDV-CQSZACIVSA-N 293.386 2.040 10 10 CECE C[C@H]1CN(Cc2c(O)ccc3ccccc23)C[C@H](CO)O1 191520594 QGXKDFMPOBGPMH-GXTWGEPZSA-N 287.359 2.127 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H](O)C2)cc1Br 235216365 NWXVOMQRPISPGM-KOLCDFICSA-N 299.212 2.430 10 10 CECE COCc1ccc2c(c1O)C(=O)c1ccccc1C2=O 90556002 XSLPNDYXWFMNGX-UHFFFAOYSA-N 268.268 2.314 10 10 CECE Oc1c(Br)cc(F)c(F)c1[C@@H]1COCCN1 95719094 REBGMYHXQDTVGB-ZETCQYMHSA-N 294.095 2.094 10 10 CECE Cc1cc(O)c([C@@H]2CCC(=O)N2)cc1Br 238488555 GQXRRHXKFODWAF-VIFPVBQESA-N 270.126 2.414 10 10 CECE N[C@H](c1cc(Cl)cc(Cl)c1O)C(F)(F)CO 95672144 JJHRKDKZINGKEZ-MRVPVSSYSA-N 272.078 2.326 10 10 CECE C[C@@H](CCN(C)C)NCc1ccc2c(c1)CCN2C 50286878 HJFLAIQKMNOXBC-ZDUSSCGKSA-N 261.413 2.109 10 10 CECE Nc1ccc(/C=C\C(=O)NCc2ccccc2O)cc1 379639964 YRLTUPONTWDDKY-YFHOEESVSA-N 268.316 2.304 10 10 CECE CCSC[C@@H](C)N(C)c1cc2c(cc1F)[C@@H](O)C(=O)N2 706359387 RTGYIMUYZYHNAS-AMIZOPFISA-N 298.383 2.389 10 10 CECE NN[C@H](c1ccc(N2CCCCC2)cc1)[C@@H]1CCOC1 2163107491 SPNGPBMEGIDYSU-GDBMZVCRSA-N 275.396 2.218 10 10 CECE NN[C@H](C[C@H]1CCCO1)c1ccc(N2CCCC2)cc1 2163104663 FVUYIGMTRYDFTI-HZPDHXFCSA-N 275.396 2.360 10 10 CECE CCN(CC)c1ccc([C@@]2(O)C[C@H]3CN[C@@H](C3)C2)cc1 2163109646 AZBXTAUWSAQJMI-JLJPHGGASA-N 274.408 2.492 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3C[C@]34CCOC4)ccc21 2163126275 HGDAHQFLOWHNJG-PVAVHDDUSA-N 272.392 2.495 10 10 CECE CO[C@H](C1CCCC1)[C@@H](NN)c1ccc(N(C)C)cc1 2163132024 XHKBMMOTTICOOP-JKSUJKDBSA-N 277.412 2.462 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@](C)(O)C(C)(C)OC 2163132348 AWTGMWUDXNQXOY-ZBFHGGJFSA-N 280.412 2.189 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@@]2(C)C(C)=O)c1O 2163554322 ZSXYIFCOUQKLFI-HNNXBMFYSA-N 279.311 2.287 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@@H]2CC3(CCC3)CO2)C1 2166465984 YHWIDUSHVFWQHL-RYUDHWBXSA-N 278.356 2.495 10 10 CECE O=C(Nc1cnc(CC2CC2)nc1)c1cc(O)cs1 807525313 DTGSYWHFZSCTFA-UHFFFAOYSA-N 275.333 2.449 10 10 CECE O=C(O)[C@H](O)c1c(S)ccc2scc(O)c12 396383460 URSJRIKLYGLWGB-SECBINFHSA-N 256.304 2.014 10 10 CECE NCc1ccc(N2C[C@@H](F)[C@H](F)C2)cc1Br 714667842 YTRAGSKOAHSMRG-GHMZBOCLSA-N 291.139 2.404 10 10 CECE CO[C@H]1C=CCN(c2ccc(C=CC(=O)O)cc2F)C1 2165045500 KCMFIVIWNBIHLS-LBPRGKRZSA-N 277.295 2.315 10 10 CECE Oc1cccc2c1[C@H](N[C@H]1CCn3nccc3C1)CC2 2165193852 XMUQDCYMMLTQON-GXTWGEPZSA-N 269.348 2.181 10 10 CECE CC(C)NCc1cc(F)c(N2C[C@@H]3C[C@H]2CO3)c(F)c1 718280053 KORMHOABJBJXKB-RYUDHWBXSA-N 282.334 2.440 10 10 CECE CCN(C(=O)c1cc(O)c(O)c(O)c1)C1CCCC1 2132351196 VCOBRQRQWHGWCF-UHFFFAOYSA-N 265.309 2.208 10 10 CECE COc1cc([N+](=O)[O-])cc([C@H](N)[C@H](O)CCC(C)C)c1O 575282672 XPOXLXBOSDXBKB-YPMHNXCESA-N 298.339 2.106 10 10 CECE COC[C@H]1CCN1Cc1ccc(Br)cc1O 826011398 HFHSQRUBQQMZRV-LLVKDONJSA-N 286.169 2.375 10 10 CECE COc1cccc(CNC(=O)NC2CC(C)(C)C2)c1O 824018829 YOZKNFSLGAZLCU-UHFFFAOYSA-N 278.352 2.389 10 10 CECE COC[C@](C)(CCO)NC/C=C\c1ccc(N(C)C)cc1 835041427 CBWLXXFYFCUXBU-OSJSJHBBSA-N 292.423 2.143 10 10 CECE Cc1cc(O)c(CN[C@H]2CCNC[C@H]2C)c(Cl)c1 841064066 OTHINFJJXNDYEI-MFKMUULPSA-N 268.788 2.442 10 10 CECE CC(=O)C(=O)COC(=O)c1cccc2c1CCCCC2 910135901 OLHZTRNDHOXXHL-UHFFFAOYSA-N 274.316 2.270 10 10 CECE CNC[C@@H]1CCN(Cc2c(O)cc(C)cc2Cl)C1 843052153 IKSRMJXLEZDEBJ-NSHDSACASA-N 268.788 2.395 10 10 CECE C[C@H](CNC(=O)NCc1c(O)cccc1F)C1CC1 914371197 OMJJDZPXNLGCAQ-SECBINFHSA-N 266.316 2.377 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)NCc1ccc(O)cc1O 910957654 USOBUQFNNDSCFC-GHORINQJSA-N 261.321 2.006 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](N)C12CCC2 925497557 HSLAFBCCCCJFSA-HOTGVXAUSA-N 273.424 2.421 10 10 CECE Cc1cc(CC(=O)NCCN(C)C)c(C)n1-c1ccccc1 854144375 FPFIXEYLNRDCFL-UHFFFAOYSA-N 299.418 2.314 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cc(O)cc(Br)c1 700833203 NYPBDIBCFNYOAJ-UHFFFAOYSA-N 285.101 2.195 10 10 CECE COc1ccc(O)c([C@H](C)NCc2cc(N)ccn2)c1 925765746 DPNYDPIBNPGJOO-JTQLQIEISA-N 273.336 2.229 10 10 CECE NCc1ccc2c(c1)CCCN2[C@H]1CCCC[C@@H]1O 700808858 NLBWNWAQWQFGEI-HOTGVXAUSA-N 260.381 2.201 10 10 CECE c1cc2c(cc1CN[C@]13C[C@H]1COC31CCC1)CCO2 923033101 PSWDSPKFRCUSMT-WMLDXEAASA-N 271.360 2.423 10 10 CECE C[C@H](NCC[C@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O 757656475 IHWOKQRAHGCUIF-QWRGUYRKSA-N 280.324 2.378 10 10 CECE C[C@H](O)c1ccc(N2CC3(COC3)C2)cc1Br 697078961 CFWQZWZRBZBKSA-VIFPVBQESA-N 298.180 2.339 10 10 CECE CNCCOCCN[C@H](C)c1ccc2ccccc2c1O 863544091 KQLINEBIXCICDZ-CYBMUJFWSA-N 288.391 2.432 10 10 CECE C[C@@]1(CCN[C@@H]2CCc3cccc(O)c32)COCCO1 1875564410 PFAUONGAPHAPSR-CZUORRHYSA-N 277.364 2.165 10 10 CECE CN(C)c1ccc([C@H](N)C(F)(F)F)c(F)c1C#N 72195552 DTGJYMIQFDFSTJ-JTQLQIEISA-N 261.222 2.325 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3C(C(F)F)[C@H]3C2)cc1O 1877074715 VOOOBFBJYLFPMF-SWPVVBRQSA-N 268.307 2.359 10 10 CECE C[C@H](NC(=O)C[C@H]1CO[C@H](C)C1)c1ccccc1O 1877573757 OJIAGTRTICBGFF-WOPDTQHZSA-N 263.337 2.385 10 10 CECE COc1cccc(CNC(=O)CCCn2cccc2)c1O 1137473480 KVRNUVPZSUHCGT-UHFFFAOYSA-N 288.347 2.299 10 10 CECE CC(C)N[C@@](CSc1nccs1)(C(N)=O)C1(C)CC1 1879634603 BZIGEEZFXAOIAT-ZDUSSCGKSA-N 299.465 2.257 10 10 CECE CC(C)(C)OC(=O)N1CC[C@H]2CN(CCN=[N+]=[N-])C[C@H]2C1 1957245362 XBWGSFFKHGIOOT-RYUDHWBXSA-N 295.387 2.486 10 10 CECE CC[C@@H](NC[C@]1(CCO)CCOC1)c1ccc(F)cc1O 796797096 KALRQUVITONNPU-ZBFHGGJFSA-N 297.370 2.361 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1nccs1 50287824 KLYXTXLMIAVWQB-CYBMUJFWSA-N 259.378 2.444 10 10 CECE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]1NCc1ccc(N)cc1 1886531334 UEALHKZEYYKBFN-KBPBESRZSA-N 291.395 2.414 10 10 CECE Oc1cc(Cl)ccc1CNCCCn1cccn1 1964019662 FHSGMATWEIMYBL-UHFFFAOYSA-N 265.744 2.422 10 10 CECE COC(=O)c1ccc2c(cnn2-c2ccc(N)cc2)c1 75944680 CDRLNSIGBYRZIU-UHFFFAOYSA-N 267.288 2.394 10 10 CECE CC(C)Oc1ccc(N2CCCNCC2)cc1F 77434958 LAURHYWDIAPZML-UHFFFAOYSA-N 252.333 2.413 10 10 CECE CCCC[C@H](N)c1nnc(-c2cc(O)c(O)c(O)c2)o1 83588869 HPBJWJXNJOJKRO-QMMMGPOBSA-N 279.296 2.043 10 10 CECE COc1cc2c(cc1OC)N(C(C)C)CC[C@H]2N 84101491 GJMHFURSYJVISK-LLVKDONJSA-N 250.342 2.322 10 10 CECE COc1ccc(O)c(CN2CC[C@H](CCN(C)C)C2)c1 701494530 FBAYBPASIOZELI-ZDUSSCGKSA-N 278.396 2.174 10 10 CECE Oc1nc(CNCc2ccc(F)c(F)c2O)cs1 703234386 QKCRWZNGSBXWEW-UHFFFAOYSA-N 272.276 2.122 10 10 CECE CN1C[C@H]2CN(Cc3cccc(Cl)c3O)C[C@@H]2C1 706234484 AGIFJKKAQATUAD-RYUDHWBXSA-N 266.772 2.039 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1ccc(Cl)nn1 706392078 GMLNSHHTPFFUKX-ZETCQYMHSA-N 266.692 2.045 10 10 CECE CC[C@H](C)CC[C@H](O)CC(=O)NCc1cc(O)ccc1O 1176756099 WTQSYQDDGCWQQA-FZMZJTMJSA-N 295.379 2.291 10 10 CECE NC[C@H]1CCCCN(Cc2cc(F)cc(F)c2O)C1 708494769 OVYATKPRYGQRRW-SNVBAGLBSA-N 270.323 2.231 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](C)[C@H](CO)C2)cc1 709191676 GGWDVSIHMFCVCD-NFAWXSAZSA-N 262.397 2.422 10 10 CECE CC(C)N(CC(C)(C)O)c1c(F)cc(CN)cc1F 689948870 VFHKEARLLIKDBS-UHFFFAOYSA-N 272.339 2.409 10 10 CECE CO[C@@H](CN(C)c1ccc(CN)c(F)c1)C1CC1 692230261 KHACRWJKGOIBCA-AWEZNQCLSA-N 252.333 2.146 10 10 CECE C[C@@H](N)c1ccc(N2CC3CC2(CO)C3)cc1Cl 694590045 WDVMCSMUJUCASI-NAUIOFCNSA-N 266.772 2.321 10 10 CECE CN(C)c1ccc([C@@H](NC2CCCC2)C(=O)O)cc1 211876232 WXBNBWPUOVGGSQ-CQSZACIVSA-N 262.353 2.411 10 10 CECE O=C(O)[C@@H](c1cc(Cl)ccc1O)N1CCCC1 211940336 HIMHDQSNMQNBGF-LLVKDONJSA-N 255.701 2.267 10 10 CECE NC1(c2c(O)cccc2Br)CCC(O)CC1 1536060783 RZYCCJSWGRPTMO-UHFFFAOYSA-N 286.169 2.244 10 10 CECE CN(CCCc1ccc(N)cc1)C[C@H]1[C@@H]2COC[C@@H]21 2118019953 WEPHWTICLVZRNA-PHZGNYQRSA-N 260.381 2.026 10 10 CECE CC(C)[C@@H](C(=O)O)N(C)[C@@H](C)c1cc(O)ccc1O 2118366432 GIRKQRROVGEBAI-ZANVPECISA-N 267.325 2.200 10 10 CECE Oc1ccc(CNC2CCC(CF)CC2)c(O)c1O 2118426365 YRDUOLOWQUOSJQ-UHFFFAOYSA-N 269.316 2.421 10 10 CECE CNCc1ccc(N2CCOC[C@@H]2C(F)F)c(F)c1 2119028183 MCVYNHARWXYQDE-GFCCVEGCSA-N 274.286 2.015 10 10 CECE Cc1cc(C)nc(COCCc2ccc(N)cc2)n1 2119734457 UWCPEVXSJRJQFP-UHFFFAOYSA-N 257.337 2.435 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@H]2[C@H]3OCC[C@H]23)c(F)c1 2119904054 PPINVPPYFXCKQI-CGEWXTDFSA-N 265.328 2.350 10 10 CECE CSc1ncc(CN[C@@H]2CCNCC23CC3)s1 2248700087 JQBJXLZXYYHOIR-SNVBAGLBSA-N 269.439 2.097 10 10 CECE COc1ccc(N2CCN[C@H](C)C2)c(Br)c1 2211844851 FKGXCOHOCHCWCH-SECBINFHSA-N 285.185 2.256 10 10 CECE C[C@@H]1CCCCN1C(=O)CN1CCC[C@@H]1CN=[N+]=[N-] 2123016970 CEUCBDJXKMLNLP-VXGBXAGGSA-N 265.361 2.162 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1C[C@H]1c1cccc(O)c1 1643882528 YSEKSFFWRDDRLT-LSDHHAIUSA-N 299.326 2.223 10 10 CECE Cc1nccc(C(=O)NCc2cccc(Cl)c2O)n1 1640402607 WEHSUMSBPDROAL-UHFFFAOYSA-N 277.711 2.074 10 10 CECE Cc1cccc(F)c1C(=O)NCc1cc(O)ccc1O 1644754413 VWCHDQGVYAOWEB-UHFFFAOYSA-N 275.279 2.475 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CCCSCC3)ccc21 104969449 ULEGRACZYOJHHR-AWEZNQCLSA-N 291.420 2.233 10 10 CECE CC(C)[C@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CN1 1964684242 XUUHZOZPBVZODC-HUUCEWRRSA-N 260.381 2.098 10 10 CECE c1coc(COc2ccc(N3CCNCC3)cc2)c1 136672043 BJTBHPSHRSBIGF-UHFFFAOYSA-N 258.321 2.268 10 10 CECE CC1CCN(CCCNCc2ccc(O)cc2O)CC1 20146259 FHNLAKFGTXYMRA-UHFFFAOYSA-N 278.396 2.309 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3C[C@H]4CC[C@H]3C4)ccc21 250605912 GILJSCSIDBIEOQ-PGUXBMHVSA-N 271.364 2.278 10 10 CECE CNCc1ccc(N2CC[C@@H]([C@H](C)O)C2)c(Cl)c1 162194894 YUDCOXWYFZOHAW-CMPLNLGQSA-N 268.788 2.267 10 10 CECE CN(C)[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128268606 JBCIKIYXXDSBGU-ZBFHGGJFSA-N 259.397 2.163 10 10 CECE CCN(C)[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128322104 OTUCVWQEKTYSNF-HOCLYGCPSA-N 259.397 2.163 10 10 CECE CCN1N=C(C)/C(=C\c2ccc(N(C)C)cc2)C1=O 1865654487 VSZLMAZJPVNTSN-GXDHUFHOSA-N 257.337 2.374 10 10 CECE CCc1cc(CNCCCC(=O)O)ccc1OC 258844256 IILAPBLERDBEPD-UHFFFAOYSA-N 251.326 2.212 10 10 CECE CCc1cc(CNC(C)(C)CCN)ccc1OC 258776295 IDBDLERCRSYHOA-UHFFFAOYSA-N 250.386 2.475 10 10 CECE CN1CC[C@H](c2cnc(Nc3ccc(N)cc3)nc2)C1 259431011 XQTICTBZUCVODC-NSHDSACASA-N 269.352 2.222 10 10 CECE CN1C[C@H](N(C)Cc2ccc(Cl)cc2O)CCC1=O 2131940776 MRCWYYLVMHHRGX-GFCCVEGCSA-N 282.771 2.098 10 10 CECE C[C@@H](CC(=O)NCCc1ccc(O)c(O)c1)C(F)(F)F 860235458 SOPFNHQKFKAKJF-QMMMGPOBSA-N 291.269 2.345 10 10 CECE Oc1cc(F)ccc1CN[C@H]1C[C@@H]1C1CCOCC1 2139879574 BIDLRKKSJJJLKM-KGLIPLIRSA-N 265.328 2.436 10 10 CECE CCCc1nnc(CN2CC[C@@H](CN=[N+]=[N-])C2)o1 1912166682 ALABXIURPZZBJD-VIFPVBQESA-N 250.306 2.154 10 10 CECE CCC(C)(C)NC(=O)[C@H](C)N1CCC[C@@H](N=[N+]=[N-])C1 1912186069 ZGCYWZQWJRHOQY-WDEREUQCSA-N 267.377 2.454 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)C2CC3(CCCO3)C2)CC1 1912177569 GBJSVMDEUCONFC-UHFFFAOYSA-N 264.329 2.247 10 10 CECE COc1ccc(CNCc2ccc(Cl)cc2O)nn1 1913558712 DETVPVYNTADGCW-UHFFFAOYSA-N 279.727 2.134 10 10 CECE NCc1ccc(N2CC3(CCCC3)C[C@@H]2CO)cc1F 1912776987 PFQMOOYHTLUMEU-CQSZACIVSA-N 278.371 2.416 10 10 CECE COc1ccc(N2CC[C@H](OC)C[C@H]2CN)cc1Cl 2138247784 JHILCWZTTIKAIV-RYUDHWBXSA-N 284.787 2.291 10 10 CECE CCNCc1ccc(N2CC[C@@H]2C(C)(C)O)c(F)c1 2134605319 ZVEHJWPOSBSVSO-CQSZACIVSA-N 266.360 2.285 10 10 CECE CC(C)NCc1ccc(N(C)C2COC2)c(F)c1 1915676459 MTQZLBQZYNQGIZ-UHFFFAOYSA-N 252.333 2.159 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1C2C[C@@H]3C1[C@@H]3C2 1916950014 YWWXPWQBAHEAJO-BDDQZXTRSA-N 251.276 2.414 10 10 CECE CN(C)c1ccc(CN[C@H]2CCC[C@H]2N(C)C)cc1 1922048491 BFAKOLXPUJKABK-JKSUJKDBSA-N 261.413 2.325 10 10 CECE Nc1ccc(CC(=O)N[C@@H](C2CC2)C(F)(F)F)cc1 1967118716 BYVXTQKPFPGLOJ-LBPRGKRZSA-N 272.270 2.268 10 10 CECE CN(C)c1ccc2c(c1)CCN2C(=O)C(F)(F)F 1923947708 UGPNKNFDLATJQM-UHFFFAOYSA-N 258.243 2.204 10 10 CECE CC(C)[C@H](NCc1c(O)ccc2ccccc12)C(N)=O 231041919 IZYHBWKJNFKRCZ-HNNXBMFYSA-N 272.348 2.145 10 10 CECE CC[C@H](NC[C@@H]1CC[C@H](CO)CO1)c1ccccc1O 1969540172 UUERKUYUEJYSPK-IPYPFGDCSA-N 279.380 2.220 10 10 CECE COc1cc(N2CCO[C@@H](C(C)C)C2)ccc1CO 2139685778 HCQOLBVDDKYXNP-OAHLLOKOSA-N 265.353 2.049 10 10 CECE Cc1cccc(Cn2cncc2[C@H]2CCCN2)c1O 2139746959 YFTFRLULOGFYAB-CYBMUJFWSA-N 257.337 2.370 10 10 CECE Cc1cccc(CNC[C@H]2CC[C@@H](C(=O)O)C2)c1O 2139756890 AWDFLOYZYUTGOL-NWDGAFQWSA-N 263.337 2.291 10 10 CECE C[C@]1(OCCCC(=O)Nc2ccc(N)cc2)CCOC1 2146251057 ZRPFNHQGUZEKOH-HNNXBMFYSA-N 278.352 2.183 10 10 CECE Cc1cc(N2C[C@H]3C[C@]3(CO)C2)ccc1CNC(C)C 2146310612 KXCVOCTZWKMDQT-NVXWUHKLSA-N 274.408 2.312 10 10 CECE [N-]=[N+]=N[C@H](CO)c1ccc(Br)c(O)c1 1951358290 WGQHVKSMXHFZBH-SSDOTTSWSA-N 258.075 2.498 10 10 CECE COC(=O)C(C)(C)[C@H](N)c1cc(C)c(C)cc1O 1952913211 HTXBEPPVQLYQPB-GFCCVEGCSA-N 251.326 2.208 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H](C)[C@H](C)C3)ccc21 253064257 HJCWTSRVQLMFJK-HFAKWTLXSA-N 273.380 2.382 10 10 CECE Cc1ccc(O)c(CN[C@H]2COCCC2(F)F)c1 1972757681 KSYZSQAKKPKTJB-LBPRGKRZSA-N 257.280 2.214 10 10 CECE COC(=O)c1cc(OC)c(O)c([C@H]2CCCCN2)c1 258535576 VBRSPPAVLGIDMQ-LLVKDONJSA-N 265.309 2.002 10 10 CECE CC1(NC(=O)c2ccn(-c3ccc(N)cc3)n2)CCC1 167933096 CBAPGWNWBNVAAH-UHFFFAOYSA-N 270.336 2.127 10 10 CECE C[C@H]1[C@@H](O)CN1c1ccc([C@@H](C)N)c(Br)c1 1985745619 WCGUIJMMVMKPII-LWINAJNOSA-N 285.185 2.038 10 10 CECE C[C@@H](NCc1csc(N(C)C)n1)c1ccc(O)cc1O 2149567221 JBOLRLQAFRUTJE-SECBINFHSA-N 293.392 2.471 10 10 CECE CN1CCc2cc(CN3CCC[C@]34CCNC4)ccc21 2144721394 OFAUHARDDQXLBI-QGZVFWFLSA-N 271.408 2.007 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCC[C@H](O)C2)c1 37165791 LXULLCMSVHXLLK-SRVKXCTJSA-N 265.353 2.355 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3CC(=O)N[C@H]3C2)c(Cl)c1 2145057202 JHPUROVZCVGYMO-NDMJEZRESA-N 293.798 2.075 10 10 CECE CCn1nccc1CN(C)c1ccc(CN)c(F)c1F 2150703476 PVZLKMAIRHYTCY-UHFFFAOYSA-N 280.322 2.276 10 10 CECE CCCC[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 37801178 NBPQZLVWRCCDBY-OAHLLOKOSA-N 277.412 2.229 10 10 CECE Cc1c(NN)ccnc1CSc1nccs1 1994878259 CPKWELOLJSWHDW-UHFFFAOYSA-N 252.368 2.424 10 10 CECE CN(C)c1ccc([C@H](Nc2ccccc2)C(N)=O)cc1 37941851 HOMSZLMHCMKOJV-HNNXBMFYSA-N 269.348 2.391 10 10 CECE Cc1cnc(Sc2ncc([C@H](C)N)s2)nc1O 1997410060 WJAWBJAIYUJYRW-LURJTMIESA-N 268.367 2.118 10 10 CECE CCN[C@@H](C)c1ccc2c(c1)CCN2Cc1ncon1 2145825944 JDWCQDSYWMZBCV-NSHDSACASA-N 272.352 2.303 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1C[C@@H](F)C[C@@H]1C(=O)O 2151949910 ZGWYRVSHSYRHGN-SCDSUCTJSA-N 280.343 2.311 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3COC[C@H]32)cc1Cl 2013479172 VJODNCWKQOKYAK-JRKPZEMJSA-N 252.745 2.195 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1CCOC[C@@H]1F 2013770390 RLFFUUYLKRBEES-QWRGUYRKSA-N 259.708 2.262 10 10 CECE CCCN(C[C@@H]1CCCN(C)C1=O)c1ccc(N)cc1 2154208691 MBFNNFUOTQURTA-ZDUSSCGKSA-N 275.396 2.354 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1C[C@@]12CCOC2 2021239752 BMQPRNIYNSUIGL-QWHCGFSZSA-N 253.729 2.314 10 10 CECE NCc1ccc(N2CC[C@H]3COC[C@H]32)cc1Br 2021413678 YSWAJRPGCRSNJZ-GXFFZTMASA-N 297.196 2.133 10 10 CECE Cc1oncc1CCNCc1cccc(F)c1O 2029302603 BDXZZAIEVUGQRP-UHFFFAOYSA-N 250.273 2.160 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@H]2CNC[C@@H]21 299922130 RTBFPWCWMRYWPI-SUNKGSAMSA-N 264.344 2.276 10 10 CECE CS(=O)(=O)[C@@H]1CCCC[C@@H]1Nc1ccc(N)cc1 2035398141 UHTPPGQVTCLWET-QWHCGFSZSA-N 268.382 2.037 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@]3(C2)CC3(F)F)c(O)c1O 2156164866 BQIRGNCBXZYSER-RNCFNFMXSA-N 285.290 2.471 10 10 CECE CN1CCc2cc([C@H](N)Cc3cncs3)ccc21 2037095478 NJSXMSUYJFOBLE-CYBMUJFWSA-N 259.378 2.378 10 10 CECE CC[C@H](N)Cc1cnc(Sc2nccc(O)n2)s1 2037804834 APLRJTVOCWFKLF-ZETCQYMHSA-N 282.394 2.070 10 10 CECE N[C@H]1CN(Cc2ccc(Cl)cc2O)[C@@]2(CCCOC2)C1 2156306226 NGPLBVFXBQNZIY-HIFRSBDPSA-N 296.798 2.128 10 10 CECE CN[C@H](C)c1ccc(N2CC(C)(CO)C2)cc1Cl 2039553180 TTZBYNCSWMXERI-SNVBAGLBSA-N 268.788 2.439 10 10 CECE 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2.007 10 10 CECE CCCS(=O)(=O)CCN(C)[C@@H]1CCc2cccc(O)c21 2170544894 JVZLVDVOLUWRAH-CYBMUJFWSA-N 297.420 2.136 10 10 CECE CNCc1ccc(N2CC[C@@H]3COC[C@@H]3C2)c(C)c1 702093854 POHZAHVCROMLJQ-CABCVRRESA-N 260.381 2.187 10 10 CECE CNCc1ccc(N2CC[C@H]3CN(C)CC[C@@H]32)c(C)c1 2170957633 SYTDEUKBVHAINY-RDJZCZTQSA-N 273.424 2.245 10 10 CECE CCc1cccc(CNCc2cnc(C)n2C)c1O 689267707 WVMPOJUVTDMMKZ-UHFFFAOYSA-N 259.353 2.286 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cc(-c2ccccc2)[nH]n1 706100144 ABSRGIRQRWMZDT-UHFFFAOYSA-N 256.269 2.117 10 10 CECE CN1CC[C@H](N(C)Cc2c(O)cccc2Br)C1 707156106 SEQMSQGPYDWMRJ-JTQLQIEISA-N 299.212 2.291 10 10 CECE CCOC[C@H]1CCN(C(=O)CCc2ccc(N)cc2)C1 707551267 OXVJXDBQJLPDHW-AWEZNQCLSA-N 276.380 2.086 10 10 CECE CC1(C)CO[C@H](COC(=O)COc2ccc(N)cc2)C1 708340801 YCGQYBSFAPHKLH-ZDUSSCGKSA-N 279.336 2.006 10 10 CECE CON(CCN)[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 708852890 ABQCFXQPXWLUMH-MNOVXSKESA-N 250.342 2.071 10 10 CECE CCNCc1cc(F)c(N(C)[C@@H]2CCC[C@@H]2O)c(F)c1 709478612 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C[C@@H](c1c(O)cccc1O)N1CCNC(C)(C)CC1 2231334910 ILEIBEQXRKRBTA-NSHDSACASA-N 264.369 2.233 10 10 CECE CC[C@H](C)NCc1ccc(N2CC=C[C@@H]2CO)cc1 2231463371 OFDJUOAZKKWFEL-XJKSGUPXSA-N 260.381 2.312 10 10 CECE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@@H]2C)c(F)c1 2231478849 TVXIHJLVRAMJON-PGUXBMHVSA-N 266.360 2.283 10 10 CECE NCC1(NCc2ccc(C(F)(F)F)cc2O)CCC1 2231937708 XJKXDUNOHSXGAW-UHFFFAOYSA-N 274.286 2.382 10 10 CECE CC(=O)Nc1nc(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])cs1 2234177838 WHSBTFYMTRVFSU-JGVFFNPUSA-N 294.340 2.063 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)C1C[C@H]2COC[C@H](C1)C2 2234168126 ZGZRWSLDSVIFIZ-YRRQLQLVSA-N 278.356 2.397 10 10 CECE CCO[C@@H]1C[C@@H]2CN(c3ccc(CO)c(OC)c3)C[C@@H]21 2234297213 WPFLORNQFUIFHZ-IVMMDQJWSA-N 277.364 2.049 10 10 CECE CCOc1ccc(N2CC[C@@H](O)[C@H](F)C2)cc1OCC 2234880784 LTJIKILQQXXRLZ-CHWSQXEVSA-N 283.343 2.393 10 10 CECE COc1ccc(N2C[C@H]3C[C@@H](O)CC[C@H]3C2)c(OC)c1 2235125191 UDVNEZGDTQHHRA-XQQFMLRXSA-N 277.364 2.301 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@H]2C[C@@]3(C)O)c(F)c1 2225431559 TULGSZTTYHAURA-FOOGCRFISA-N 264.344 2.195 10 10 CECE CCCNCc1cc(OC)ccc1N(C)[C@@H](C)CCO 2235965125 XRYLLGXSBQGYOA-ZDUSSCGKSA-N 280.412 2.402 10 10 CECE COc1ccc(N2CCO[C@@](C)(C3CC3)C2)c(CN)c1 2235962931 NBWLQYFNEOFRGN-MRXNPFEDSA-N 276.380 2.159 10 10 CECE COc1ccc(N(C)C[C@]2(C)CCCN2C)c(CO)c1 2236003635 SYSALQNKOOUGNT-INIZCTEOSA-N 278.396 2.108 10 10 CECE COc1ccc(N(C)C[C@H]2CC[C@@H]2OC)c(C(=O)O)c1 2236144234 UMRRMVQJYVSPIO-YGRLFVJLSA-N 279.336 2.255 10 10 CECE C[C@@H]1CC[C@H]1C(=O)Nc1ccnn1-c1ccc(N)cc1 2236124838 VKYWZQAHSGCKBY-ZWNOBZJWSA-N 270.336 2.439 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CC[C@H]2OC)cc1OC 2236138498 ISZUPYWNPFZOSS-DZGCQCFKSA-N 278.396 2.276 10 10 CECE CO[C@]1(CO)CCN(c2ccc(OC(C)C)cc2)C1 2226766806 RWDXREVWEZUKEH-OAHLLOKOSA-N 265.353 2.061 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CC[C@H]1O 2226702001 SCCDNTLPSIUQSU-WCBMZHEXSA-N 271.263 2.215 10 10 CECE COc1ccc(N2CC[C@H](CO)[C@@H](C)C2)c(F)c1F 2226930686 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CN1CCCc2cc([C@@H](N)C34COCC(C3)C4)ccc21 2288770176 NHJMPKLMAIJXDE-PTXATLKXSA-N 272.392 2.495 10 10 CECE COc1ccc(O)c(CN[C@H]2CCCN(C3CC3)C2)c1 2288803565 PTOMSGILMMYCII-ZDUSSCGKSA-N 276.380 2.117 10 10 CECE C[C@H]1CCS[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2298023782 JPJMUOOZZVOYTG-QCLAVDOMSA-N 254.359 2.476 10 10 CECE COc1cccc2nc(-c3cc(O)c(O)c(O)c3)[nH]c12 1251244777 ZDXCQNPIGOWKJE-UHFFFAOYSA-N 272.260 2.355 10 10 CECE Cc1ccc(CN=c2ccn(C)[nH]2)c(O)c1Br 2307476177 YIAHPGHNPFLAKP-UHFFFAOYSA-N 296.168 2.231 10 10 CECE C[C@H](NC(=O)[C@H]1CCCC[C@]1(C)N)c1ccccc1O 870988477 QPFKKVBWPMONMD-GHJWDPDVSA-N 276.380 2.477 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 2328635667 QVQCNIQNXFACGV-HTZLXXLYSA-N 263.312 2.044 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@@H](C)[C@@H](N)[C@H]1C 2328840790 MKOFYVQHRBIROH-JNIYBQFBSA-N 264.369 2.216 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@H]3CO)c(C)c1 2329061615 GSGIIQMFOAIYIS-LZWOXQAQSA-N 260.381 2.064 10 10 CECE Cc1c(CN[C@H]2C[C@H]2[C@H](C)O)n(C)c2ccccc12 2331384512 NDMOCZJMLADSJV-UBHSHLNASA-N 258.365 2.346 10 10 CECE CN(C[C@H]1[C@@H]2CCO[C@@H]21)c1ccc2c(c1)CC[C@@H]2N 2331551286 FEFDQUNEPNHHDX-VGWMRTNUSA-N 258.365 2.104 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4CC[C@H]3[C@@H]4N)cc21 2331523907 BCNZTBVXGNITMT-VZJVUDMVSA-N 258.365 2.283 10 10 CECE CC[C@@H](N)Cc1ccc(N2C[C@@H]3COC[C@@H]32)cc1C 2331660913 YRAVMQCYPMICJT-FMKPAKJESA-N 260.381 2.110 10 10 CECE Cc1cccc(O)c1CN[C@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12 2331831765 YEPCIPRMZOCKCX-QAQUCLOOSA-N 259.349 2.356 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@H]3CO)c(Cl)c1 2333105339 REVTUUFKFZIALR-ZFVXVEAMSA-N 280.799 2.437 10 10 CECE C[C@H]1Cc2cc(N3CC[C@@H]4[C@H](CO)[C@@H]4C3)ccc2O1 2333687248 UFXXZYLMVIRSDE-HPEDKQMDSA-N 259.349 2.075 10 10 CECE CCCNCc1ccc(N2CCOC[C@@H](F)C2)cc1 2336667239 CDCQOXKCTXKLPA-AWEZNQCLSA-N 266.360 2.361 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CCN(C)[C@H](C)C2)c1C 2341061914 ONEWKGCLFHJDDR-BXUZGUMPSA-N 261.413 2.463 10 10 CECE O=C(NC[C@H]1[C@@H]2CCC(F)(F)[C@@H]21)c1ccc(O)c(O)c1 2355164186 GXPFFMFKLHFONP-AUTRQRHGSA-N 283.274 2.119 10 10 CECE OC[C@@H]1[C@@H]2CC[C@@H](C2)N1c1ccc2c(c1)CCC[C@H]2O 2356170985 AOTMGJDXPFETTK-DLTLXFJOSA-N 273.376 2.406 10 10 CECE CC(=O)c1ccc(O)c(CN2CCN(CC(C)C)CC2)c1 50682501 PABNVDOVQPOQTQ-UHFFFAOYSA-N 290.407 2.368 10 10 CECE O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1c(O)cccc1Cl 252503807 NRLGSRYBFQJESE-VDDIYKPWSA-N 281.739 2.483 10 10 CECE CCN(CC)c1ccc(/C=C(/NC(C)=O)C(=O)O)cc1 66113817 JHDODRBSIYUBGG-GXDHUFHOSA-N 276.336 2.094 10 10 CECE COc1cccc(CN[C@@H](C)[C@@H]2C[C@@H]3CCO[C@H]23)c1O 2358117729 IROHRBPQWIZCOZ-GPMKHBRKSA-N 277.364 2.304 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@@H]2CNC[C@H]2CC1 311731957 RFRZJBYYRSGQIF-VXGBXAGGSA-N 280.799 2.477 10 10 CECE COCCNCc1ccc(N(C)CC(F)F)cc1 136872590 NALBCATZZPYSIH-UHFFFAOYSA-N 258.312 2.124 10 10 CECE CCN(CCCC(=O)Nc1ccc(N)cc1)[C@@H](C)COC 42737669 YKOSDEUGDNCHRS-ZDUSSCGKSA-N 293.411 2.344 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@@](=O)C(C)(C)C 40966723 KKJGEWOUUSSANE-LZVRBXCZSA-N 268.382 2.143 10 10 CECE NCc1ccc(N2CCCC3(C2)OCCO3)c(Cl)c1 133649094 AYJQUJGMQKKMIC-UHFFFAOYSA-N 282.771 2.142 10 10 CECE CC(C)(C)[S@](=O)CCC(=O)Nc1ccc(N)cc1 40966325 FZHWJVNCLUETJB-SFHVURJKSA-N 268.382 2.145 10 10 CECE CN[C@](C)(CCCSc1nccs1)C(=O)OC 45596086 WIRFWVZLEFGTER-LLVKDONJSA-N 274.411 2.167 10 10 CECE CN1CCc2cc(CN[C@H]3CCC[C@H](C(=O)O)C3)ccc21 86787146 BZBFGZVFECUHBK-GJZGRUSLSA-N 288.391 2.412 10 10 CECE COC[C@@H]1CCN(c2ccc(/C=C/C(=O)O)cc2)C1 81072903 MXZWOUAEHYUNPD-WXJAXGNASA-N 261.321 2.257 10 10 CECE CC(C)(C)OC(=O)N[C@H](CC(=O)O)c1sccc1O 238154086 ZZBGPTODKOIHJV-SSDOTTSWSA-N 287.337 2.494 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@](C)(O)C2)c(Br)c1 235513352 AXSZKBVPAOAXOK-TVQRCGJNSA-N 299.212 2.430 10 10 CECE N[C@@H](CCC(=O)O)c1c(O)cccc1Br 238666579 XBXOLXIDQXGGIP-ZETCQYMHSA-N 274.114 2.019 10 10 CECE Cc1ccc2c(c1)cc(-c1n[nH]cc1CCN)n2C 606595796 NQHCUQVUNATRBJ-UHFFFAOYSA-N 254.337 2.378 10 10 CECE C[C@H](N[C@H](C)Cn1cncn1)c1ccc(N(C)C)cc1 269056275 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2117722506 AJLBQNPQAXVEJZ-UHFFFAOYSA-N 281.297 2.477 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@]2(O)CCC3(CC3)C2)cc1 1906316412 NTXRQCRFUPYAEF-GDBMZVCRSA-N 260.381 2.448 10 10 CECE CCCNCc1ccc(N(C)CCC(=O)O)c(OCC)c1 212034404 WAMRLLGAMOQWLR-UHFFFAOYSA-N 294.395 2.496 10 10 CECE CC(C)NCc1ccc(N(C)CC(=O)O)c(OC(C)C)c1 212142245 NMNVRCRKKGYJRU-UHFFFAOYSA-N 294.395 2.493 10 10 CECE O=C1Cc2cc(C(=O)C(=O)c3ccccc3)ccc2N1 217133176 PUYBSSHRFZFWOK-UHFFFAOYSA-N 265.268 2.247 10 10 CECE CC[C@H](N)c1ccc(N2CC(CCN(C)C)C2)cc1 2120154818 KFRLCZXBMOWMBG-INIZCTEOSA-N 261.413 2.484 10 10 CECE C[C@]1(C(F)F)C[C@@H]1NCc1cc2c(cc1O)OCO2 2120926199 ARIVJSOWYUIAIV-AAEUAGOBSA-N 271.263 2.254 10 10 CECE COc1cc(N)c(N(CCO)C2CCCC2)cc1OC 213408562 SOHRDOGNJXMYLT-UHFFFAOYSA-N 280.368 2.027 10 10 CECE CN(C[C@H]1CCCOC1)C(=O)Nc1ccc(N)cc1 104203640 SKXVXEAATVBVCW-LLVKDONJSA-N 263.341 2.159 10 10 CECE Cc1cc(N(C)C[C@H]2OCC[C@H]2F)ccc1CCN 2122540694 BRAQCXTVRVOJOC-HUUCEWRRSA-N 266.360 2.059 10 10 CECE Cc1ncoc1C(=O)NCc1ccc2cccnc2c1O 1627072915 HMVRQALNIVJPRW-UHFFFAOYSA-N 283.287 2.167 10 10 CECE COc1ccsc1C(=O)NCc1ccc(O)cc1O 1638352716 VGNWGTFJBZXBDR-UHFFFAOYSA-N 279.317 2.098 10 10 CECE CCN(Cc1ccc(F)cc1O)[C@H](C)CC(=O)O 1964703361 KYTYLUOSTGAODW-SECBINFHSA-N 255.289 2.216 10 10 CECE CCC[C@@H](C(=O)O)N(C)Cc1cc(F)cc(F)c1O 1964723647 HNFFLKXISFENPQ-NSHDSACASA-N 273.279 2.356 10 10 CECE CN(C)[C@H](CNCc1ccc(O)c(O)c1)c1ccco1 20122137 MIDKMNUYADWYER-GFCCVEGCSA-N 276.336 2.083 10 10 CECE CCNCc1ccc(N2CCN(CC)[C@@H](C)C2)cc1 216584375 GEFUPJBBBARKOX-AWEZNQCLSA-N 261.413 2.327 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CO[C@H]3C[C@@H]2C3)c(F)c1 2126709231 VFRLRHUCTILJMG-ADGXKJENSA-N 264.344 2.459 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C1(CN)CCC1 138781895 BMXFXWLXWCHFOT-NSHDSACASA-N 262.353 2.041 10 10 CECE Nc1ccc(CCO[C@H]2C[C@@H](n3cccn3)C2)cc1 2127246394 POROBHUGBZCAAN-GASCZTMLSA-N 257.337 2.428 10 10 CECE C[C@@H](CN(C)C(=O)COc1ccc(N)cc1)C(F)F 2127520756 CAUYGTRBBFWDMW-VIFPVBQESA-N 272.295 2.007 10 10 CECE C[C@@]1(CO)CCCN1c1ccc2c(c1)CCC[C@H]2N 2128269156 PAWYHQQIULJZFK-CVEARBPZSA-N 260.381 2.374 10 10 CECE CCO[C@@H]1C=CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128327357 GMMGZYAWBZHIOB-ZBFHGGJFSA-N 258.365 2.414 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CC[C@H]3O)C2(CC2)C1 2128315660 VCIUFKRRRICWDD-DZGCQCFKSA-N 259.349 2.160 10 10 CECE CN[C@H]1CCc2cc(N(C[C@@H](C)O)C3CC3)ccc21 2128315550 SXTLSLAKHGQPJH-BZNIZROVSA-N 260.381 2.243 10 10 CECE C[C@@H]1CN(C)CCCN1c1ccc2c(c1)CC[C@@H]2N 2128316992 LUHCUCBFQGWYDP-WBMJQRKESA-N 259.397 2.163 10 10 CECE CC(C)[C@@H]1[C@@H](O)CCN1c1ccc2c(c1)CC[C@@H]2N 2128324259 BOTFAKVQMDBTSV-HRCADAONSA-N 260.381 2.228 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@]2(C)C[C@H]21 2128970371 YRLHFDXLZBOFHY-WXHSDQCUSA-N 266.345 2.398 10 10 CECE OC[C@@H](CC1CC1)NCc1ccc(Cl)cc1O 1659647210 JPAOMHWIZYJVLA-GFCCVEGCSA-N 255.745 2.296 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3COC[C@H]32)c(F)c1 2129812043 VILBDMXUXRAKDK-IUODEOHRSA-N 264.344 2.159 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H]2CC[C@H]2OC)c1 2130360491 LTSRUSJXRCJCIU-ZIBATOQPSA-N 265.353 2.476 10 10 CECE Cn1cc(CNCc2ccc3c(c2)CCO3)c(Cl)n1 856768344 UYGWEPZYWDQTHK-UHFFFAOYSA-N 277.755 2.298 10 10 CECE CC[C@@H](C)OC(=O)CNCc1ccc(N(C)C)cc1 1857871130 CITNQOWIPNJNOR-GFCCVEGCSA-N 264.369 2.184 10 10 CECE Cn1nc2ccccc2c1C(=O)N1CC[C@H](N=[N+]=[N-])C1 1912154129 GLDMXFRKXJVQMS-VIFPVBQESA-N 270.296 2.098 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CCn2ccccc2=O)C1 1912151280 FOFAFYFWVHHGDY-CYBMUJFWSA-N 275.356 2.261 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(CC[C@H]2CN3CCC2CC3)C1 1912146074 OZXHLCPMKBFPQA-OCCSQVGLSA-N 263.389 2.351 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H](O)[C@H]4CC[C@@H]43)ccc21 2133728704 WFGNXUPFTZTQKH-YHUYYLMFSA-N 259.349 2.016 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3cc(F)ccc3O)C[C@@H]21 2133889828 HXGAOOBYGAKCCS-BYDSVVRCSA-N 265.328 2.434 10 10 CECE CCCN(CC)CCN[C@@H](C)c1cc(O)ccc1O 217709867 CITAARACTGKIME-LBPRGKRZSA-N 266.385 2.480 10 10 CECE C[C@H](NCc1ccncc1F)c1ccc(O)cc1O 2138231654 YUIITEFUSAXERN-VIFPVBQESA-N 262.284 2.483 10 10 CECE COc1ccc(CN[C@@H](C)c2c(O)cccc2O)nc1 1913976169 AWMGLJNURCKVGG-JTQLQIEISA-N 274.320 2.352 10 10 CECE Nc1ccc(OCC(=O)OC[C@]23CCC[C@@H]2C3)cc1 2134450750 HWLYIOVGJGROQK-IAQYHMDHSA-N 261.321 2.381 10 10 CECE CNC[C@@H]1CCCN([C@@H](C)c2cc(OC)ccc2O)C1 218067556 MVOYQKJJPCGHFU-STQMWFEESA-N 278.396 2.393 10 10 CECE Nc1ccc(CNC(=O)c2ccnc(Cl)c2F)cc1 2138569305 GCIMKBUJVFQMFL-UHFFFAOYSA-N 279.702 2.386 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H]3CC[C@@]3(CO)C2)cc1 1903840079 VKDYVRMKSXWMOA-IMJJTQAJSA-N 260.381 2.305 10 10 CECE COc1ccc([C@H](NCCO)c2ccccc2)c(O)c1 20597002 CETKAZXCYIHNCC-MRXNPFEDSA-N 273.332 2.072 10 10 CECE CCNCc1ccc(N2CCN(OC)CC2)c(Cl)c1 1915785647 IOSAYYDVLWLTGH-UHFFFAOYSA-N 283.803 2.133 10 10 CECE CCCN(c1ccc(C=CC(=O)O)cc1)C1COC1 1915718151 NRTXOXCAHOLMKC-UHFFFAOYSA-N 261.321 2.400 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3CCCCC[C@H]3C2=O)cc1F 1916135364 LZYJHBRZQIGROR-GHMZBOCLSA-N 276.311 2.478 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC(F)(F)C3)c(Cl)cc21 1916984433 AAQCYWKDBQGDFM-JTQLQIEISA-N 287.697 2.008 10 10 CECE C[C@@H]1CCO[C@@H]1Cc1noc(-c2sccc2O)n1 1918114724 GBRNZENRLFVLAY-VXNVDRBHSA-N 266.322 2.471 10 10 CECE CC(=O)NCC1CCN(c2ccc([C@@H](C)N)cc2)CC1 226307792 XNUKPPJOUWMFSI-GFCCVEGCSA-N 275.396 2.059 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3C[C@H](C)S[C@@H](C)C3)ccc21 226670935 BWRGLOULUKGJEM-BHDSKKPTSA-N 291.420 2.229 10 10 CECE COc1ccc(CNCC[C@H]2CCCCO2)c(O)c1 227336022 FRSMXLGCKIABNR-CYBMUJFWSA-N 265.353 2.450 10 10 CECE C[C@H](O)[C@@H]1CCN(c2ccc(CN)c(Br)c2)C1 228155227 IHDGWSMUGOFFOQ-GXSJLCMTSA-N 299.212 2.115 10 10 CECE CC(C)[C@]1(C)CC(=O)N(Cc2ccccc2O)C1=O 228430038 WOYYKSODVQZDLP-HNNXBMFYSA-N 261.321 2.313 10 10 CECE CCCOc1cncc(OCc2ccc(N)cc2)n1 1924903446 BEXZWHMIBBBPNY-UHFFFAOYSA-N 259.309 2.427 10 10 CECE Oc1ccc(CNCc2ncoc2C(F)(F)F)c(O)c1 1924962831 IHKOOGGTJUYXLC-UHFFFAOYSA-N 288.225 2.394 10 10 CECE CCNCc1ccc(N2C[C@@H](C)O[C@@H](CO)C2)c(Cl)c1 229979511 AQTBXGXFRKRKNP-DGCLKSJQSA-N 298.814 2.036 10 10 CECE CCCNCc1ccc(N2C[C@H](O)C2(C)C)cc1C 2136627151 YINOXQLXNPVQTR-HNNXBMFYSA-N 262.397 2.454 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@](C)(O)CC2)cc1O 230356878 AULAPPNOZIGGLC-MLGOLLRUSA-N 278.396 2.414 10 10 CECE Cc1cccc(O)c1CNC[C@H](CO)C(C)(C)C 1967700374 XHYIMYNMHGXJLB-GFCCVEGCSA-N 251.370 2.445 10 10 CECE CCO[C@H]1CCCN(c2ccc(CO)c(OC)c2)C1 2139682776 MBQWMMKLOLTFGM-AWEZNQCLSA-N 265.353 2.193 10 10 CECE CCCO[C@@H]1CCN(c2ccc(CN)c(OC)c2)C1 2139687031 WVOBORBRGHRGTA-CQSZACIVSA-N 264.369 2.159 10 10 CECE Cc1ccc(CN(C)Cc2ccc(=N)[nH]c2)c(O)c1 2139771948 IHRMYUSVFKGVPG-UHFFFAOYSA-N 257.337 2.140 10 10 CECE Oc1cc(F)ccc1CN1[C@H]2CC[C@@H]1[C@H]1CC[C@H]2O1 2139804650 OMLOMTROSIVVSY-AYRXBEOTSA-N 263.312 2.426 10 10 CECE Cc1nn(C)cc1CNCc1ccc2c(c1)CCN2C 125562193 RNAZFWJQRCQCTM-UHFFFAOYSA-N 270.380 2.011 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2CCN1CCCC1 234395672 GHOLISJPNFBQBV-AWEZNQCLSA-N 273.424 2.425 10 10 CECE CS(=O)(=O)Nc1ccccc1NCc1ccc(N)cc1 2148949351 SLEHLJSLQCXRHO-UHFFFAOYSA-N 291.376 2.252 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)C1(Cl)CC1 1941413307 GPHCCTWEGYLICU-UHFFFAOYSA-N 274.773 2.154 10 10 CECE CO[C@H]1CN(c2ccc(CN)cc2C(F)(F)F)C[C@H]1F 2146485628 XDPOAEILQOXKTD-PWSUYJOCSA-N 292.276 2.337 10 10 CECE CCCNCc1ccc(N(CC)C2CN(C)C2)c(F)c1 2146885027 PTNPJIKBNDPSHG-UHFFFAOYSA-N 279.403 2.466 10 10 CECE CNC(=O)OC1CN(c2ccc([C@H](C)NC)cc2Cl)C1 2146880020 RMTUDCMQENRNLA-VIFPVBQESA-N 297.786 2.165 10 10 CECE O=C1C(=Cc2ccccc2F)SC(=S)N1CCCO 1951314800 NGGUBWRAXZBCEN-UHFFFAOYSA-N 297.376 2.409 10 10 CECE Oc1cc(C(F)(F)F)ccc1[C@@H]1C[C@@H](O)CCN1 1952076825 TXUXIDRMGPCYBU-WPRPVWTQSA-N 261.243 2.196 10 10 CECE COc1cc([C@@H](CC(=O)O)C2CC2)cc(O)c1O 1952463690 OQKWWYNTACAMSZ-VIFPVBQESA-N 252.266 2.075 10 10 CECE CCOC(=O)[C@@H]1CCN[C@H](c2ccc(F)cc2O)C1 1952461921 BHAPPCJEGJZQGL-SKDRFNHKSA-N 267.300 2.135 10 10 CECE COc1cc(C(F)(F)C(C)(C)C(=O)O)cc(O)c1O 1952883954 PIYHTSZUUSRLMY-UHFFFAOYSA-N 276.235 2.309 10 10 CECE CC(C)(C)OC(=O)[C@@H]1C[C@]1(N)c1cc(F)cc(F)c1O 1952914857 WBJSBONWSQVIQO-XPTSAGLGSA-N 285.290 2.186 10 10 CECE C[C@]12CC[C@H]1CN(c1ccc(CO)c([N+](=O)[O-])c1)C2 2143191918 IWBHOIQCDVLXOX-SMDDNHRTSA-N 262.309 2.323 10 10 CECE CO[C@H]1CCN(Cc2cc(C(C)=O)ccc2O)C[C@H]1C 2149338587 LTHSUQFZHIBXGJ-BZNIZROVSA-N 277.364 2.452 10 10 CECE COC(=O)N[C@H]1CCN([C@H](C)c2ccc(F)cc2O)C1 252795443 BDDBLPKQCBVZGF-KOLCDFICSA-N 282.315 2.023 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H](C)CN 150109378 NKOUJNIHFZLBSN-CYBMUJFWSA-N 277.412 2.086 10 10 CECE CCn1cc(CN[C@H](C)c2ccc(O)cc2O)c(C)n1 2143437968 NHVRKZDZTOSEQS-LLVKDONJSA-N 275.352 2.473 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)C3(CC3)C2)c(F)c1 2149577728 QIQURNQVQBAVNO-OAHLLOKOSA-N 278.371 2.286 10 10 CECE Nc1ccc(N2C[C@@]3(CCCSC3)OC2=O)cc1 258676364 VQGHRSHRIOFYEU-CYBMUJFWSA-N 264.350 2.491 10 10 CECE Oc1cccc(CN[C@H]2CCC[C@@]34C[C@@H](CO3)[C@H]24)c1O 2144359319 RIJBEKYUEOJCGA-GMZLATJGSA-N 275.348 2.145 10 10 CECE Cc1ccc(NC(=O)C(=O)Nc2ccc(N)cc2)cc1 237586392 MIOLJKDDDYGAIM-UHFFFAOYSA-N 269.304 2.154 10 10 CECE CCOC(=O)CC[C@H](N)c1cc2c(cc1O)CCC2 260890160 DNEHHKGHWXKXBX-ZDUSSCGKSA-N 263.337 2.224 10 10 CECE 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Oc1ccccc1CNc1ccn(CC(F)F)n1 133845395 RATWEGGDJXGMAX-UHFFFAOYSA-N 253.252 2.466 10 10 CECE C[C@H](NCc1c(O)cccc1Cl)C(=O)NC(C)(C)C 134653179 RJSYYRUUJSVIGG-VIFPVBQESA-N 284.787 2.438 10 10 CECE N[C@H]1CCCN(c2ccc(OCC(F)F)cc2)C1 43470953 RVOGTLMLZDPETN-JTQLQIEISA-N 256.296 2.258 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCN(C)C[C@@H]1C 229664975 POXZQXVWVUKMCC-FZMZJTMJSA-N 291.395 2.198 10 10 CECE O=C1N[C@H](c2ccc(Br)c(F)c2O)CO1 95718688 HKCLGMACSWRSQX-LURJTMIESA-N 276.061 2.075 10 10 CECE CCC[C@H](O)[C@H](N)c1cc(Br)cc(F)c1O 95805191 VWQRFYSXRXLSHU-VHSXEESVSA-N 292.148 2.455 10 10 CECE CC(C)(CO)[C@@H](N)c1ccc(Br)c(F)c1O 95715868 XJFNYLRYCDRQOA-JTQLQIEISA-N 292.148 2.312 10 10 CECE CCOC(=O)Cc1c(O)c(O)cc(Br)c1F 260298481 DFHSAXMUQXTEKU-UHFFFAOYSA-N 293.088 2.105 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H]2CCNC23CCC3)c1 530214226 CKXUUNZAUCCEMF-IAQYHMDHSA-N 276.380 2.336 10 10 CECE Cc1cc(Cl)cc(CN2CCC(O)CC2)c1O 271774435 FWOONXIVTMJDCM-UHFFFAOYSA-N 255.745 2.311 10 10 CECE 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C[C@@H](NC(=O)NCC[C@@H]1CCOC1)c1ccccc1O 868495447 RQQYPWBRFCVBHQ-VXGBXAGGSA-N 278.352 2.179 10 10 CECE CC(C)(C)[C@](C)(O)CNC(=O)Nc1ccc(N)cc1 1876137351 QFADLXOSKFPGAG-CQSZACIVSA-N 265.357 2.187 10 10 CECE CCc1cc([C@H](O)CCc2ccc(N)cc2)n(C)n1 1877132538 KAFQSACAQUUUSC-OAHLLOKOSA-N 259.353 2.231 10 10 CECE CN(Cc1ccccc1O)c1ccn2nccc2n1 1877533679 WEGMLEJNWRVZLI-UHFFFAOYSA-N 254.293 2.071 10 10 CECE C[C@@H]1CN(CCN(C)Cc2ccccc2O)C[C@H]1C 1877545216 NASRSKIJATXGMW-ZIAGYGMSSA-N 262.397 2.412 10 10 CECE Cc1cnc(N)c(CN(C)Cc2ccccc2O)c1 1877528113 AWJZTTYMJJHVLF-UHFFFAOYSA-N 257.337 2.310 10 10 CECE CN(Cc1ccccc1O)C[C@]1(N)CCC[C@@H]2C[C@H]21 1877538516 NCDNPPJCCYCMCL-XNRPHZJLSA-N 260.381 2.342 10 10 CECE CCc1nnc(CN(C)c2ccc3c(c2)OCO3)s1 784206393 SOIXCRYVGQYEET-UHFFFAOYSA-N 277.349 2.466 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CCCn2nncc2C1 895756282 UPYZMPMXJOKAAM-UHFFFAOYSA-N 296.733 2.182 10 10 CECE O=C(NC[C@H]1CCC2(CCC2)CO1)c1cccc(O)c1O 899465295 CQVTYPVMLGDLDX-LLVKDONJSA-N 291.347 2.177 10 10 CECE C[C@@]1(CNC(=O)Cc2ccc(N)cc2)CCCSC1 1879814535 QCWDWSMLZUHJEI-HNNXBMFYSA-N 278.421 2.461 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@H](N(C)C)C2)c(F)c1 1880484047 BWRVEQWYMZTOIH-KOLCDFICSA-N 270.323 2.158 10 10 CECE C[C@H](O)c1cc(F)c(N2[C@H]3CC[C@H]2COC3)c(F)c1 1880479245 LSPGCHIPWVBCAY-LSJOCFKGSA-N 269.291 2.386 10 10 CECE Cc1ccncc1CN(C)C(=O)c1ccc(C)c(O)c1O 794199501 BFWSXVBRMBVKMV-UHFFFAOYSA-N 286.331 2.382 10 10 CECE Cc1sc(C(=O)N(C)Cc2ccccc2O)nc1O 1149872183 SENLYVSGTPVNMP-UHFFFAOYSA-N 278.333 2.135 10 10 CECE COC(=O)[C@@H]1CCC[C@H]1NCc1cc(C)ccc1O 1338953152 CUMSQRHVOUZUMH-CHWSQXEVSA-N 263.337 2.132 10 10 CECE Cc1csc(N2CCN(c3ccc(N)cc3)CC2)n1 37671425 NPVSMBJCGTVEEE-UHFFFAOYSA-N 274.393 2.360 10 10 CECE C[C@@H](NC(=O)c1ccc2nn[nH]c2c1)c1ccccc1O 1151886102 VEQPBBQYDNMBIH-SECBINFHSA-N 282.303 2.155 10 10 CECE COc1ccc(N(C)C[C@H]2CCCCNC2=O)cc1 1884497135 FACZRQBMIOMCNQ-GFCCVEGCSA-N 262.353 2.048 10 10 CECE CCc1nn(C)c(N(C)[C@@H](C)c2ccccc2O)c1N 2192601273 WTEYTHOLODRDKU-JTQLQIEISA-N 274.368 2.468 10 10 CECE Oc1cccc([C@H]2NCCc3c2ccc(O)c3O)c1 83655906 MTWKDVTZNQDDCU-CQSZACIVSA-N 257.289 2.039 10 10 CECE C[C@H](O)c1nc2cc(C(=O)O)ccc2n1-c1ccc(N)cc1 76080312 URDVRGBAIDAVEF-VIFPVBQESA-N 297.314 2.359 10 10 CECE Cc1cccc(O)c1CNCc1nnc2ccccn12 1963063865 HVVQGPPICZHBKD-UHFFFAOYSA-N 268.320 2.033 10 10 CECE CN(CC[C@@H]1CC1(F)F)C(=O)c1cccc(O)c1O 1885403250 HMPPENVNVFPCIX-MRVPVSSYSA-N 271.263 2.215 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H]2COCC2(F)F)c(F)c1 1888227631 RNGIWBRCZNUSGR-PELKAZGASA-N 275.270 2.349 10 10 CECE Cn1c(Cc2ccc(N)cc2)nc2cc(N)ccc21 84950602 FIBBKDPODKPTOH-UHFFFAOYSA-N 252.321 2.329 10 10 CECE Oc1cc(F)ccc1CNC1C[C@@H]2CC[C@H](C1)O2 1963624792 QKEYPYXDUXSXMH-YHWZYXNKSA-N 251.301 2.331 10 10 CECE CCONC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1312533843 WSINMFSAPYMUMH-UHFFFAOYSA-N 277.368 2.380 10 10 CECE Cc1ccc([C@H](C)N[C@H]2CN3CCC2CC3)c(O)c1 20090968 FZJBMGUCUZJFJH-WFASDCNBSA-N 260.381 2.445 10 10 CECE C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2c1ccc(CN)c(F)c1F 686170843 HIYBEQMWMJCEMX-WHIUSJLISA-N 282.334 2.162 10 10 CECE CC[C@H](NCCOCCCO)c1cccc(Cl)c1O 1322765320 HKZLQDHQJYQXFL-ZDUSSCGKSA-N 287.787 2.485 10 10 CECE Nc1cc2c(cc1N1CCC[C@@H](CF)C1)CCC(=O)N2 711424085 RCYIMPJJKDUZAR-JTQLQIEISA-N 277.343 2.339 10 10 CECE CCCN(CCOc1ccc(N)cc1)CC(C)(C)O 690064906 WLZDCLQTPZMCGP-UHFFFAOYSA-N 266.385 2.131 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H]3COC[C@@H]32)c(F)c1 690320479 CAIVGLYRAOOPLL-GMXABZIVSA-N 264.344 2.461 10 10 CECE C[C@@H](O)c1ccc(N2CCS[C@H](CCO)C2)c(F)c1 720007672 ZMZOXZNPRMAWTC-ZYHUDNBSSA-N 285.384 2.183 10 10 CECE CC[C@@H](O)c1ccc(N2CCS[C@H](CCO)C2)cc1 720007592 RTNFLRSQTXGNOG-HUUCEWRRSA-N 281.421 2.434 10 10 CECE CNCC[C@H]1CCCCN1Cc1ccc(OC)cc1O 70190574 HNAZSLITRXUJFV-CQSZACIVSA-N 278.396 2.365 10 10 CECE C[C@@H]1CCN(Cc2ccc(F)c(F)c2O)CCO1 720500174 KGDUNARQEYOFNP-SECBINFHSA-N 257.280 2.281 10 10 CECE CN(CCC1CCNCC1)c1ccc2c(c1)OCCO2 1964548991 MQRMFKQWOOSVQK-UHFFFAOYSA-N 276.380 2.284 10 10 CECE COc1cccc(CN(C)[C@H]2CN(C)C(C)(C)C2)c1O 694147057 CSSFGFVQZMPUGE-CYBMUJFWSA-N 278.396 2.315 10 10 CECE CN(C)c1ccc([C@H](N)CCCO[C@H]2CCOC2)cc1 699772182 NGRXRBYHLBLGED-JKSUJKDBSA-N 278.396 2.338 10 10 CECE CCCN(CCC(=O)O)Cc1c(O)cccc1OC 1964724211 LLWYNRYEXXDKFK-UHFFFAOYSA-N 267.325 2.088 10 10 CECE COCCNCc1ccc(N(C)[C@@H]2C[C@H]2C)c(F)c1 2116305286 TXFXIPIQWUAFGG-IAQYHMDHSA-N 266.360 2.406 10 10 CECE CCn1nc(C)c(NC(=O)Cc2ccc(O)c(O)c2)c1C 1465485886 BURUALVQGSQPIO-UHFFFAOYSA-N 289.335 2.112 10 10 CECE CC(C)[C@H](C(=O)O)N(C)[C@@H](C)c1c(O)cccc1O 2118366621 HVLOKRWYUMNSGN-TVQRCGJNSA-N 267.325 2.200 10 10 CECE COC(=O)C1CCN([C@@H](C)Cc2ccc(N)cc2)CC1 218198947 XANHUWBPZMSWND-LBPRGKRZSA-N 276.380 2.085 10 10 CECE C[C@H]1OCC[C@H]1CCNC(=O)Nc1ccc(N)cc1 2121100938 MGUSXGLHJFSUFQ-GHMZBOCLSA-N 263.341 2.205 10 10 CECE CO[C@@H]1C[C@H]2[C@H]1CCN2c1ccc([C@H](C)O)cc1F 2121827666 NCFXZWLPRINZPO-OCVOHJKQSA-N 265.328 2.493 10 10 CECE CC(C)CCNC(=O)[C@H](C)N1CCC[C@@H]1CN=[N+]=[N-] 2123015406 LGZQPPDDFGGSJS-NWDGAFQWSA-N 267.377 2.312 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CO)CCC2CC3)cc1 2122356888 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CC[C@]12C[C@@H]1CN(c1ccc(CO)c([N+](=O)[O-])c1)C2 2132058004 KZLREOYRVJHYQX-BXUZGUMPSA-N 262.309 2.323 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@H]2C2CC2)c(Cl)c1 2130608722 VLMSULWTQXNNMW-LSDHHAIUSA-N 280.799 2.409 10 10 CECE Cc1nn(C)c(C)c1COCCc1ccc(N)cc1 2131268447 PPWBNTNJELCKLN-UHFFFAOYSA-N 259.353 2.378 10 10 CECE COC[C@@H]1C[C@H]1C[C@@H](N)c1ccc2c(c1)CCN2C 2133575108 MKNJAICLOBNJNW-SOUVJXGZSA-N 260.381 2.351 10 10 CECE CN(CCCN=[N+]=[N-])S(=O)(=O)c1cccc(F)c1 1912177864 LDAKRTOISKMKFA-UHFFFAOYSA-N 272.305 2.147 10 10 CECE CCC[C@@H](C)NC(=O)CN1CCC[C@@H](CN=[N+]=[N-])C1 1912198636 JBOGLOSSRSILCR-NEPJUHHUSA-N 267.377 2.314 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H]2C[C@@H]2C1 1912152795 BNAYMMQFQAZLFN-FOGDFJRCSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@@]23CCC[C@H]2OCC3)CC1 1912192508 GWOJYCAPIPZIIE-TZMCWYRMSA-N 278.356 2.495 10 10 CECE [N-]=[N+]=NCCCN1CCC(N2CCCCC2=O)CC1 1912143558 HRHCASYYEIWRTD-UHFFFAOYSA-N 265.361 2.164 10 10 CECE CCOC(=O)C1(NCCCN=[N+]=[N-])CC(C(F)F)C1 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10 10 CECE CSCCC[C@@H](O)[C@H](N)c1ccc(N(C)C)cc1 2044748693 VQGRGPSEAGCLPG-ZIAGYGMSSA-N 268.426 2.257 10 10 CECE CN1CCN(c2ccc(CO)cc2Cl)[C@@H]2CC[C@@H]21 2049403188 HTAHHXXMHXHMGS-UONOGXRCSA-N 266.772 2.115 10 10 CECE COC[C@@H]1CN(Cc2c(O)cccc2F)C[C@@H]1C 2054829196 AAYXJPKYMMOQGU-QWRGUYRKSA-N 253.317 2.246 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)[C@@]1(C)CCOC1 2055450482 YUYAETYQEGRXSP-YGRLFVJLSA-N 251.326 2.270 10 10 CECE Nc1ccc(CS(=O)(=O)N2[C@H]3CC[C@@H]2C[C@H](F)C3)cc1 2192115991 GHACRMBSBKKJCK-UBSAEIQESA-N 298.383 2.064 10 10 CECE C[C@H]1C[C@H](C(F)(F)F)N(CCCN=[N+]=[N-])CCN1 2058050914 ZKINIFBQGWNNQG-DTWKUNHWSA-N 265.283 2.302 10 10 CECE C[C@@H](C(=O)NC(C)(C)C)N1CCC[C@H]1CN=[N+]=[N-] 2059060302 VIZLLCIEVHVDNR-UWVGGRQHSA-N 253.350 2.064 10 10 CECE CCCN(C(=O)C[C@@H](C)OC)c1ccc(N)cc1 2059332801 BIJOHRAJIXBYDZ-LLVKDONJSA-N 250.342 2.437 10 10 CECE CCN(CCC(COC)COC)c1ccc(CN)cc1 2187508251 LTTLGMCVPLWFQY-UHFFFAOYSA-N 280.412 2.271 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](F)[C@H](F)C3)ccc21 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CECE O=S(=O)(Nc1ccc(O)c(F)c1)N1CCCCCC1 85200978 RVXFPIMTBBZXAY-UHFFFAOYSA-N 288.344 2.064 10 10 CECE CCCN(CC[C@@H]1CCS(=O)(=O)C1)c1ccc(N)cc1 697159121 BWHGQMFYLOXVBF-CYBMUJFWSA-N 296.436 2.310 10 10 CECE CCOc1cccc(CN2CC[C@H](CC(=O)O)C2)c1O 89715925 MEGFZTPJFGORKU-LLVKDONJSA-N 279.336 2.088 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CCCN2C)c(F)c1 92630842 DCKQKLJEOUADMI-AAEUAGOBSA-N 265.376 2.376 10 10 CECE Cc1ccc([C@H](C)NCC(C)(C)S(C)(=O)=O)c(O)c1 93522750 DZPOEABJXBRVLW-NSHDSACASA-N 285.409 2.174 10 10 CECE CCN(CC(=O)NC)[C@H](C)c1cc(Cl)c(C)cc1O 2270971804 ZEBMFQBNOWNSBR-SNVBAGLBSA-N 284.787 2.483 10 10 CECE O=C(Nc1cc(C(F)(F)F)[nH]n1)c1cc(O)cs1 1340801716 JVADPTDGUPJEEF-UHFFFAOYSA-N 277.227 2.448 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCC[C@@H](F)C1 1452243001 MPEUWVVINUIOPP-MNOVXSKESA-N 267.300 2.037 10 10 CECE C[C@@H]1CN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc2O1 1293578583 YYBRUGOCBCICQW-LLVKDONJSA-N 299.326 2.454 10 10 CECE C[C@H]1C[C@H](C(=O)NCC2(CN=[N+]=[N-])CC2)C[C@@H](C)O1 2117731467 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COC(C)(C)CCNC(=O)c1ccc(N=NC(N)=O)cc1 1643881270 JNWNLOLOKHAETF-UHFFFAOYSA-N 292.339 2.394 10 10 CECE CC(=O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)o1 1643173592 NBLWRYNJGGIPFK-UHFFFAOYSA-N 271.272 2.344 10 10 CECE O=C(CCc1ccoc1)NCc1c(O)cccc1F 1596911609 IEUHHKONRAZXSW-UHFFFAOYSA-N 263.268 2.373 10 10 CECE COc1ccc(O)c([C@@H](C)NCC2(OC)CC2)c1 1964553480 QARXVZCUTIYODJ-SNVBAGLBSA-N 251.326 2.230 10 10 CECE CCCCOCCCNC(=O)CCOc1ccc(N)cc1 160150683 DFZRDIIMQKYVIG-UHFFFAOYSA-N 294.395 2.361 10 10 CECE CCN[C@H]1CCCc2cc(N3CC[C@@H]3CO)ccc21 2128276576 CWAFHQZNQPJZRQ-ZBFHGGJFSA-N 260.381 2.245 10 10 CECE O[C@H]1CCc2cc(N3CCC34CCOCC4)ccc21 2128323402 UKTTVADZXVRWLE-HNNXBMFYSA-N 259.349 2.426 10 10 CECE CCC1(O)CCN(c2ccc3c(c2)CC[C@@H]3N)CC1 2128318907 NXQMHMAYZQYAHA-HNNXBMFYSA-N 260.381 2.374 10 10 CECE CCCNCc1ccc(N2C[C@@H](CO)OC[C@@H]2C)c(C)c1 167309641 ILTVVPPIBGLPOA-HOCLYGCPSA-N 292.423 2.081 10 10 CECE O=C(Nc1ccnc(C2CC2)c1)c1cc(O)c(O)c(O)c1 1865876455 LYFRVWMVHFXPFO-UHFFFAOYSA-N 286.287 2.328 10 10 CECE 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10 CECE CCOc1cc(CNC[C@H]2CCCO2)ccc1N(C)C 211997579 BCZMBUZLHBVRGQ-CQSZACIVSA-N 278.396 2.420 10 10 CECE C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1nccs1 181049220 PNYICDUJLYSVCG-HYYFJVDXSA-N 290.344 2.445 10 10 CECE C[C@H](N)c1cc(Br)c(F)c(O)c1O 213216780 LMJLAGJAPZFQPN-VKHMYHEASA-N 250.067 2.019 10 10 CECE C[C@@H](c1cc(Cl)ccc1O)N(C)CCS(C)(=O)=O 211570321 LMZLFJISAUSLBB-VIFPVBQESA-N 291.800 2.083 10 10 CECE CCNCc1cc(F)c(N(C)C[C@H]2CCN(C)C2)c(F)c1 71190120 VOBWYAHJHDVTDH-LBPRGKRZSA-N 297.393 2.462 10 10 CECE CCOC(=O)[C@](C)(N)CCCSc1nccs1 45596078 NZTPFAZQHNVNGJ-LLVKDONJSA-N 274.411 2.296 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccc(Br)o1 42012838 HEQIIZUPXJCJHT-UHFFFAOYSA-N 273.090 2.472 10 10 CECE CCOC(=O)[C@@](C)(CCN(C)c1ccc(OC)cc1)NC 49972117 UBFACCHRJOAMHO-MRXNPFEDSA-N 294.395 2.063 10 10 CECE CCOC(=O)[C@@H](C)N[C@H](C)c1ccc(C)cc1O 49370431 CAAFAAGYSBXPEA-GHMZBOCLSA-N 251.326 2.303 10 10 CECE CC(C)CS(=O)(=O)N(C)[C@H](C)c1ccccc1O 80190860 HAVBZYVIYPXPAV-LLVKDONJSA-N 271.382 2.371 10 10 CECE 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2.279 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2ccn(C)n2)cc1O 723523149 DSEYLGVVCXODDC-NSHDSACASA-N 274.368 2.043 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC2(CCNC2)C1 724118799 ZSROUWCOLMHXFQ-CYBMUJFWSA-N 259.397 2.109 10 10 CECE CN1CCC(c2noc(Cc3ccc(N)cc3)n2)CC1 723696914 IIVVLTKRLSHCBI-UHFFFAOYSA-N 272.352 2.052 10 10 CECE CCc1cccc(CN2CC[C@@H](O)C(F)(F)C2)c1O 826952629 ODIHSOLXVBDJNK-GFCCVEGCSA-N 271.307 2.157 10 10 CECE C[C@H]1[C@@H](C)N(Cc2cc3c(cc2O)CCC3)CC[S@@]1=O 736601361 WRJCEOSPWQBJGC-JGRMJRGVSA-N 293.432 2.222 10 10 CECE CCc1cccc(CN[C@H](CO)C[C@@H](O)C(C)(C)C)c1O 848909479 UZLJRFJHOPTGOQ-LSDHHAIUSA-N 295.423 2.202 10 10 CECE COc1ccc(O)c(CN[C@H]2CCNC23CCCC3)c1 843129405 TWVCBAOOWGSQRP-HNNXBMFYSA-N 276.380 2.165 10 10 CECE CCc1cccc(CN[C@@H](CC)[C@H](O)C(F)F)c1O 848916709 WZPWTFZLKMPMFP-AAEUAGOBSA-N 273.323 2.449 10 10 CECE CCOC(=O)[C@H](CC1CC1)NCc1ccc2c(c1)CCO2 753569902 IRULFTYOTYDMTH-HNNXBMFYSA-N 289.375 2.443 10 10 CECE COc1ccc(N(C)C(=O)C=C2CCNCC2)cc1F 852850701 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298.314 2.372 10 10 CECE Cc1cc(O[C@H]2CCOC2)ccc1N1CCC(N)CC1 161698568 YKYMKUZIMBCKNB-HNNXBMFYSA-N 276.380 2.090 10 10 CECE CS(=O)(=O)c1cccc(NCc2ccc(O)cc2O)c1 37763171 IEVGJSVBKFBCFX-UHFFFAOYSA-N 293.344 2.113 10 10 CECE CCCOc1cc(N(C)CCNCC)ccc1[N+](=O)[O-] 2150349909 XVIIKMQZYBNDAX-UHFFFAOYSA-N 281.356 2.429 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1ccc(CO)cc1 2148890832 NFIKIXHIRCNAQK-UHFFFAOYSA-N 270.332 2.033 10 10 CECE CCCc1nc(Sc2ncc([C@H](C)O)s2)n[nH]1 1997406138 UHHJDHBWGWDZSI-LURJTMIESA-N 270.383 2.418 10 10 CECE CN(Cc1ccon1)c1ccc(CO)c(Cl)c1 1997759097 HJQGSHUOQQJXKQ-UHFFFAOYSA-N 252.701 2.457 10 10 CECE OCc1cc(F)c(N2C[C@]34CC[C@]3(COC4)C2)c(F)c1 2146563795 QBPZEYIGHODALE-GASCZTMLSA-N 281.302 2.074 10 10 CECE CC[C@@H](C)[C@H](N)C(=O)N(C)[C@H](C)c1ccccc1O 40490689 MDATYRPMXNKHTE-GYSYKLTISA-N 264.369 2.285 10 10 CECE Nc1ccc(CCCN2CCC(F)(F)[C@H](CO)C2)cc1 2146752817 IDPAQEMBDVUMBX-ZDUSSCGKSA-N 284.350 2.151 10 10 CECE COC[C@@]1(OC)CCN([C@H](C)c2cc(C)ccc2O)C1 2151857964 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COc1ccc(N(C)C2(C(=O)O)CCC2)c([N+](=O)[O-])c1 312632744 WHPCMFAIUWSMEX-UHFFFAOYSA-N 280.280 2.047 10 10 CECE CNC(=O)C(C)(C)NCc1c(C)c2ccccc2n1C 312828727 JKJUHZUADOBPSY-UHFFFAOYSA-N 273.380 2.101 10 10 CECE Cc1cnn(C2CN(c3ccc(CCN)c(C)c3)C2)c1 2170285348 ADMODUVJNYLSED-UHFFFAOYSA-N 270.380 2.062 10 10 CECE CC(F)(F)[C@H]1CCN(CC(=O)Nc2ccc(N)cc2)C1 2160119557 IFNSZNJQFCWOFP-JTQLQIEISA-N 283.322 2.184 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CCC(C)(C)N1 2176040686 XRYJASJDYLNFOL-DGCLKSJQSA-N 276.380 2.442 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC(=O)NCCc1cccs1 2179617797 HLVFIAPXJWTPAV-LLVKDONJSA-N 293.396 2.182 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC[C@H](CC(=O)O)C1 86757288 MRAGHSZMPUZZEO-WDEREUQCSA-N 279.336 2.346 10 10 CECE NCc1ccc(N2C[C@@H]3CN4CCCC[C@@H]4[C@@H]3C2)cc1 2170529667 PZBVKNGZRZXFIT-USXIJHARSA-N 271.408 2.066 10 10 CECE Oc1ccc(Cl)c(I)c1O 2054852315 KADLTHKWDNJELE-UHFFFAOYSA-N 270.453 2.356 10 10 CECE Oc1c(CNCCc2cscn2)ccc(F)c1F 703229521 JENTUMMGDLFSOU-UHFFFAOYSA-N 270.304 2.459 10 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2.404 10 10 CECE C[C@H]1CN(C)C[C@@H]1NCc1cccc(Br)c1O 722270026 HOXKSQQEICAWCY-CABZTGNLSA-N 299.212 2.194 10 10 CECE C[C@H](N[C@@H]1CN(C)C[C@H]1C)c1cc(F)ccc1O 722289141 IBFDHLDHNGZJGS-GBIKHYSHSA-N 252.333 2.132 10 10 CECE COc1ccc(O)c(CNCc2cc(C)ccn2)c1 380941066 QXKMDASQUGILHI-UHFFFAOYSA-N 258.321 2.394 10 10 CECE CCN[C@H](C)c1ccc(N2CC[S@](=O)[C@@H](C)C2)c(F)c1 2171968089 GCZRZQRQDZAZHL-ZBUHCNDUSA-N 298.427 2.453 10 10 CECE CO[C@H]1C[C@H](CN[C@@H](C)c2cc(O)ccc2O)C1 714730697 RIBUSRJENXINPO-NHCYSSNCSA-N 251.326 2.173 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1n[nH]c2ccccc12 694029211 PRSBPCKNERLVGI-UHFFFAOYSA-N 258.285 2.383 10 10 CECE C[C@@H](NC(=O)c1ccc(O)c(O)c1)c1cccc(O)c1 383481167 OHESJTOEOFYIAB-SECBINFHSA-N 273.288 2.294 10 10 CECE C[C@H]1CCSCCN1CCC(=O)Nc1ccc(N)cc1 385500157 IZKZBKFAICYVCM-LBPRGKRZSA-N 293.436 2.425 10 10 CECE CCCOc1cc(N2C[C@@H](C)[C@@H](O)C2)ccc1[N+](=O)[O-] 387842814 BCGNRNNMQYQUEM-MFKMUULPSA-N 280.324 2.201 10 10 CECE Cc1cc(N2CC(O)(C(F)F)C2)ccc1CNC(C)C 2172121375 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CCN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1 2333100345 AZQNTHBZBFSODY-YUDUHTQSSA-N 260.381 2.174 10 10 CECE CN1CCCc2cc([C@]3(O)C[C@@H]4CO[C@H]3C4)ccc21 2334537745 PADJWCQYDSAILD-XFBWCDHKSA-N 259.349 2.065 10 10 CECE CCN1CCc2cc([C@H](O)C[C@H]3C[C@H]3CN)ccc21 2335827053 UAHIZONLYFVDPD-IJEWVQPXSA-N 260.381 2.087 10 10 CECE Oc1c(Cl)cccc1CNCc1nn[nH]c1C1CC1 2336991735 CJLNXEINIKDLTJ-UHFFFAOYSA-N 278.743 2.331 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1Cc2ccccc2O1 2337777410 SMMJIICDACFXMV-GFCCVEGCSA-N 260.297 2.149 10 10 CECE COc1ccc(O)c([C@@H](C)NCCc2ncco2)c1 2338766760 ZGFHSBDYDHHSTD-SNVBAGLBSA-N 262.309 2.282 10 10 CECE COC[C@@]1(C)C[C@@H](N)CN1c1ccc(OC)c(Cl)c1 2338814499 SUXFQAKBYUDEJJ-QMTHXVAHSA-N 284.787 2.291 10 10 CECE C[C@H]1C[C@@H]1N(CCO)c1ccc(CN)c(C2CC2)c1 2339161504 SSVPENGPADQNEF-ZBEGNZNMSA-N 260.381 2.230 10 10 CECE CN[C@H](C)c1ccc(N2CC=C[C@@H](O)C2)c(C)c1C 2340849598 XPSDVMDWMXQPKT-ZIAGYGMSSA-N 260.381 2.321 10 10 CECE Cc1c([C@@H](C)O)ccc(N2[C@H]3C[C@@H]2CN(C)C3)c1C 2340851204 PIHKWYBEDOGMLG-MCIONIFRSA-N 260.381 2.249 10 10 CECE Cc1c([C@H](C)O)ccc(N2C[C@@H]3C[C@H]2CN3C)c1C 2340852895 JUUNGZKBHZWDKB-IHRRRGAJSA-N 260.381 2.249 10 10 CECE CSc1cc(N2C[C@H]3CC(O)C[C@@H]3C2)ccc1CN 2353859126 XOCUYAGBYJXFHQ-VXGBXAGGSA-N 278.421 2.074 10 10 CECE Oc1cccc(-c2nc([C@H]3C[C@@H]4CC[C@H]3O4)no2)c1O 2354985437 WGCFSODHCKFLLB-OVYXKVPISA-N 274.276 2.183 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H]3[C@@H](N)[C@@H]4CCC[C@H]34)ccc21 2355399366 LPBLDQCKBXUIOM-QMPXSYISSA-N 272.392 2.086 10 10 CECE COc1cccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@@]3(C)O)c1O 2355727236 GBRLZTGXGBKOCM-BCUIYNNISA-N 277.364 2.040 10 10 CECE CC1(C)OC(=O)C(=CNCc2ccccc2Cl)C(=O)O1 100288917 GHMKZMYLBBLJDV-UHFFFAOYSA-N 295.722 2.150 10 10 CECE CN(C[C@H]1CCCOC1)c1cc2c(cc1N)NC(=O)CC2 111157910 HCHZXZQVDJULCX-LLVKDONJSA-N 289.379 2.016 10 10 CECE COc1ccc(O)c(CNC[C@@H](C)CSC)c1 69436059 DXPGTESBKNLURW-SNVBAGLBSA-N 255.383 2.490 10 10 CECE Oc1c(Br)c(F)cc(F)c1[C@H]1COCCN1 309398523 RRKYJWGFHMGTDW-SSDOTTSWSA-N 294.095 2.094 10 10 CECE C[C@H](N[C@@H]1CCO[C@H](C)C1)c1cc(O)ccc1O 300593218 NPCXPISLKJVHSO-OUAUKWLOSA-N 251.326 2.316 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@](C)(N)C1CC1 37807435 PARMDSMIKLOYAY-QGZVFWFLSA-N 289.423 2.229 10 10 CECE O=C(O)C[C@H]1[C@@H]2CC[C@@H](C2)N1Cc1c(O)cccc1F 2357919179 FXJILQYUZWDTHC-NRUUGDAUSA-N 279.311 2.359 10 10 CECE COCCN1CCC[C@@H]1CN[C@H](C)c1ccc(C)cc1O 185330140 PZZLYERLCPPSJP-HUUCEWRRSA-N 292.423 2.462 10 10 CECE CN[C@H](C)c1cc([N+](=O)[O-])c(F)c(Br)c1O 309168955 KEASGSXZTVCSAP-SCSAIBSYSA-N 293.092 2.482 10 10 CECE CCN(CCCO)c1ccc(CN)cc1Br 124394132 RMZZZLVKCUXMFQ-UHFFFAOYSA-N 287.201 2.117 10 10 CECE COc1cc(N2CCN[C@@H](C(C)C)C2)cc(OC)c1OC 86122427 ANICFXWYTAJACT-CYBMUJFWSA-N 294.395 2.147 10 10 CECE COc1ccc(N2CCC(N)CC2)cc1Br 83869406 XWORXCXNQOPAJT-UHFFFAOYSA-N 285.185 2.385 10 10 CECE CCOC(=O)c1cnc(OCc2ccc(N)cc2)nc1C 134312213 UOMHHXFSHMPOOL-UHFFFAOYSA-N 287.319 2.123 10 10 CECE Nc1ccc(-n2nc(Cl)c(Cl)cc2=O)cc1 82314899 GANALMBLVJYZAD-UHFFFAOYSA-N 256.092 2.122 10 10 CECE OC[C@@H]1C[C@@H]1NCc1cc(Cl)cc(Cl)c1O 381624526 HWBOIMXPTLVJSJ-XVKPBYJWSA-N 262.136 2.169 10 10 CECE O=C1N[C@@H](c2ccc(Br)c(F)c2O)CCO1 95718515 SPAQBDCOUVNYCT-SSDOTTSWSA-N 290.088 2.465 10 10 CECE CC(C)N(C)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 92749942 ZVHXJDHSISSQDL-LLVKDONJSA-N 253.733 2.137 10 10 CECE N[C@@H](c1c(C(=O)O)ccc(Br)c1O)C1CC1 95718483 RGYINGKENVCQNZ-SECBINFHSA-N 286.125 2.263 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1ccc(C)cc1 90257595 XTQZTXGLJRBQOZ-LBPRGKRZSA-N 262.313 2.499 10 10 CECE CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)C[C@@H](C)O1 245512755 AVRRQJKRJARSRE-DGCLKSJQSA-N 295.379 2.409 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2CCNC23CCC3)c1O 530179298 SKKWZARDAMZDEE-CYBMUJFWSA-N 296.798 2.428 10 10 CECE COC(=O)c1cnoc1COc1ccc(N(C)C)cc1 289483976 YFTKHAHXXHQAGC-UHFFFAOYSA-N 276.292 2.106 10 10 CECE CCC[C@@H](CNCc1ccc(O)c(O)c1O)OCC 707844102 ZLKVVDIBRRXDSF-NSHDSACASA-N 269.341 2.098 10 10 CECE Oc1ccc(CCNCc2ncoc2C(F)F)cc1O 2167877230 VBDJWIGZSVJCRH-UHFFFAOYSA-N 284.262 2.356 10 10 CECE COCC[C@@](C)(O)CNCc1cc(Cl)c(F)cc1O 293528902 DSEVCRQKLHGXEB-CYBMUJFWSA-N 291.750 2.062 10 10 CECE C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 296385216 PGYNZWHNKIOMIR-NWDGAFQWSA-N 261.369 2.302 10 10 CECE CN(C)c1ccc([C@@H](NN)C23CCOC(C)(C2)C3)cc1 2164972505 DVNQECMRCXEHHI-QQFBHYJXSA-N 275.396 2.216 10 10 CECE CCCN[C@H](C)c1ccc(N2CC=C[C@@H](O)C2)cc1O 2165065510 SKMFJPDURJUNTA-TZMCWYRMSA-N 276.380 2.190 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H]2CCS(=O)(=O)C2)cc1 2163098699 DOOJGJOWCWNJQX-HIFRSBDPSA-N 297.420 2.001 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3OCC[C@@H]3C2)cc1O 724797912 VYSPCFQBWXXXTC-FIXISWKDSA-N 262.353 2.027 10 10 CECE C[C@H](NCc1cnc2n1CCC2)c1c(O)cccc1O 719854268 WZPUOXSYQAOMOW-JTQLQIEISA-N 273.336 2.091 10 10 CECE CCOc1ccc(O)c(CN[C@@H]2CCCC[C@H]2N)c1 818431239 HJXCTHFEEJXEPQ-ZIAGYGMSSA-N 264.369 2.150 10 10 CECE Cc1cccc(CN2CCC[C@H](C)[C@@H]2C(=O)O)c1O 818631910 VPTCTSVPGQUPNU-GXFFZTMASA-N 263.337 2.386 10 10 CECE NCc1cc(F)c(N2CC[C@@H]3OCC[C@H]3C2)c(F)c1 724833665 QXGCENGBCMDZQB-GWCFXTLKSA-N 268.307 2.039 10 10 CECE CN1C[C@@H]2CCN(C/C=C/c3ccc(N(C)C)cc3)[C@@H]2C1 835057049 XTSHHAKRGKWEFO-HRMTXBTBSA-N 285.435 2.402 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@@H]2CCCN2C)cc1 835038926 ZQHWQBKPEHHXSG-YXMMZVCTSA-N 273.424 2.450 10 10 CECE CN(C[C@H]1CCC(C)(C)O1)C(=O)c1ccc(O)c(O)c1 691894838 UWORKPYGTTYXTH-LLVKDONJSA-N 279.336 2.127 10 10 CECE Cc1cc(O)c(CNCC[C@@]2(O)CCCOC2)c(Cl)c1 846106285 DSSQDNFQUGCMII-HNNXBMFYSA-N 299.798 2.375 10 10 CECE CC[C@@H](N[C@@H]1CCc2nnn(C)c2C1)c1ccccc1O 927144810 JKLLZLZNBDICAE-DGCLKSJQSA-N 286.379 2.119 10 10 CECE CC[C@H](O)[C@H](C)NCc1cccc(Br)c1O 386968678 BAPUVGUJTZCBQA-KWQFWETISA-N 288.185 2.404 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)CCC(F)F)C2)cc1 855226613 RDHWHMBMGAMVPT-NSHDSACASA-N 298.333 2.435 10 10 CECE COCc1n[nH]c(CN[C@@H](C)c2ccc(C)c(C)c2O)n1 850514662 OXGRGXQPGXXXLE-NSHDSACASA-N 290.367 2.124 10 10 CECE CCOCCCNC(=S)N[C@@H](C)c1ccccc1O 865269340 JDANVFFCRFYUMR-NSHDSACASA-N 282.409 2.344 10 10 CECE COC(=O)C1=CC[C@@H](NCc2cc(Cl)ccc2O)C1 862465594 RTMHLPCYNRSANN-GFCCVEGCSA-N 281.739 2.397 10 10 CECE COc1cccc(CNS(=O)(=O)C2(C(C)C)CC2)c1O 866841054 SIRWWOJCQNWKDY-UHFFFAOYSA-N 299.392 2.009 10 10 CECE COc1cc(O)c(CN(C[C@@H](C)O)C(C)C)cc1OC 775682355 WNXTXIPAIISAIV-LLVKDONJSA-N 283.368 2.001 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CC[C@H]1C1CC1 1876560388 JSWIUYFQAQUGNX-RYUDHWBXSA-N 261.321 2.358 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](C)[C@@](C)(O)C2)cc1O 1876948977 YKKKHFWVSFFMTF-PGUXBMHVSA-N 265.353 2.043 10 10 CECE COC(C)(C)CCOC(=O)c1ccc(C)c(O)c1O 787682326 RFEWYRFQVWNWLG-UHFFFAOYSA-N 268.309 2.378 10 10 CECE C[C@@H](O)c1cc(N(C)Cc2ccccc2O)ccn1 1877524015 OYARVHBHGSZMFC-LLVKDONJSA-N 258.321 2.477 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ccnc(CO)c1 1877537751 IZROYRSLVSIQFF-NSHDSACASA-N 258.321 2.477 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H]2NCCSC2(C)C)cc1 1879490870 NIDOYDIQJKPVRE-ZIAGYGMSSA-N 280.437 2.270 10 10 CECE C[C@H](O)c1cc(F)c(N2CCOCC23CC3)c(F)c1 1880480332 VGZMZLZATYRBSB-VIFPVBQESA-N 269.291 2.387 10 10 CECE CNC(=O)[C@H]1CCCCN1[C@H](C)c1ccc(F)cc1O 133045015 UXNMDATUVRSYJV-ZWNOBZJWSA-N 280.343 2.193 10 10 CECE OCC1CCN(c2ccc(CNCC3(F)CC3)cc2)CC1 792929167 ATIUYGJJNZENGA-UHFFFAOYSA-N 292.398 2.487 10 10 CECE CC[C@](C)(O)CN1CCc2cc(OC)c(OC)cc21 1884119588 ODCIREXPTTYWEH-HNNXBMFYSA-N 265.353 2.227 10 10 CECE CN(CCc1cn[nH]c1)Cc1ccc(N(C)C)cc1 1884241300 LHLPAWKZPWBOQN-UHFFFAOYSA-N 258.369 2.150 10 10 CECE FC(F)(F)CN1CCNc2cc3c(cc21)OCO3 57926396 RZNUHTIJDWVTNW-UHFFFAOYSA-N 260.215 2.210 10 10 CECE COc1ccc([C@H]2NCCc3cc(O)ccc32)c(O)c1 83593812 QRMHZJHGPHXFRE-INIZCTEOSA-N 271.316 2.342 10 10 CECE Oc1ccc([C@@H]2NCCc3cccc(F)c32)c(O)c1O 83622202 WVYYRQKMZUTHCO-ZDUSSCGKSA-N 275.279 2.178 10 10 CECE CNC[C@H]1CCCN(c2ccc(OC)cc2OC)C1 84639288 BYVLSKFIGFHQEM-GFCCVEGCSA-N 264.369 2.140 10 10 CECE CN(C)c1ccc(C=CC(=O)NCC(F)(F)F)cc1 1963324837 BRXOVPKVOWWZFX-UHFFFAOYSA-N 272.270 2.444 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H]2CCN(C)C)cc1O 701421689 VTBQDGNJKOYPQH-STQMWFEESA-N 277.412 2.332 10 10 CECE CN(C(=O)[C@@]12CCC[C@@H]1OCC2)c1ccc(N)cc1 687376743 JEJFEVRIQRFLLK-DZGCQCFKSA-N 260.337 2.191 10 10 CECE CN(C)c1ccc(CN2CCCCC[C@@H](N)C2)cc1 709030707 HHOSRDUJRRCSNS-OAHLLOKOSA-N 261.413 2.456 10 10 CECE C[C@@H](c1cc(Cl)ccc1O)N(C)C[C@@H]1CN(C)CCO1 709425077 OQAQLCJKBJATIR-AAEUAGOBSA-N 298.814 2.369 10 10 CECE COCCn1cccc1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 692854579 LINIVFDFTTXUCI-NSHDSACASA-N 277.328 2.049 10 10 CECE CC[C@@H](NC)c1ccc(N(C)Cc2cn(C)nn2)cc1 689255200 JOFCFNWTSIRQHO-OAHLLOKOSA-N 273.384 2.122 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC(F)(F)C[C@H]1C(=O)O 713602561 XIRICQKUJSVUGZ-XCBNKYQSSA-N 289.253 2.387 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CCC[C@H]2O)c(F)c1 689848462 QNRQSFGWAWVQNA-ITDIGPHOSA-N 266.360 2.443 10 10 CECE C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNC(=O)Cc1ccc(N)cc1 717136255 OZAOBUOUVRGVBX-WCUVEOEZSA-N 258.365 2.220 10 10 CECE C[C@@H](NCC[C@H](O)C(F)(F)F)c1ccc(F)cc1O 717344175 BKNDBBHAUOPXLB-HQJQHLMTSA-N 281.249 2.495 10 10 CECE COc1ccc(CNCC[C@@H](O)C(F)(F)F)cc1C 717412283 IFZIIYHEDHGSEB-GFCCVEGCSA-N 277.286 2.407 10 10 CECE COc1ccc([C@@H](C)NCCO[C@@H]2CC2(F)F)c(O)c1 690730614 JKFSIMXKFFITHQ-NOZJJQNGSA-N 287.306 2.476 10 10 CECE CN(C[C@H](O)COc1ccc(N)cc1)CC1(C)CCC1 720462855 FPLHTVAQDSEGFG-AWEZNQCLSA-N 278.396 2.131 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](C)[C@@](C)(CO)C2)c(F)c1 694645575 GECZFKPDPMKWGR-JRPNMDOOSA-N 267.344 2.334 10 10 CECE COc1ccc(O)c(CNC[C@@H]2CCCC[C@H]2CO)c1 89503273 XYIQNHSKILGSKD-STQMWFEESA-N 279.380 2.289 10 10 CECE CCCN(C(=O)c1cc(C)nn1C)c1ccc(N)cc1 90120634 XYLNQNJGKKRLKM-UHFFFAOYSA-N 272.352 2.368 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1cc(F)ccc1F 90257484 UIFGGTBLTNCCOC-LLVKDONJSA-N 284.266 2.469 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC1(C2CCC2)CC1 1452772997 SJMPILPMQGWGHS-UHFFFAOYSA-N 261.321 2.089 10 10 CECE CNC1(C)CCN(c2ccc(OC)cc2OC)CC1 217108456 AAHNRYBDJZABII-UHFFFAOYSA-N 264.369 2.282 10 10 CECE CCNc1cncc(NCCc2ccc(N)cc2)n1 2117370918 YDEAAFZXHADSCX-UHFFFAOYSA-N 257.341 2.145 10 10 CECE NCc1ccc(N2C[C@H](O)C3(CCCC3)C2)c(F)c1 2117749454 PBTQYXFUMZMMOE-AWEZNQCLSA-N 264.344 2.026 10 10 CECE CC1=C[C@@H](NC(=O)CCOc2ccc(N)cc2)CC1 2119417903 LJINWYGUOCACKZ-ZDUSSCGKSA-N 260.337 2.263 10 10 CECE CN(Cc1cnn(C(F)F)c1)c1ccc(CN)cc1 2120838831 GIFWGHITPJCOAI-UHFFFAOYSA-N 266.295 2.373 10 10 CECE Cc1ccc(NC(=O)c2cc(O)c(O)c(C(=O)O)c2)cc1 1554646979 BQSZETQWFLXSCS-UHFFFAOYSA-N 287.271 2.357 10 10 CECE COc1ccc(O)c([C@H](C)N=c2[nH]ccnc2Cl)c1 2121645014 UEOQGIWXTBYBDG-QMMMGPOBSA-N 279.727 2.439 10 10 CECE CCN1c2cc(OC)c(OC)cc2NC(=O)C[C@@H]1C 214156025 WXWLZQYYCYPXRK-VIFPVBQESA-N 264.325 2.261 10 10 CECE CCNCc1ccc(N(C)C2CC3(COC3)C2)cc1 2125789165 PUWUADTVRCJOHB-UHFFFAOYSA-N 260.381 2.411 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)cc1 250014512 XMTBPPHXGPAOHK-SLEUVZQESA-N 274.364 2.343 10 10 CECE NCCN(Cc1ccccc1)c1ccc2c(c1)OCCO2 20238824 KWWUMHPKMLVXRA-UHFFFAOYSA-N 284.359 2.423 10 10 CECE Oc1cccc(Cl)c1CN1CCNC[C@H]1CC(F)F 2127051914 DGJUVBNIKVZLCA-SECBINFHSA-N 290.741 2.475 10 10 CECE O=C(O)c1cc(NCc2ccccc2O)ccc1O 13732187 WSUKEAJMTLBGAN-UHFFFAOYSA-N 259.261 2.408 10 10 CECE C[C@H](N)c1ccc2c(c1)CCCN2CCCC(=O)N(C)C 162232429 YHJFOWAPZCHFGP-ZDUSSCGKSA-N 289.423 2.327 10 10 CECE CCOC(=O)[C@H](N[C@@H](C)CC)c1ccccc1O 166135827 KEBCOABIOKQGDB-GXFFZTMASA-N 251.326 2.385 10 10 CECE CCN[C@@H]1CCc2cc(N3CCC[C@@H](O)C3)ccc21 2128297989 YZFGVFWVLLEALO-GDBMZVCRSA-N 260.381 2.245 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H](O)CC34CC4)ccc21 2128323466 VCIUFKRRRICWDD-HIFRSBDPSA-N 259.349 2.160 10 10 CECE COc1cccc(N(C)C(=O)/C=C/c2cnc(OC)nc2)c1 1866371454 GRHKFIYAOKIGJN-BQYQJAHWSA-N 299.330 2.170 10 10 CECE NC(=O)[C@H](Cc1ccc(N)cc1)c1ccccc1F 20227993 DLZRPVCJAXLCTR-CYBMUJFWSA-N 258.296 2.220 10 10 CECE Oc1c(F)cccc1CN[C@H]1CO[C@@H](C(F)(F)F)C1 2129078456 BOURJZVJSQKBKC-PSASIEDQSA-N 279.233 2.341 10 10 CECE CN(CCc1ccc(N)cc1)CC1(O)CCCCC1 2129440469 KSFQPBUUAJGMJQ-UHFFFAOYSA-N 262.397 2.438 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3CC[C@H]2CN3C)c(F)c1 2130115410 WNATYEHAECCLLA-RTXFEEFZSA-N 263.360 2.128 10 10 CECE C[C@H](NCc1ccc(Cl)cc1O)c1ncn(C)n1 1205417589 HSJRAUYEJREWFI-QMMMGPOBSA-N 266.732 2.025 10 10 CECE O[C@H]1CCc2cc(N3CCC[C@H]3C3(O)CC3)ccc21 2130513219 LHFCUORQLOWEHM-GJZGRUSLSA-N 259.349 2.160 10 10 CECE NCc1ccc2c(c1)CCN2C[C@@H]1CCCC[C@@H]1O 2133388759 VHWAQWWNEAALDJ-HOCLYGCPSA-N 260.381 2.059 10 10 CECE CC[C@H](C)OC(=O)CNCc1cc(Cl)ccc1O 1857872969 JSEYDIQWHAUKCZ-VIFPVBQESA-N 271.744 2.477 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2cnn(C3CC3)c2)C1 1912177530 FWOKBZLXXDVMHC-SNVBAGLBSA-N 274.328 2.381 10 10 CECE Cc1[nH]nc(C(=O)N2CCC(CN=[N+]=[N-])CC2)c1C 1912170977 FAJQXAICIJXGPN-UHFFFAOYSA-N 262.317 2.189 10 10 CECE C[C@]1(C(=O)N2CCCC[C@H](CN=[N+]=[N-])C2)CCCO1 1912175107 IEFYTYYVAUPTMF-DGCLKSJQSA-N 266.345 2.495 10 10 CECE CN1CCC[C@H]1CCN1CCC(CN=[N+]=[N-])CC1 1912198471 GWQVYHRJVUVSHS-ZDUSSCGKSA-N 251.378 2.493 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@@H]2C[C@@H]3CC[C@H]2O3)CC1 1912167256 ITHKEXBGQKMCRK-QJPTWQEYSA-N 264.329 2.103 10 10 CECE CC(C)N1CC[C@@H](N2CCCC[C@H](CN=[N+]=[N-])C2)C1=O 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10 10 CECE COC[C@@]1(O)CCN(c2ccc3c(c2)CCCC3)C1 2226765867 OHPMHYTYKRJSCZ-MRXNPFEDSA-N 261.365 2.153 10 10 CECE CCCN(c1ccc(OC)cc1CN)[C@H]1CCOC1 2227675095 ZKQMLHBQKPNHHC-ZDUSSCGKSA-N 264.369 2.159 10 10 CECE COc1ccc(N2C[C@H]3C[C@H]3C2)c(CNC2CC2)c1 2227682467 PPECEAPPXTXYJE-BETUJISGSA-N 258.365 2.403 10 10 CECE COC[C@H]1C[C@H]1CN(C)c1ccc(OC)cc1C=O 2227703593 PAYVMCBBFJMVMO-WCQYABFASA-N 263.337 2.226 10 10 CECE CN[C@@H](C)c1ccc(N2CCOCCOCC2)c(C)c1 2240735513 OXBBMPNSVNTDBB-AWEZNQCLSA-N 278.396 2.129 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC(N2CCSCC2)C1 2240828724 IFESOYLUKDQIAD-ZDUSSCGKSA-N 292.448 2.286 10 10 CECE COC[C@@]1(C)COCCN1c1ccc([C@H](C)N)cc1C 2240841128 CEABWUALEFVTBJ-BBRMVZONSA-N 278.396 2.256 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cnnc(Br)c1 2251366176 HLHDVJDSTBTEIQ-UHFFFAOYSA-N 299.132 2.059 10 10 CECE CSc1ncc(CNCC[C@@H](N)C2CC2)s1 2243844756 PYAPWHDAAPYVQI-SNVBAGLBSA-N 257.428 2.082 10 10 CECE C[C@H](N)c1ccc(N2CC[C@]3(O)C[C@H]3C2)c(Cl)c1 2254123951 QMWWCTAQTGKHNI-CHIMOYNISA-N 266.772 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CNCc1cc(COC)cc(Br)c1O 214629494 HTSGUXVITQJVHU-UHFFFAOYSA-N 260.131 2.021 10 10 CECE CN(C)c1ccc(/C=C/C(=O)NC[C@@H]2CCC[C@@H]2O)cc1 89160295 PJNYOYBNIYLGIN-DOLYSSGKSA-N 288.391 2.043 10 10 CECE O=C1CSC(=S)N1c1nnc(-c2ccccc2)o1 196105313 VMOOAYHXAKOSJN-UHFFFAOYSA-N 277.330 2.101 10 10 CECE CCN(C[C@H](C)C(=O)O)[C@@H](C)c1ccc(O)cc1O 86761635 PZDHILJMLRVMPL-UWVGGRQHSA-N 267.325 2.201 10 10 CECE COc1ccc(F)cc1CNC(=O)c1cccc(O)c1O 193169344 HHNSGOMJLOLVCE-UHFFFAOYSA-N 291.278 2.176 10 10 CECE COc1ccccc1N(C)CC(=O)Nc1ccc(N)cc1 49966221 WTGZSXXCSHDSHH-UHFFFAOYSA-N 285.347 2.352 10 10 CECE CC(C)(C)N(CCC(=O)O)Cc1ccc(O)cc1O 86749797 GLUBDOXRCJWAKT-UHFFFAOYSA-N 267.325 2.173 10 10 CECE CCCN1C(=O)N=C(N)[C@@H]1c1ccc2c(c1)CCCN2C 94513324 RJUVFPXKNCRIBB-AWEZNQCLSA-N 286.379 2.313 10 10 CECE CN1CCCc2cc(CN[C@H]3CC[C@H](O)CC3)ccc21 253116913 GGQZWSCLMZNEKR-WKILWMFISA-N 274.408 2.462 10 10 CECE CN(C)c1ccc(CNC(=O)/C=C\c2cncc(O)c2)cc1 254926064 GFQOMAUAKNNXDN-YVMONPNESA-N 297.358 2.183 10 10 CECE C[C@@H](N)C1(c2c(Br)cc(O)c(O)c2F)CC1 258506688 KGZCLGVBFFKAIY-RXMQYKEDSA-N 290.132 2.378 10 10 CECE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1nc[nH]n1 269407059 DLLDMHQKQSHQMW-UHFFFAOYSA-N 299.378 2.067 10 10 CECE CCC[C@@H](N)[C@@H](N)c1cc(Br)ccc1O 397083210 UPUXQDUPOLKLET-KOLCDFICSA-N 273.174 2.282 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N1CC(CN(C)C)C1 382727816 JKLAHHFWXKVXAB-ALCCZGGFSA-N 274.364 2.091 10 10 CECE CN(CCn1cccn1)c1ccc(/C=C/C(=O)O)cc1 707619614 DVMDCEPMEJRPBA-VMPITWQZSA-N 271.320 2.117 10 10 CECE O=[N+]([O-])c1cc(Br)c(O)c([C@@H]2CCCN2)c1 383817596 DCBJDKRRZMDXNV-VIFPVBQESA-N 287.113 2.487 10 10 CECE COc1ccc(N2CC[C@H](C)[C@@H]2CO)c(OC)c1C 2278068528 DKMAEPKNCMLOEL-GWCFXTLKSA-N 265.353 2.219 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3C[C@H]4O[C@H]3[C@@H]3C[C@@H]43)ccc21 2163066220 JQGFQEORFVIKOF-YITGRIRXSA-N 271.360 2.136 10 10 CECE CCN1CCc2cc([C@@H](O)c3cn(CC)cn3)ccc21 2163077042 TXDBBUBOSQTQBW-MRXNPFEDSA-N 271.364 2.367 10 10 CECE CN1CCc2cc([C@@H](NN)c3cncc(Cl)c3)ccc21 2163155572 HDUUHKFVNSICGV-OAHLLOKOSA-N 288.782 2.280 10 10 CECE N[C@H](c1cc(Br)ccc1O)[C@@H](O)C1CCC1 396458446 RDRIZIYTMDAFAK-NEPJUHHUSA-N 286.169 2.316 10 10 CECE C[C@H](N[C@H]1CCNC[C@H]1C)c1cc(F)cc(F)c1O 817971048 JPAGBSNVOMMBRB-ZDMBXUJBSA-N 270.323 2.319 10 10 CECE C[C@H](NCCCN)c1ccc(Br)cc1O 817938005 BDODQYITJZATOA-QMMMGPOBSA-N 273.174 2.154 10 10 CECE Oc1ccc(F)cc1CNC[C@]12OCCC[C@H]1C2(F)F 827242937 DUXQKLCCEIOGEZ-OLZOCXBDSA-N 287.281 2.435 10 10 CECE Nc1ccc(CN(CCO[C@@H]2CCOC2)C2CC2)cc1 724962255 XTTRINCOKIJILX-MRXNPFEDSA-N 276.380 2.039 10 10 CECE CCc1cccc(CN[C@@H]2CC[C@@H](C)S(=O)(=O)C2)c1O 827165392 YBMOOEAUAXSLLK-BXUZGUMPSA-N 297.420 2.010 10 10 CECE CC(C)OCCCNC(=O)/C=C\c1ccc(O)c(O)c1 588406066 OPIVGOKQJYDYDE-ALCCZGGFSA-N 279.336 2.042 10 10 CECE COc1ccc(O)c(CNC(=O)/C=C\c2ncccc2C)c1 588455677 KFNAIGNZXNPXFC-VURMDHGXSA-N 298.342 2.434 10 10 CECE CCOc1ccc(O)c(CN[C@@H]2CCSC2)c1 742382535 CNHXITPAOBBDFM-LLVKDONJSA-N 253.367 2.386 10 10 CECE CCN(CC)CCCNC(=O)NCc1c(O)cccc1F 913852277 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CN(C)c1ccc(CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)cc1F 865691708 DSLLCPIQHMCJHY-NTLKJNNPSA-N 290.382 2.405 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)Nc1cnn2c1CCCC2 870696376 FLFPYJQKSFLMAH-ALCCZGGFSA-N 299.330 2.283 10 10 CECE CC1CC(COCC(=O)N(C)c2ccc(N)cc2)C1 1877093981 QUVGGAVITAAGMY-UHFFFAOYSA-N 262.353 2.294 10 10 CECE Nc1ccc(NC(=O)N2CC3(CCC3)CC2=O)cc1 1876149604 NUFSSKIBISDPIH-UHFFFAOYSA-N 259.309 2.203 10 10 CECE CCCOc1cc(N2CC[C@H](CCN)C2)ccc1N 1876399850 TXLLBAIBBVEOTL-LBPRGKRZSA-N 263.385 2.233 10 10 CECE CN(Cc1ccccc1O)c1ccc(C(N)=S)cn1 1877516843 ACMPZYVRXZXZBH-UHFFFAOYSA-N 273.361 2.058 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1cccnc1C 1878792965 WVELTXHIIJVWAB-GJZGRUSLSA-N 258.321 2.090 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCO[C@@H](C)C1 1896322418 HYNXCGNIFQAPNV-LBPRGKRZSA-N 261.321 2.318 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H](C2)O3)cc1C(F)(F)F 1899694092 SOHUAVKSHJHNDA-PHIMTYICSA-N 272.270 2.142 10 10 CECE CC(=O)NCCN1C(=O)C(=C2CCCCC2)SC1=S 1088671133 OJEUVAYYHGIEBX-UHFFFAOYSA-N 298.433 2.201 10 10 CECE Cc1cc2c(cc1O)[C@H](c1cccc(O)c1O)NCC2 83657604 WDLOBHILNDRGFA-HNNXBMFYSA-N 271.316 2.347 10 10 CECE CC(=O)N[C@H](CC(C)C)[C@H]1NCCc2cccc(O)c21 83659570 RNJUEXLEIOLYTJ-CZUORRHYSA-N 276.380 2.130 10 10 CECE CNC(=O)[C@]1(C)CCN(Cc2ccc(Cl)cc2O)C1 1462163138 DVSYXESCFNEGET-CQSZACIVSA-N 282.771 2.004 10 10 CECE C[C@H](CN)c1nc2cccnc2n1-c1ccc(N)cc1 76038358 UIWRLSFKGXKKBF-SNVBAGLBSA-N 267.336 2.065 10 10 CECE Cc1ccc(CNC[C@@]2(CO)CC23CCC3)c(O)c1 1963051494 OTSBUUALJUGVBR-MRXNPFEDSA-N 261.365 2.343 10 10 CECE CN1CC[C@H](CCNCc2ccc3c(c2)CCO3)C1 1963364711 MKBGDMCOCJGSQE-ZDUSSCGKSA-N 260.381 2.053 10 10 CECE C[C@@H]1CCC[C@@H](C)N1NCc1ccc(O)c(O)c1 213919879 WULZPSNGAFCMLO-GHMZBOCLSA-N 250.342 2.365 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cc(O)ccc1F 703744285 DZYZIKHDVIFOMW-UHFFFAOYSA-N 252.249 2.352 10 10 CECE COC1(CC(=O)N2CCC[C@H]2CN=[N+]=[N-])CCC1 691688184 RUPUIBCMXVADTM-JTQLQIEISA-N 252.318 2.247 10 10 CECE O=[N+]([O-])c1ccc(O)c(CNC2C[C@@H]3[C@@H](C2)C3(F)F)c1 1327202610 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C[C@]1(C2CC2)CN(CCc2ccc(N)cc2)CCO1 822256389 NUQQXRBHDIFRIV-MRXNPFEDSA-N 260.381 2.312 10 10 CECE CN(C(=O)[C@@H]1CNc2ccccc2N1)[C@H]1CCC[C@H]1F 2175596170 KOMOIOLNKJHISF-SWHYSGLUSA-N 277.343 2.242 10 10 CECE CC(C)(C)c1cc(=NCc2cccc(O)c2O)[nH]cn1 2064772113 DVDKIJMODNGDPW-UHFFFAOYSA-N 273.336 2.219 10 10 CECE CCN1CCc2cc(N3C[C@H]4CCNC[C@H]4C3)ccc21 2168790202 MOLKXLYOHGAPRN-CABCVRRESA-N 271.408 2.115 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@H]2[C@H]3OCC[C@@H]32)cc1 2176424141 APWYBDQZTHINNX-UGUYLWEFSA-N 275.396 2.072 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2[C@H]3CCCO[C@@H]23)c(O)c1 2176452773 KQZZXSKQZWIDRO-DVUFPGTOSA-N 277.364 2.476 10 10 CECE CP(C)(=O)CCCNC(=O)[C@@H]1CNc2ccccc2N1 2177186901 MRWNYZLARVXCFF-ZDUSSCGKSA-N 295.323 2.022 10 10 CECE Cc1cc(N2CCN([C@@H]3CCSC3)CC2)ccc1CO 2171553735 RIKQBULDTOQRJP-MRXNPFEDSA-N 292.448 2.115 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1csc(C(=O)O)c1 2178683616 VSBAHKQWWHLBBD-UHFFFAOYSA-N 290.344 2.301 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H]3CCNC3(C)C)ccc21 2198666936 IJGLENOEUKXZRU-HOCLYGCPSA-N 273.424 2.457 10 10 CECE CCCNCc1ccc(N2C[C@@H]3CC[C@@]3(CO)C2)cc1 2198882482 TULYLDPNPAOKGR-RDJZCZTQSA-N 274.408 2.395 10 10 CECE N[C@H]1CCCc2cc(N3C[C@@H]4C[C@H](C[C@@H]4O)C3)ccc21 2184690066 XGAKFCIJLAQZFO-DTJGQCLQSA-N 272.392 2.230 10 10 CECE N[C@H]1CCc2cc(N3CCO[C@H](C(F)(F)F)C3)ccc21 2184739188 CVHZVMKBJVWLFI-STQMWFEESA-N 286.297 2.400 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@H]4C[C@H]3C[C@@H]4O)ccc21 2184711027 MRPPKHMDLIPGIC-QCPWZWHMSA-N 272.392 2.243 10 10 CECE C[C@H](N[C@H]1C[C@H](Cn2cncn2)C1)c1ccccc1O 2184777051 JZNKIIZQHFCQCR-AVGNSLFASA-N 272.352 2.113 10 10 CECE C[C@@H]1Cc2ccccc2[C@]1(NCCCN=[N+]=[N-])C(=O)O 2185399720 OOIRMALJPMMQJY-YGRLFVJLSA-N 274.324 2.449 10 10 CECE C[C@@H](NC(=O)[C@@]1(C)CNC(C)(C)C1)c1ccccc1O 2199635903 YGNWONLBQNFQRR-BDJLRTHQSA-N 276.380 2.348 10 10 CECE COC12CC(C1)N(c1ccc(C=CC(=O)O)c(C)c1)C2 2185471220 QQHMIZVMAQPGAQ-UHFFFAOYSA-N 273.332 2.460 10 10 CECE CCN1CCc2cc([C@]3(O)CCNCC34CC4)ccc21 2185944631 OOGXKJXIFYDCFQ-QGZVFWFLSA-N 272.392 2.030 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)C(=O)Nc1ccc(N)cc1 2191502738 GQRBOBZOKXFYQD-FZMZJTMJSA-N 276.384 2.121 10 10 CECE CC(C)[C@H]1COC[C@@H]1NCc1c(O)cccc1F 2042600108 VWFDKNPUXIAHRD-YPMHNXCESA-N 253.317 2.292 10 10 CECE Nc1ccc(C[C@H](O)[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 2045361567 XHQRSFBIQYSSHY-RYDUCSDGSA-N 253.292 2.464 10 10 CECE CCO[C@H]1C=CCN(c2ccc(CN)c(F)c2)C1 2046464244 HWVYYTBZVGLZIP-ZDUSSCGKSA-N 250.317 2.066 10 10 CECE CC(C)[C@@H](O)CN(C)c1ccc([C@@H](C)O)cc1F 2048724858 REOYTCVRFMIWEV-YGRLFVJLSA-N 255.333 2.332 10 10 CECE CN(c1cc2c(cc1Cl)[C@@H](N)C(=O)N2)C1(C)CC1 2050023670 MHYAJHFNGBDXCS-LLVKDONJSA-N 265.744 2.281 10 10 CECE CN(Cc1ccn(C2CC2)n1)c1ccc(CO)cc1F 2186849423 JNOOJOMNASVWEZ-UHFFFAOYSA-N 275.327 2.486 10 10 CECE CC[C@H](N)c1ccc(N2CC[S@](=O)[C@H](C)C2)cc1 2051913489 DBWQRIQHUSGOJR-VZSAFFHGSA-N 266.410 2.054 10 10 CECE C[C@@H]1C[C@@H]1N(C)c1cc2c(cc1Cl)[C@@H](O)C(=O)N2 2052754706 GPZYYTGZJQOKHN-MDSUWVFBSA-N 266.728 2.170 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)[C@H]3C[C@@H]3C3CC3)ccc21 2199901876 JOHJEECDGYFMPB-YQFWSFKMSA-N 272.392 2.086 10 10 CECE CC(F)(F)c1cncc([C@@H](NCCN=[N+]=[N-])C(=O)O)c1 2187392296 DTDUXXBRSPJQPH-SECBINFHSA-N 285.254 2.219 10 10 CECE CCN(Cc1cnnn1C)c1ccc([C@H](C)NC)cc1 2196705360 YNBAHYBKCUNJHS-LBPRGKRZSA-N 273.384 2.122 10 10 CECE COC(=O)[C@H](CC(C)C)N1CCC[C@@H]1CN=[N+]=[N-] 2059052980 HXHKYUSMAKQJIU-MNOVXSKESA-N 254.334 2.349 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)[C@@H]1CCN2CC[C@H]1C2 2192745112 IDMMEVONPSTBKJ-RRQGHBQHSA-N 271.408 2.163 10 10 CECE C[C@H]1SCCC[C@H]1N(C)C(=O)c1cc(O)c(O)c(O)c1 2197297935 WUFKZNHOLBWROP-PSASIEDQSA-N 297.376 2.160 10 10 CECE C[C@]1(NCc2cc(F)cc(F)c2O)CCC[C@H]1O 2062592511 CVECTPUWWXDKIZ-YPMHNXCESA-N 257.280 2.064 10 10 CECE O[C@@H]1CCc2cc(N3C[C@@H]4CSC[C@H]4C3)ccc21 2065077311 LJAJPAXHBMHAGH-LALPHHSUSA-N 261.390 2.465 10 10 CECE CN(Cc1csnn1)c1ccc2c(c1)CC[C@@H]2O 2065082693 DAYUBZVAIZFSQY-ZDUSSCGKSA-N 261.350 2.154 10 10 CECE CCc1cccc(CN[C@@H]2COCC2(F)F)c1O 2067449187 RDKALAWQWNWKQP-LLVKDONJSA-N 257.280 2.078 10 10 CECE CC[C@H](C)c1noc(-c2cc(O)c(O)c(O)c2)n1 2068618166 OAESKUFCIPXRFA-LURJTMIESA-N 250.254 2.367 10 10 CECE CC(C)=CCC[C@](C)(NCCCN=[N+]=[N-])C(N)=O 2070312320 XVEARBOJDSFAHY-LBPRGKRZSA-N 253.350 2.267 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]2C(C)(C)O)c(F)c1 2071165155 SKRZRTHZRQADGE-NOZJJQNGSA-N 252.333 2.195 10 10 CECE CN[C@@H](C)c1ccc(N2CC([N+](=O)[O-])C2)cc1Cl 2071558788 RDSWFKVORAIODU-QMMMGPOBSA-N 269.732 2.086 10 10 CECE Nc1ccc(CS(=O)(=O)NCC2C[C@@H]3CC[C@H]3C2)cc1 2189010470 XWBAIHATUPXVIK-KBPBESRZSA-N 294.420 2.124 10 10 CECE Cc1nc2cnc([C@H](O)Cc3ccc(N)cc3)nc2s1 2189179733 QCBUUUMOYFNPJT-GFCCVEGCSA-N 286.360 2.253 10 10 CECE C[C@]12CC[C@@H]1CCN2c1ccc2c(c1)NC(=O)[C@H]2O 2101038669 CTMFKWWNSUJTSH-DVJZZOLTSA-N 258.321 2.051 10 10 CECE C[C@]1(CO)CC(F)(F)CN1c1ccc(CO)c(Cl)c1 2102791517 QASBQAJGOIYTJL-GFCCVEGCSA-N 291.725 2.429 10 10 CECE Oc1ccc(CNC[C@H]2C[C@H]2C(F)(F)F)c(O)c1O 2103541831 SARZGQCHEKIKGV-HTQZYQBOSA-N 277.242 2.091 10 10 CECE Cc1cccc(O)c1CN1C[C@@H]2CN(C)C[C@@]2(C)C1 2104471777 MEEUODRZBYJFFD-BBRMVZONSA-N 260.381 2.084 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CC2(CCC2)[C@H]1O 2084791093 PWTJPZRKGGHMGN-YPMHNXCESA-N 267.756 2.439 10 10 CECE CN(C)c1ccc([C@]2(O)CCC[C@]23CCNC3)cc1 2106790834 MIAOCFREYNVEHU-HZPDHXFCSA-N 260.381 2.104 10 10 CECE CN1CCc2cc([C@H](O)[C@H](CN)CC3CC3)ccc21 2106790017 DNZSRUAQLLPWCJ-HOCLYGCPSA-N 260.381 2.087 10 10 CECE CN1CCc2cc([C@H](N)CN3CCCCC3)ccc21 2106798098 HMAWBDQVYKKORX-OAHLLOKOSA-N 259.397 2.165 10 10 CECE CCN1CCc2cc([C@H](N)C(C)(C)N(C)C)ccc21 2106792655 GBXQOQWMWCYPJY-HNNXBMFYSA-N 261.413 2.409 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@](C)(O)CSC 2106851134 QCCAOOYQYJQSIJ-CABCVRRESA-N 280.437 2.053 10 10 CECE C[C@]1([C@@H](O)c2ccc(N3CCCC3)cc2)CCNC1 2106832385 ZUOOCORJPAHYDP-HOTGVXAUSA-N 260.381 2.320 10 10 CECE CN1CCc2cc([C@@H](N)[C@H](O)C3CCCC3)ccc21 2106851617 WGQXLMQXROQQOB-HZPDHXFCSA-N 260.381 2.230 10 10 CECE CCN1CCc2cc([C@@H](N)[C@](C)(O)CSC)ccc21 2106855683 QQLNRFYQFXKFDY-HUUCEWRRSA-N 280.437 2.183 10 10 CECE C[C@@H](C1CNC1)[C@H](O)c1ccc(N2CCCC2)cc1 2106822504 GIXIYVWAOBXKMB-LRDDRELGSA-N 260.381 2.176 10 10 CECE COc1cc(N)c(N2CC3CC(F)(C3)C2)cc1OC 2107481907 UZOIKCSLSBRRHS-UHFFFAOYSA-N 266.316 2.224 10 10 CECE COc1ccc([C@H](C)N[C@@H]2C[C@@H]3COC[C@@H]32)c(O)c1 2087580752 XIJQUQSKCLCNHP-GIFSMMMISA-N 263.337 2.086 10 10 CECE C[C@H](O)c1ccc(N2[C@H](CO)C[C@H]3CCC[C@H]32)cc1 2108392915 XYXSMZHQICJLFE-RUAUBTSSSA-N 261.365 2.480 10 10 CECE C[C@@H](NCc1cccc(O)n1)c1cc(F)ccc1O 2088349658 UJGOPFVMLDFPNA-SECBINFHSA-N 262.284 2.483 10 10 CECE C[C@H](NCc1cc(F)cc(F)c1O)c1ncccn1 2089070055 ISAIDJDQGDYOJS-QMMMGPOBSA-N 265.263 2.311 10 10 CECE CCN1CCC[C@@H]1CN(C)c1ccc(OC)cc1N 213460417 DFMPHJCJOZPNNT-GFCCVEGCSA-N 263.385 2.198 10 10 CECE Cc1cc2n(n1)CCN(c1ccc([C@@H](C)O)cc1)C2 2089962814 IYWOKSKBTDZRPB-GFCCVEGCSA-N 257.337 2.265 10 10 CECE COc1cccc([C@H](N)c2ccccc2O)c1OC 2090038307 VZDNCQXVCNRFBM-CQSZACIVSA-N 259.305 2.458 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H](CO)C3CC3)ccc21 2110682782 MTWPYFUXGGTAPF-GDBMZVCRSA-N 260.381 2.087 10 10 CECE CN(C)c1ccc([C@H](N)[C@H](O)[C@@H]2[C@H]3CCC[C@H]32)cc1 2111127694 JOYHHZRQLIGSJX-CQJMVSDSSA-N 260.381 2.159 10 10 CECE CC(=O)c1ccc(O)c(CN(CCO)CC(C)C)c1 2097987253 BJSMJSGMQBLLHW-UHFFFAOYSA-N 265.353 2.045 10 10 CECE CNCc1ccc(OCc2cn(C)nc2C)c(C)c1 2098795213 ZKHZWLLQJRIEPT-UHFFFAOYSA-N 259.353 2.335 10 10 CECE C[C@@H]1C[C@@H](C)[C@H](C(=O)O)N(Cc2ccc(O)cc2O)C1 2201096574 QNFQNNARVSWDOY-GPCCPHFNSA-N 279.336 2.029 10 10 CECE O=C(O)[C@@H]1C=CCN1Cc1c(O)ccc2ccccc12 2201086310 OXHNTFSIOQCUKS-AWEZNQCLSA-N 269.300 2.370 10 10 CECE Cc1cc(N2CCS[C@@H]3COCC[C@@H]32)ccc1CN 2114090705 DRPBGMPIPHOROH-LSDHHAIUSA-N 278.421 2.164 10 10 CECE Cc1cc(CO)ccc1N1CCC[C@@]2(CCOC2)C1 2114690822 UATTVCDKKSBCPJ-MRXNPFEDSA-N 261.365 2.494 10 10 CECE COCCNCc1ccc(N2Cc3ncsc3C2)cc1 2201380801 IZNICWQVNOALQD-UHFFFAOYSA-N 289.404 2.399 10 10 CECE COc1cccc(O)c1CN1CCC(C[C@@H](C)N)CC1 2203550121 JYXNMGWRVULCAM-GFCCVEGCSA-N 278.396 2.350 10 10 CECE Cc1csc([C@H](NCCN=[N+]=[N-])C(=O)O)c1C 2213643303 WVVMLGYBKNXBCO-QMMMGPOBSA-N 254.315 2.391 10 10 CECE CCCNCc1ccc(N2CC[C@H](CO)C2)cc1OC 2204541631 PVODBJZJXHPLBF-ZDUSSCGKSA-N 278.396 2.013 10 10 CECE COc1cc(N(C)C[C@@H]2C[C@]23CCOC3)ccc1CN 2204554085 LHCGJSHUEJUFSC-BBRMVZONSA-N 276.380 2.017 10 10 CECE OCc1cc(F)c(N2[C@@H](CO)CCC23CCC3)c(F)c1 2205759522 MSEOVVFSNAMEFR-LLVKDONJSA-N 283.318 2.341 10 10 CECE CP(C)(=O)[C@@H](O)CN1CCC[C@H](N=[N+]=[N-])CC1 2215742121 TUCJDQOHWXTMQO-VHSXEESVSA-N 260.278 2.092 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H](C3)[C@H]2CO)ccc1[C@@H](C)O 2269693304 XZXBIEOOOILFGR-TWJWRFFLSA-N 261.365 2.398 10 10 CECE CSc1ncc(CN[C@@H](C)[C@H]2CCOC2)s1 2208734354 WYZGKBNCLQLZDD-IUCAKERBSA-N 258.412 2.380 10 10 CECE C[C@H](O)CCN(C)c1ccc2c(c1)OC(F)(F)O2 2219515796 VMLXBSONNKUKAP-QMMMGPOBSA-N 259.252 2.215 10 10 CECE COc1ccc(N2CCC[C@@](C)(CO)C2)cc1F 2219606692 BRMVXUNKCQETCE-CQSZACIVSA-N 253.317 2.433 10 10 CECE COc1ccc(N2CCC[C@@H]2CCO)c(F)c1F 2219763787 XQEWQNGMHJMDOI-SECBINFHSA-N 257.280 2.325 10 10 CECE C[C@H](O)CN(c1ccc([C@H](C)O)c(O)c1)C1CCC1 2272463173 SLWJLBZPXMMBLJ-QWRGUYRKSA-N 265.353 2.185 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@@H](O)P(C)(C)=O 2221505076 UUWASROPPUNTBT-ZDUSSCGKSA-N 270.313 2.032 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3[C@@H]2C[C@H]3O)c(C)c1 2232103868 DZQKVJIFFIHWIV-SHPPOPEUSA-N 260.381 2.235 10 10 CECE Cn1nc(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])cc1C(F)F 2234177606 UIGNZIOGYGJQAU-RQJHMYQMSA-N 284.270 2.319 10 10 CECE Oc1c(F)cccc1CNC[C@@H]1OC[C@H]2CCC[C@@H]21 2224962233 NAHPQFBMPBIREZ-DYEKYZERSA-N 265.328 2.436 10 10 CECE CC1(CO)CCN(c2ccc3c(c2)OCCCO3)CC1 2235115252 LDRJRFFDWBPNGP-UHFFFAOYSA-N 277.364 2.447 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@@H]3[C@@H]2C[C@@]3(C)O)cc1 2225421669 LZTQDDWJHYKOFA-FXUDXRNXSA-N 260.381 2.446 10 10 CECE CSCCC1CC(NC(=O)Cc2ccc(N)cc2)C1 2225579957 LGQMISPRAAMENF-UHFFFAOYSA-N 278.421 2.459 10 10 CECE COc1ncccc1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2225797527 FTMODYJKLKAGEP-UWVGGRQHSA-N 261.285 2.051 10 10 CECE COc1ccc(N(C)[C@@H](C)c2cncn2C)c(C=O)c1 2235999681 LZLPUWGJAVIOJY-NSHDSACASA-N 273.336 2.439 10 10 CECE COc1ccc(N2C[C@H](O)[C@@H]2C)c(CNC(C)(C)C)c1 2235962649 IDEWNIDQTYMKCP-NHYWBVRUSA-N 278.396 2.153 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H](CO)CC2CC2)c(F)c1 2226309533 PNPPBFWVSSEHBX-GWCFXTLKSA-N 266.360 2.443 10 10 CECE O[C@H]1CN(c2ccc(OC3CCC3)cc2)CC1(F)F 2226527643 RHRPYOMYYYHGSI-ZDUSSCGKSA-N 269.291 2.434 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)[C@H]1CO 2226698896 DAYHUXBCLVCHBJ-SCZZXKLOSA-N 271.263 2.215 10 10 CECE C[C@H]1CN(c2ccc3c(c2)COCC3)CC[C@@H]1CO 2226716532 UOUPRVFHMLKAHI-GXTWGEPZSA-N 261.365 2.214 10 10 CECE C[C@H]1C[C@@H](CO)CN1c1ccc2c(c1)OC(F)(F)O2 2226700947 CFYKLKYFAZHPBE-DTWKUNHWSA-N 271.263 2.215 10 10 CECE COc1ccc(N2CC[C@@H](O)C3(CC3)C2)cc1OC 2226804317 CWWITWBYUKBKPU-CQSZACIVSA-N 263.337 2.055 10 10 CECE COc1ccc(N(C)[C@@H]2CCCC[C@@H]2O)cc1OC 2226815548 UPPKOAPEOOEDKQ-OLZOCXBDSA-N 265.353 2.444 10 10 CECE COc1ccc(N2CCOC[C@H]2C[C@H](C)O)cc1Cl 2226923091 SUXZGMXAKJLYOR-CMPLNLGQSA-N 285.771 2.325 10 10 CECE Nc1ccc(OCCCS(=O)(=O)CCC2CC2)cc1 2227193086 GMZXPZIQQYWTKG-UHFFFAOYSA-N 283.393 2.253 10 10 CECE COc1ccc(N(C)[C@@H]2CCO[C@@H]2C)c(C(=O)O)c1 2227677288 HCKJBIMRCGTISF-BXKDBHETSA-N 265.309 2.007 10 10 CECE CC[C@H](C)N(CCOC)c1ccc(OC)cc1CN 2227675457 HWQPPGSXUCNXKE-LBPRGKRZSA-N 266.385 2.405 10 10 CECE C[C@@H]1CC[C@@H]1CN(C)c1ccc2c(c1)NC(=O)[C@@H]2N 2227829245 IIZKPEKUYTVSMS-GPCCPHFNSA-N 259.353 2.121 10 10 CECE CC1(C)CN(C(=O)Nc2ccc(N)cc2)C[C@H]1CCO 2238470567 OYUIMPBQHIVXSG-LLVKDONJSA-N 277.368 2.141 10 10 CECE CN1CC2(CCN2c2ccc(CN)cc2C(F)(F)F)C1 2239008471 WMAOHJASPPRRIH-UHFFFAOYSA-N 285.313 2.058 10 10 CECE COC[C@@]1(C)COCCN1c1ccc([C@@H](C)N)cc1C 2240737545 CEABWUALEFVTBJ-CJNGLKHVSA-N 278.396 2.256 10 10 CECE CN1CCc2cc([C@@H](N)Cc3cnsc3)ccc21 2253409412 KQFISIHDNSRMRK-ZDUSSCGKSA-N 259.378 2.378 10 10 CECE CSc1ncc(CN[C@H](C)c2nn(C)cc2O)s1 2257102502 PEVCLXALNXRPJD-SSDOTTSWSA-N 284.410 2.155 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H](C(=O)O)S2)CC1 2286180837 PJWDYEDIABJEHS-UTLUCORTSA-N 298.368 2.027 10 10 CECE CSc1ncc(CNCC[C@@H](N)C2CCC2)s1 2248733426 IGKBKISQZGEVCN-LLVKDONJSA-N 271.455 2.472 10 10 CECE Nc1ccc(NC(=O)CCCSCC2COC2)cc1 2271378585 TXTVYEMAXUJPCC-UHFFFAOYSA-N 280.393 2.367 10 10 CECE CCNCc1ccc(N2CCC=C[C@]2(C)CO)cc1 2264396640 PYBKDHBFYCMYTB-MRXNPFEDSA-N 260.381 2.313 10 10 CECE Cc1cc(CO)ccc1N(C)Cc1ccnnc1C 2274306709 LRPICRAJEQRKNR-UHFFFAOYSA-N 257.337 2.222 10 10 CECE COc1ccc(N2C[C@H]3C[C@@]3(N)C2)c2ccccc12 2277409278 LADMFIHIHQUWMC-BDJLRTHQSA-N 254.333 2.386 10 10 CECE COc1ccc(N(CCCO)C2CC2)c(OC)c1C 2277993831 LLJKGWSGQCFMEC-UHFFFAOYSA-N 265.353 2.363 10 10 CECE COc1ccc(N(C)[C@H]2CCOC3(CCC3)[C@H]2O)cc1 2279044741 SFMVCGTYJMPPFG-GJZGRUSLSA-N 277.364 2.204 10 10 CECE CCCn1ccc(C(=O)c2cccc3c2NCC3)n1 2269543930 JKECXIXXMLHZKX-UHFFFAOYSA-N 255.321 2.492 10 10 CECE Cc1nc(C)c([C@](C)(NCCCN=[N+]=[N-])C(=O)O)s1 2269687166 JDYZVXSPEGFSLU-NSHDSACASA-N 283.357 2.350 10 10 CECE Cc1cc(N(C)Cc2ccn(C)n2)ccc1[C@H](C)O 2269678812 MSUBSICANAPALY-LBPRGKRZSA-N 259.353 2.418 10 10 CECE COc1ccc(N2CCOC[C@H]2CO)c2ccccc12 2294609822 OKKWUWBMTNIEQN-GFCCVEGCSA-N 273.332 2.046 10 10 CECE COC[C@]1(C)[C@@H]2C[C@@H]2CN1c1c(F)cc(CN)cc1F 2284550814 JSIVSEFCRMSTST-UEKVPHQBSA-N 282.334 2.285 10 10 CECE COc1ccc(CN[C@H]2CC[C@@H](C(N)=O)CC2)cc1C 2287905035 DXEKMWUXGJHLBW-OKILXGFUSA-N 276.380 2.137 10 10 CECE C[C@H](N)c1cc(F)c(N(C)Cc2ccnnc2)c(F)c1 2290046680 IZUSVJQTGHKZAK-VIFPVBQESA-N 278.306 2.411 10 10 CECE Cc1cncc(/C=C\C(=O)N2C[C@H](O)Cc3ccccc32)c1 492952401 LRNDAWRJGVROTL-MWWKQMNYSA-N 294.354 2.353 10 10 CECE CN(Cc1nccs1)C(=O)C=Cc1ccc(O)c(O)c1 2308001817 RTVBXDRTPRTSQY-UHFFFAOYSA-N 290.344 2.226 10 10 CECE Cc1ccc(CN(C)[C@@H]2CC[C@H]2N)c(O)c1Br 2307565166 KALVPJBFNXPDRK-GHMZBOCLSA-N 299.212 2.385 10 10 CECE CCc1nnsc1CN(C)c1ccc(CN)cc1 2314380750 KTMMBALZPHXVQO-UHFFFAOYSA-N 262.382 2.196 10 10 CECE Cc1ccc([C@@H](C)N2CCOC[C@H](F)C2)c(O)c1 2315078146 GIWWJNSRVRJDLV-VXGBXAGGSA-N 253.317 2.432 10 10 CECE CC(C)[C@@H](O)C(C)(C)NCc1cc(F)ccc1O 2318072243 PURINDXDSFRNII-CYBMUJFWSA-N 255.333 2.416 10 10 CECE CP1(=O)CCN(c2cc(F)c(CN)cc2F)CC1 2320016921 PXJRXJVTFORYAJ-UHFFFAOYSA-N 274.251 2.236 10 10 CECE CC1=NN(c2ccccn2)C(=O)C1=Cc1ccc(O)cc1O 2332096177 XAZPZDUFNWUKCK-UHFFFAOYSA-N 295.298 2.299 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 2328706507 PMLHPCRLDLMLLH-CKQPIXPZSA-N 259.349 2.466 10 10 CECE Nc1ccc(OCCN2C[C@@H]3C[C@H]2C(F)(F)C3)cc1 2329006458 FVTQIQAOBUJXRG-MFKMUULPSA-N 268.307 2.377 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](O)[C@@H]3CC[C@@H]32)cc1 2331945767 SDGWGIDFZVNXQF-MWNCTCPHSA-N 260.381 2.317 10 10 CECE C[C@@H]1C[C@H]1[C@H](O)[C@H](N)c1ccc2c(c1)CCCN2C 2332645658 ODXAAUYSGIRUFA-NMFKLSHFSA-N 260.381 2.086 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H]3C[C@]3(O)C2)c(C)c1 2333979026 BZRPFKPKBMIMLU-BJJXKVORSA-N 260.381 2.237 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)CC2(O)CC2)c(F)c1 2340252956 UCYBNKBCRWNSBS-VIFPVBQESA-N 270.323 2.206 10 10 CECE COCCCCCN(C)CCOc1ccc(N)cc1 2342774232 ANUVLWNHTTVDCB-UHFFFAOYSA-N 266.385 2.396 10 10 CECE CCOC(=O)c1nnsc1Nc1ccc(N)cc1 1417027 RYUPODSTGDIZPM-UHFFFAOYSA-N 264.310 2.041 10 10 CECE CCc1cnn(C[C@H](O)c2ccc(N(C)C)cc2)c1 2345724715 NXUNHBGDQQPRKP-HNNXBMFYSA-N 259.353 2.245 10 10 CECE CN(Cc1ccccc1O)[C@@](C)(C(=O)O)C(F)(F)F 2351140150 RYFLNNMBXVVXGD-NSHDSACASA-N 277.242 2.230 10 10 CECE CSc1cc(N2CCC([C@@H](C)O)CC2)ccc1CN 2353853458 BQLZROHRWDBPHV-LLVKDONJSA-N 280.437 2.464 10 10 CECE CSc1cc(N2CC(c3nncs3)C2)ccc1CN 2353854879 AXXSAYRIKGVOAO-UHFFFAOYSA-N 292.433 2.323 10 10 CECE CN1CCCc2cc([C@@]3(N)C[C@@]4(C)CCO[C@H]43)ccc21 2354608493 AHTGNGVGPNZZOF-ZACQAIPSSA-N 272.392 2.422 10 10 CECE COc1cc(Cl)cc(CN2[C@H]3CC[C@@H]2C[C@@H]3CN)c1O 2355420895 OZTDAQMXWFZYHJ-WQAKAFBOSA-N 296.798 2.366 10 10 CECE COc1cc(Cl)cc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@H]3O)c1O 2355718307 BCLVLXWUDVYRDL-VDUILEQBSA-N 297.782 2.303 10 10 CECE CN[C@H]1CCc2cc(N3[C@H]4CC[C@@H]3C[C@H]4CO)ccc21 2356172054 ICIDZAVLFXJRLR-YVVXQTMVSA-N 272.392 2.243 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2O)[C@H]1CC[C@@]2(C)C[C@@H]12 2356224156 ZOHDVWIURINWNA-ZIEJDFEHSA-N 272.348 2.297 10 10 CECE CCCNCc1ccc(N2CCCC[C@H]2C(N)=O)c(C)c1 50561923 VXRZCOOXPHUFCE-INIZCTEOSA-N 289.423 2.339 10 10 CECE CN(C)c1ccc(CN2CCCN(C3CC3)CC2)cc1 179727661 MZFIAQVAHKDGPH-UHFFFAOYSA-N 273.424 2.423 10 10 CECE C[C@@H](N)c1ccc(N2CCC(O)CC2)c(Cl)c1 61694354 OXFDNZCLTSNDKG-SECBINFHSA-N 254.761 2.321 10 10 CECE NCc1ccc(N2[C@H]3CC[C@@H]2CC(O)C3)c(Cl)c1 113507931 HGVVSSASHXACFO-FOSCPWQOSA-N 266.772 2.291 10 10 CECE O=[N+]([O-])c1cc(N2CC(C(F)(F)F)C2)ccc1CO 2132058586 QRBLTQQPQOXDNR-UHFFFAOYSA-N 276.214 2.086 10 10 CECE CC[C@](C)(COCC(=O)N(C)c1ccc(N)cc1)OC 319406296 GBJAHLRLCAZKIK-OAHLLOKOSA-N 280.368 2.063 10 10 CECE CN(c1ccc(/C=C/C(=O)O)cc1)C1CCOCC1 36322032 QPAUDZGWIGERBH-QPJJXVBHSA-N 261.321 2.400 10 10 CECE CCN(CC(=O)NC(C)C)c1ccc(/C=C\C(=O)O)cc1 218067041 UWDOMKKSAAHWNH-YFHOEESVSA-N 290.363 2.135 10 10 CECE CCCCOC[C@H](O)CN(C)c1ccc(OC)cc1OC 195199400 CWNJEGHWJLKMDF-CYBMUJFWSA-N 297.395 2.318 10 10 CECE N[C@@H]1CCCN(c2ccc(OC3CCOCC3)cc2F)C1 87439512 GNDYJDLTDHIHBK-GFCCVEGCSA-N 294.370 2.311 10 10 CECE O=C(O)c1ccc(Sc2ncc([N+](=O)[O-])s2)nc1 226765977 SIHOXSBAVKAGIN-UHFFFAOYSA-N 283.290 2.296 10 10 CECE CN(C)c1ccc(Cn2ncnc2Br)cc1 84197808 RFZHIKWUPLKYCR-UHFFFAOYSA-N 281.157 2.155 10 10 CECE COC[C@@H](N[C@@H](C)c1c(O)cccc1O)C(C)C 234734273 IAWXOOHVCMTKGM-WDEREUQCSA-N 253.342 2.419 10 10 CECE CCOc1cccc(CN[C@@]23C[C@H]2COC3(C)C)c1O 527765035 IDQHSGPWNDGDKU-LRDDRELGSA-N 277.364 2.448 10 10 CECE C[C@@H]1C[C@@H](C)N([C@H](C)C(=O)Nc2ccc(N)cc2)C1 253068986 LGDHQAUPEWFUIR-IJLUTSLNSA-N 261.369 2.326 10 10 CECE CC(C)(CO)c1cc(Br)cc(O)c1O 258524378 YEHKPJOZTRTFMJ-UHFFFAOYSA-N 261.115 2.130 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](C)[C@@H](CO)C2)c(F)c1 700399442 KIZISTULTVYNHN-GMXVVIOVSA-N 267.344 2.334 10 10 CECE C[C@@H]1[C@H]2CNC[C@H]2CN1Cc1cc(Cl)ccc1O 252562220 WLDNBYWEWKANRZ-SUZMYJTESA-N 266.772 2.085 10 10 CECE Cc1ccc(C(=O)N2CC[C@@]3(CCCOC3)C2)c(O)c1O 368600065 ATYCVVJUYWEJRO-INIZCTEOSA-N 291.347 2.049 10 10 CECE COc1ccc(CN[C@@H](CO)C[C@H](O)C(C)(C)C)cc1C 283800112 AKDUUOJIWYCJEK-ZBFHGGJFSA-N 295.423 2.251 10 10 CECE c1cc2c(cc1N1CCC[C@]13CCNC3)OCCCO2 2162669761 FZPMLOVHNNMAJA-MRXNPFEDSA-N 274.364 2.180 10 10 CECE COc1ccc(N2C[C@@]3(C)CNC[C@]3(C)C2)cc1OC 2162670682 BATOSLQZVZPKTG-HZPDHXFCSA-N 276.380 2.140 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](CC(N)=O)C2)c(Cl)c1 723160478 XLPHRRLSADTQCG-VHSXEESVSA-N 281.787 2.061 10 10 CECE CN1CCc2cc([C@@]3(N)CCOCC34CCC4)ccc21 2163064422 WRKNRQOFSBBSHD-KRWDZBQOSA-N 272.392 2.424 10 10 CECE CCN(CC)c1ccc(C2(O)CC3(CCNC3)C2)cc1 2163098134 UIZWKQPPLNLJMF-UHFFFAOYSA-N 274.408 2.494 10 10 CECE CO[C@@H](C(C)C)[C@@H](NN)c1ccc(N2CCCC2)cc1 2163109008 ZYQUNIAJYMFYMI-HOTGVXAUSA-N 277.412 2.462 10 10 CECE CN1CCCc2cc([C@@H](O)C[C@@]3(N)CCSC3)ccc21 2163112338 ATSXDRPWXWUNGG-HOTGVXAUSA-N 292.448 2.327 10 10 CECE OCc1cc(F)c(N2CCC([C@@H](F)CO)CC2)c(F)c1 2163237483 BECWCJYAFZRYQI-ZDUSSCGKSA-N 289.297 2.004 10 10 CECE CNCc1ccc(N(C)[C@@H](CCOC)COC)c(F)c1 2165974353 MMCZSIPUOXUJMH-ZDUSSCGKSA-N 284.375 2.033 10 10 CECE COc1ccc(CN[C@H]2CCn3nccc3C2)cc1C 2165189836 HBOJFSDNDXEDTM-AWEZNQCLSA-N 271.364 2.305 10 10 CECE COC[C@@](C)(O)CCNCc1ccc2ccccc2c1O 824559596 WDTPCFQUNDJKJH-KRWDZBQOSA-N 289.375 2.423 10 10 CECE C[C@@H]1OCC[C@@H]1N(CCO)Cc1cc(Cl)ccc1O 825130114 NIYNCMBICUVXNC-GWCFXTLKSA-N 285.771 2.017 10 10 CECE Cc1cccc(CN2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1O 824653944 JSDVBNNLCRPBMJ-OAGGEKHMSA-N 291.391 2.062 10 10 CECE CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCOC1(C)C 823749964 HDZZMWYLVDYNLV-ZDUSSCGKSA-N 292.379 2.349 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1CCO[C@H]1C1CC1 906992269 SVQYRGYJAKSMPZ-HIFRSBDPSA-N 275.348 2.166 10 10 CECE CN1CCCC[C@@H]1CCC(=O)NCCc1ccc(N)cc1 832659118 MWPRKBRXPFJBMQ-MRXNPFEDSA-N 289.423 2.192 10 10 CECE COc1cccc(CN[C@@H]2CCC[C@H]3OCC[C@H]23)c1O 153936071 ZNNMFMFKJSYAKZ-MGPQQGTHSA-N 277.364 2.448 10 10 CECE CC[C@@H](NCC[C@@H]1CNC(=O)C1)c1ccc(C)cc1O 926982789 RQWRKYMGMUNMNF-GXTWGEPZSA-N 276.380 2.268 10 10 CECE Cc1cc(O)c(CN[C@H]2CCN(C3CCC3)C2=O)cc1C 858343337 YMYOPWPFQRAJIS-HNNXBMFYSA-N 288.391 2.252 10 10 CECE CCNCc1ccc(N2CCCC[C@H](CO)C2)cc1 696711679 HUEKWNIWOOZVDU-HNNXBMFYSA-N 262.397 2.395 10 10 CECE C[C@H](N[C@@H]1CCCS(=O)(=O)CC1)c1ccccc1O 694778791 YIOUTEFJQHGMPY-NWDGAFQWSA-N 283.393 2.010 10 10 CECE C[C@H](NC(=O)[C@@H]1CCC[C@@H](N)C1)c1ccccc1O 870988369 NUCWETRAOAJEPM-QJPTWQEYSA-N 262.353 2.087 10 10 CECE Cc1ncc(CC(=O)NCc2ccc3c(c2)CCCN3C)o1 878534761 LQFJJTBEUBRDHJ-UHFFFAOYSA-N 299.374 2.224 10 10 CECE Cc1nc(F)ccc1/C=C1/SC(=S)NC1=O 779221067 MCSGSWFEIRKHPH-QPJJXVBHSA-N 254.311 2.018 10 10 CECE COC(C)(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773018764 XFIPRRDJFCELKO-NSHDSACASA-N 264.369 2.355 10 10 CECE CC1(N)CCC(NC(=O)Nc2ccc(N)cc2)CC1 1876153095 OOGAAWGVFLACLN-UHFFFAOYSA-N 262.357 2.050 10 10 CECE CCCOc1cc(N2CCC[C@](C)(N)C2)ccc1N 1876349724 LWQCRJFDSWWHDG-HNNXBMFYSA-N 263.385 2.375 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CCCCC[C@H]1N 1876459124 LIAJYCSNBQMDEU-ZYHUDNBSSA-N 263.341 2.039 10 10 CECE CC[C@H](c1ccccc1O)N(CC)CC(=O)N(C)C 133208226 SDAVKKKZRPTJBS-CYBMUJFWSA-N 264.369 2.253 10 10 CECE COCCNCc1ccc(N2C[C@H]3C[C@@H](C2)C3)cc1 1899731516 MQPRPPGRLRDXLV-GASCZTMLSA-N 260.381 2.269 10 10 CECE O=C(Cc1c(F)cccc1F)NCc1ccc(O)cc1O 1142533454 KWKQMJZMHLNXPO-UHFFFAOYSA-N 293.269 2.235 10 10 CECE COC(=O)C[C@@H](C)N(C)Cc1ccc(N(C)C)cc1 1883117549 PJECGXLPMCFYFE-GFCCVEGCSA-N 264.369 2.136 10 10 CECE Cc1cc2c(=O)n(Cc3ccc(N)cc3)cnc2s1 57837828 QMXPXXGQVZGPJK-UHFFFAOYSA-N 271.345 2.397 10 10 CECE C[C@@H](NCCNC(=O)C(C)(C)C)c1ccccc1O 1962970944 YWKRZHDUHDYVNN-LLVKDONJSA-N 264.369 2.205 10 10 CECE CN1C[C@@H]2CC[C@@H](NCc3cccc(Cl)c3O)[C@H]2C1 1474756618 JUVFKYMFIRRWJH-SGMGOOAPSA-N 280.799 2.475 10 10 CECE Cn1cc(C(=O)NCCCCN=[N+]=[N-])c(C(F)(F)F)n1 1963731927 CZLPIFBZLLTREE-UHFFFAOYSA-N 290.249 2.259 10 10 CECE CCCOc1ccc(O)c([C@@]2(C)COCCN2)c1 83385052 BUZPNMSAWJCJRC-CQSZACIVSA-N 251.326 2.016 10 10 CECE Nc1cccc(-c2nnc(-c3ccc(O)c(O)c3)o2)c1 83512770 YGRGXZNHAOWQLO-UHFFFAOYSA-N 269.260 2.397 10 10 CECE [N-]=[N+]=NCCNC(=O)c1ncc(Br)cc1F 1963809340 PYDGKKDBAXDTSR-UHFFFAOYSA-N 288.080 2.023 10 10 CECE COc1ccc(N2C[C@@H](C)NCC2(C)C)cc1OC 84639298 MOZLMGAGQIGOEG-LLVKDONJSA-N 264.369 2.281 10 10 CECE C[C@@H](N)c1ccc(N(C)C2CCOCC2)cc1O 93670564 GRNKDNMLHXVSKB-SNVBAGLBSA-N 250.342 2.027 10 10 CECE Nc1ccc(OCCC(=O)NCc2ccccc2)cc1 40295977 LXDBKNDCYUZLGD-UHFFFAOYSA-N 270.332 2.354 10 10 CECE COc1ccc(N(C)C[C@H](OC)C2CC2)c(N)c1 692136264 BBBCHXYNMAVTOX-AWEZNQCLSA-N 250.342 2.139 10 10 CECE CCC[C@@H]1COC[C@@H]1N(C)CCOc1ccc(N)cc1 688261056 MEVXZWGPTZEQIS-CJNGLKHVSA-N 278.396 2.395 10 10 CECE CCSC[C@H](C)N(C)C(=O)c1ccc(O)c(O)c1 706384908 JJKHOCDNMRJCLB-VIFPVBQESA-N 269.366 2.311 10 10 CECE Nc1ccc(CCNC(=O)[C@H]2CCC[C@@H](F)C2)cc1 1326037635 ATZSOBYOTQGTMY-QWHCGFSZSA-N 264.344 2.456 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2CN(C)CCO2)cc1Cl 707791369 RDJOUPVXTYAQTE-WCQYABFASA-N 298.814 2.160 10 10 CECE COc1ccc(N2C[C@]3(N)CCC[C@@]3(F)C2)c(F)c1 1893617170 AXSKHVSLYXSLSQ-ZIAGYGMSSA-N 268.307 2.244 10 10 CECE CCN[C@H](C)c1ccc(N(C[C@H](C)O)C2CC2)cc1O 709452353 MLMUDZVAMPJXNO-NWDGAFQWSA-N 278.396 2.412 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)cc1 718307443 UZTWGAMGUMMLMS-ORDIRQJYSA-N 259.349 2.354 10 10 CECE Nc1ccc(OCCC(=O)N[C@H]2CC23CCC3)cc1 721208394 WFLNSSQRWIDBNR-ZDUSSCGKSA-N 260.337 2.097 10 10 CECE CC[C@]1(C)CN(c2ccc3c(c2)OCCO3)CCCN1 86285788 HLQNZCBMXQFPLJ-MRXNPFEDSA-N 276.380 2.426 10 10 CECE C[C@@H]1CN(c2ccc(CO)cc2)C[C@@](C)(C(F)F)O1 698779711 JAUZHNGWBGQCRH-YGRLFVJLSA-N 271.307 2.428 10 10 CECE CC[C@@]1(C(=O)O)CCN(Cc2cccc(OC)c2O)C1 86780755 WYSYMGIBOBOFRW-OAHLLOKOSA-N 279.336 2.088 10 10 CECE Cc1cc(CO)ccc1N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2 686169109 XNGFHQDVZJVPLI-XTBFLFJDSA-N 261.365 2.225 10 10 CECE CCCN[C@H](C)c1ccc(N2CC[C@H](O)C2)cc1O 93671460 OVYNMSLJKOHSNV-YPMHNXCESA-N 264.369 2.024 10 10 CECE CC1(C)CCN(c2cc3c(cc2N)NC(=O)CC3)C1 94795488 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Cc1cc(NC(=O)Cc2ccc(O)c(O)c2)cn2ccnc12 1625194745 FICZSAUGMFXBCB-UHFFFAOYSA-N 297.314 2.235 10 10 CECE CCCC1CC(NC(=O)COc2ccc(N)cc2)C1 2123483978 GQJYBPYHYFOIRT-UHFFFAOYSA-N 262.353 2.343 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CCOC[C@H]1CCCCO1 2123016498 YEQOKMPVWBXIBT-CHWSQXEVSA-N 268.361 2.347 10 10 CECE Cc1csc(C(=O)NCc2ccc(O)c(O)c2)c1 1635960035 UWQNFNJNSRHBPN-UHFFFAOYSA-N 263.318 2.398 10 10 CECE CC(=O)c1ccc(O)c(CN2CC=CCC23COC3)c1 2201648038 UPUYKBVFDPZSRT-UHFFFAOYSA-N 273.332 2.126 10 10 CECE N[C@H]1C(=O)Nc2cc(N(CC(F)(F)F)C3CC3)ccc21 105486083 WDKJOLYRJNKOFN-LLVKDONJSA-N 285.269 2.170 10 10 CECE O=C(O)[C@@H]1CCCCCN1Cc1ccc(F)cc1O 1964719422 RJBDYHJMDDYRFK-LBPRGKRZSA-N 267.300 2.361 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F 1652628947 QDWUCNUKAZXXDC-IEBDPFPHSA-N 297.301 2.395 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)O3)cc1 2124949968 YGURRDVUEINHCL-CLLJXQQHSA-N 261.325 2.100 10 10 CECE Nc1ccc(OCCC(=O)NCC=CC2CC2)cc1 1911915769 NLDNTCXZCUXYRO-UHFFFAOYSA-N 260.337 2.120 10 10 CECE CN(C[C@H]1CC[C@@H](C(=O)O)C1)c1ccc(CN)cc1 2125384275 SAZKNZMDSVFHAJ-QWHCGFSZSA-N 262.353 2.082 10 10 CECE Cc1c(CNC2(C)CC(O)C2)n(C)c2ccccc12 2126191602 KFLFAWITMPUEBJ-UHFFFAOYSA-N 258.365 2.490 10 10 CECE C[C@H]1Cc2cc(N3CC[C@]34C[C@@H](CN)C4)ccc2O1 2125789909 BMTAMIMBUWVILW-MKBNYLNASA-N 258.365 2.328 10 10 CECE O=S(=O)(NCc1ccccc1O)C1[C@H]2CCCC[C@H]12 1965758961 QJUVHSZXLNCXTM-RYUDHWBXSA-N 281.377 2.000 10 10 CECE O=C(OCCc1ccccc1)c1cc(O)c(O)c(O)c1 13438132 UHPALUGVFOSLRU-UHFFFAOYSA-N 274.272 2.203 10 10 CECE CCNCc1ccc(N2CCCC[C@@H]2C(N)=O)c(Cl)c1 164006306 YWLNHRUUAAGQKN-CQSZACIVSA-N 295.814 2.294 10 10 CECE CNCc1ccc(N(C)[C@H]2CCOC[C@H]2F)c(F)c1 2130203331 WWVIOSFBLPKMCJ-OCCSQVGLSA-N 270.323 2.108 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](F)[C@H](OC)C3)ccc21 2128294618 LORRVDDFJDPKRM-RBSFLKMASA-N 264.344 2.066 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)Cc1ccccc1 19393313 WWTRKBIIQLNNEM-UHFFFAOYSA-N 269.348 2.339 10 10 CECE CN(c1ccc2c(c1)OCCCO2)C(C)(C)CCO 258951873 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CS(=O)(=O)c1ccsc1CNCc1ccccc1O 1912405582 KCVHJTMLYLBFIA-UHFFFAOYSA-N 297.401 2.147 10 10 CECE C[C@H](NCC[C@@H]1CCC[C@H]1O)c1cc(O)ccc1O 1913730390 AGGFYHIDJSEGKQ-COPLHBTASA-N 265.353 2.300 10 10 CECE C[C@H](N)Cc1ccc2ccn(Cc3cnns3)c2c1 2134090116 AXRIIZPMLJJBPF-JTQLQIEISA-N 272.377 2.431 10 10 CECE C[C@@H]1CN(c2ccc(CN)c3ccccc23)CCN1C 235383448 CUEFTEXBKCBEKN-CYBMUJFWSA-N 269.392 2.439 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H]3[C@@H]2CO)cc1Cl 1905554745 DXVQRJKUZHVDIN-JLBHGKSJSA-N 280.799 2.437 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC2(C[C@H]2C(=O)O)C1 1914705345 PTGLYQFHFHXXEM-RISCZKNCSA-N 274.364 2.220 10 10 CECE CCC1(CC)CCN1C[C@H](O)COc1ccc(N)cc1 1915011535 CWNFCBDCHUDYHI-AWEZNQCLSA-N 278.396 2.273 10 10 CECE CN[C@@H](C)c1ccc(N2CCOCC23CC3)cc1O 1915577492 UHARJCJRJHVXCD-NSHDSACASA-N 262.353 2.042 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H]1C[C@@H]2CC[C@@H]2C1 2134952868 YZPGUYKYIYKGRJ-QCNOEVLYSA-N 266.345 2.254 10 10 CECE C[C@H](N[C@H](CCO)C(F)F)c1ccc(F)cc1O 1918531019 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COc1ccc(N(C)[C@@H]2CNCC[C@@H]2C)c(F)c1F 2136988518 OHNFDJNZYBOQQI-GXSJLCMTSA-N 270.323 2.408 10 10 CECE CN(C(=O)c1ccccc1CCN)c1cccc(O)c1 234244562 HTRBOTDZVUWMJO-UHFFFAOYSA-N 270.332 2.170 10 10 CECE Cc1cccc(CNc2ccnc3nccn23)c1O 2139762778 CKWCECYKYYTWTD-UHFFFAOYSA-N 254.293 2.355 10 10 CECE CCC[C@H]1CN(c2ccc(OC)cc2N)C[C@@H]1CO 2140895154 LLGKEXYTTGXSSV-NWDGAFQWSA-N 264.369 2.122 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)CCN1CCCC1 235472810 ISOVIDOLLIYGHH-LBPRGKRZSA-N 264.369 2.186 10 10 CECE COC[C@@]1(C(=O)O)CCCN1Cc1ccc(Cl)cc1O 2146321855 UIPRGANPYSCBHO-CQSZACIVSA-N 299.754 2.111 10 10 CECE CN[C@@H]1CCN(c2ccc3c(c2)OCO3)[C@H](C)[C@@H]1C 252595678 HPXWISPTXZKJCN-DMDPSCGWSA-N 262.353 2.238 10 10 CECE CNC(=O)[C@H]1[C@@H](C)CCN1c1ccc([C@H](C)O)c(Cl)c1 2146463417 MJBUKSUNYRUGRI-PKFCDNJMSA-N 296.798 2.354 10 10 CECE CCN[C@H](Cc1ccnn1C)c1ccc(N(C)C)cc1 2150678159 YUDBFOVJTPLFOQ-MRXNPFEDSA-N 272.396 2.379 10 10 CECE Nc1ccc(OCCCN2C(=O)[C@H]3CCCC[C@@H]32)cc1 2146808348 YVNAHXZGVFQLNZ-GJZGRUSLSA-N 274.364 2.439 10 10 CECE Cc1cc(N2C[C@@H]3C(CO)[C@H]3C2)ccc1CNC(C)C 2146875576 WAWBXMOQVNQVNS-HOTGVXAUSA-N 274.408 2.168 10 10 CECE CC(C)(C)OC(=O)[C@H]1CCN[C@H]1c1ccc(O)cc1O 1952791358 BXFQTWUPVMGPFS-AAEUAGOBSA-N 279.336 2.090 10 10 CECE CC(C)(C)OC(=O)N1CCOC[C@@H]1Cc1ccc(N)cc1 1952933965 YZKOZHNNVPMLAV-AWEZNQCLSA-N 292.379 2.447 10 10 CECE Cc1cc(C(=O)[C@H](O)c2ccc3c(c2)CCN3C)sn1 2147119220 WHIIPCDBXDRHQH-CQSZACIVSA-N 288.372 2.360 10 10 CECE C[C@@H](N[C@H]1COCCC1(F)F)c1ccccc1O 1972758285 QKXZIOVJNKBKOJ-SKDRFNHKSA-N 257.280 2.467 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2C[C@H](O)C(F)(F)F 2143379095 JKZWLOBNMLXEIX-RNCFNFMXSA-N 288.313 2.253 10 10 CECE Cc1ccc(O)c(CNC[C@@H]2COCCC2(F)F)c1 1974459738 SWYILWPFFPQEIE-GFCCVEGCSA-N 271.307 2.462 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@@H]3COCC[C@H]32)cc1Cl 2143769457 VZSCAUGJWKHBQH-VCTAVGKDSA-N 297.782 2.387 10 10 CECE O=C1Nc2cc(N3CCC4(CC3)CSC4)ccc2[C@H]1O 2150341384 BLSIAJLSFZVOHE-CYBMUJFWSA-N 290.388 2.006 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2CCCCNC2=O)c1 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CCCN(CCN1CCCC1)c1ccc(CN)cc1 233062991 XEWODOOXVOYDCK-UHFFFAOYSA-N 261.413 2.458 10 10 CECE CN(Cc1ccc2c(c1)CCN2C)C[C@@H]1CCCCN1 234305594 IBXJSSHVNGACMH-INIZCTEOSA-N 273.424 2.253 10 10 CECE COC[C@@H]1CCCN(Cc2cc(C(C)=O)ccc2O)C1 234716606 IXLWCQIORGCUBO-CYBMUJFWSA-N 277.364 2.453 10 10 CECE COc1ccc(CN(C[C@@H]2CCCN2)C(C)C)c(O)c1 234950904 FAUVOCFXPJNNNQ-AWEZNQCLSA-N 278.396 2.363 10 10 CECE C[C@@H](NCCN1CCCCC1)c1c(O)cccc1O 235194876 DGYCBNWMMKDKCY-GFCCVEGCSA-N 264.369 2.234 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@H]2[C@H]1[C@@H]2C(=O)O 2151004880 BLPUEWRUVXMJAZ-NKBRHBOISA-N 279.311 2.387 10 10 CECE CN(C)[C@@H]1CCN(Cc2ccc(Cl)cc2O)C1 1942491218 HWBYRWCPUZDQJN-GFCCVEGCSA-N 254.761 2.182 10 10 CECE CC(=O)C(=O)[C@](C)(O)c1ccc(C(F)(F)F)s1 1943309223 DFBSTOCNBHBTHC-SECBINFHSA-N 266.240 2.133 10 10 CECE C[C@H](N[C@@H]1CCN(C)C[C@@H]1C)c1c(O)cccc1O 235727773 HMSUINPROPNNOF-SDDRHHMPSA-N 264.369 2.089 10 10 CECE O=C(O)C[C@]12CC[C@H]1CN(Cc1ccccc1O)C2 2142526480 GGMQTOKAORPGJO-WFASDCNBSA-N 261.321 2.079 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275.440 2.417 10 10 CECE Cc1ccc(CNCc2ccc(O)cc2O)nc1C 314095356 DEPSSPYRLRSKID-UHFFFAOYSA-N 258.321 2.399 10 10 CECE Nc1ccc(OCCNc2ncnc3scnc23)cc1 320807405 VZXUMYQXNUQZSP-UHFFFAOYSA-N 287.348 2.159 10 10 CECE CN(C)CC[C@H]1CCCN(Cc2cc(N)ccc2O)C1 700973020 IBHKXNIAWVHBJY-CYBMUJFWSA-N 277.412 2.138 10 10 CECE COc1ccc(CNCc2cc(C)ccn2)c(O)c1 328070154 DMXGNAROJVPYBF-UHFFFAOYSA-N 258.321 2.394 10 10 CECE CC1(C)CO[C@@H]1COC(=O)CCOc1ccc(N)cc1 2161331229 KYPYKSOPDXCQQA-CYBMUJFWSA-N 279.336 2.006 10 10 CECE C[C@@H]1[C@H](CN(C)CCC(=O)Nc2ccc(N)cc2)[C@@H]1C 2161548970 AFGYXEYNJICRAP-JJLQDPRZSA-N 275.396 2.431 10 10 CECE CC[C@@H](N)c1ccc(N2CCc3ncn(C)c3C2)cc1 2170691826 MLQVVLLEQOQJJM-CQSZACIVSA-N 270.380 2.393 10 10 CECE CN1CCCC[C@@H](CNCc2cccc(F)c2O)C1 700787869 PBQMTDVCOJAYGA-LBPRGKRZSA-N 266.360 2.353 10 10 CECE Cc1ncc(CN[C@H](C)c2cc(F)ccc2O)n1C 701778901 LPYDSXQRGNVTDX-SECBINFHSA-N 263.316 2.424 10 10 CECE CO[C@@H]1C[C@H]2[C@@H]1CCN2c1ccc(C=CC(=O)O)cc1 2178342944 SMEVHQBMGHWAEY-SOUVJXGZSA-N 273.332 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2.369 10 10 CECE COc1ccc(N2CCC[C@@H](CN(C)C)C2)c(C=O)c1 2235982925 IRXKIJXIGOZWJU-ZDUSSCGKSA-N 276.380 2.286 10 10 CECE CCn1nccc1CN(C)c1ccc(OC)cc1CO 2236004772 ZPQSHMYKJGUMRY-UHFFFAOYSA-N 275.352 2.040 10 10 CECE C[C@@H]1CC[C@H]1CN(C)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2236135390 SNUHCDKACFNWJD-TVLCNXBWSA-N 278.327 2.294 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2C[C@H]3CC[C@H]2O3)cc1O 2236352660 JMBVPCXLYRPMRO-MWKWWEEBSA-N 276.380 2.429 10 10 CECE CCN(c1ccc2c(c1)COCC2)[C@H]1CCC[C@H]1O 2226710744 LIEQXDGPPUUMRA-JKSUJKDBSA-N 261.365 2.499 10 10 CECE C[C@H]1[C@H](CO)CCN1c1ccc2c(c1)OC(F)(F)O2 2226706663 NZUCMEPJRYWUIS-IUCAKERBSA-N 271.263 2.215 10 10 CECE COCCn1nccc1N[C@@H](C)c1ccccc1O 2226795478 UHDGLMKTBBVJNN-NSHDSACASA-N 261.325 2.408 10 10 CECE Cc1cc(C)nc([C@H](O)[C@@H](N)c2ccccc2O)c1 2227237969 IWLKVPQRJOAPJV-GJZGRUSLSA-N 258.321 2.137 10 10 CECE C[C@@H]1C[C@@H](Oc2ccc(N(C)C)cc2)C[C@](N)(CO)C1 2237698866 UZDLBPZSSYKMOI-WQVCFCJDSA-N 278.396 2.010 10 10 CECE CN1CCc2cc(CNCC3(F)CCOCC3)ccc21 2238261073 BDGVSVRBLRPNDT-UHFFFAOYSA-N 278.371 2.287 10 10 CECE CC[C@@H](C)NCc1ccc(N(CC)CC(N)=O)c(C)c1 2240039730 IPAXZMWXCNCMIN-CYBMUJFWSA-N 277.412 2.195 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@H]2OCC[C@@H]2C(F)(F)F)CC1 2240500113 YHEFNLJBGTWZKC-YUMQZZPRSA-N 292.261 2.161 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@@H](C)C(=O)NC)c(C)c1 2240755538 VUJPGJZRDPSQBC-STQMWFEESA-N 277.412 2.236 10 10 CECE CSc1ncc(CNC[C@H]2CC23CCNCC3)s1 2257137888 WFQGNOSVQHBCLH-SNVBAGLBSA-N 283.466 2.344 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3COC[C@H]2C3)c(F)c1 2258859960 IKIZOMFGLVJPAN-JBLDHEPKSA-N 251.301 2.104 10 10 CECE CN(Cc1ccc(Cl)cc1O)[C@H]1CNCC12CC2 2258923205 DTMWZKGOIYMCNN-ZDUSSCGKSA-N 266.772 2.229 10 10 CECE CS[C@H]1C[C@H](COC(=O)COc2ccc(N)cc2)C1 2271986957 BXJPUICCRSMUCY-MJHDQNEOSA-N 281.377 2.332 10 10 CECE COc1cc(N(CC(C)C)C[C@H](C)O)ccc1CO 2272322450 UMEGTTIJFFWGCJ-LBPRGKRZSA-N 267.369 2.031 10 10 CECE C[C@@H]1NCCN(c2ccc(OC(F)F)cc2)[C@@H]1C 2263933426 VDAAZJKJMBHEIN-VHSXEESVSA-N 256.296 2.475 10 10 CECE Cc1cc(N2CCN(C)[C@H]3CC[C@@H]32)ccc1[C@H](C)O 2269680011 WJDOUFMJENPNNG-RCBQFDQVSA-N 260.381 2.331 10 10 CECE COc1ccc(N(CCO)CC(F)(F)F)c(OC)c1C 2295357809 PQERUENRGUWVAB-UHFFFAOYSA-N 293.285 2.373 10 10 CECE Cc1cc(N(C)CC(C)(C)S(C)(=O)=O)ccc1[C@@H](C)N 2285121561 MOQDZUQSHDQMML-GFCCVEGCSA-N 298.452 2.274 10 10 CECE Cc1cc(N2CCc3nnccc3C2)ccc1[C@@H](C)O 2285167056 MKYKXIGCFANPEQ-GFCCVEGCSA-N 269.348 2.401 10 10 CECE ClC1=CCCN(Cc2ccc(N3CCNCC3)cc2)C1 2286073324 MDULRIVVANQOIV-UHFFFAOYSA-N 291.826 2.425 10 10 CECE C[C@H](N[C@H]1CCCN(C2CC2)C1)c1cc(O)ccc1O 2288808935 CYOVVGYGBMBCBN-RYUDHWBXSA-N 276.380 2.375 10 10 CECE COCCNCc1ccc(OCc2ncco2)c(C)c1 2289422271 ZAHBCAWSHIBXJL-UHFFFAOYSA-N 276.336 2.298 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)N1C[C@H]2CCC[C@@H]2C1 2307989565 CIZQOMAHUGPMIF-CHWSQXEVSA-N 273.332 2.370 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)N1C[C@@H]2CCC[C@H]2C1 2307989566 CIZQOMAHUGPMIF-STQMWFEESA-N 273.332 2.370 10 10 CECE CN[C@H]1CN(Cc2c(O)cccc2Cl)CC1(C)C 2314802459 KFDOJKKGDUENFB-ZDUSSCGKSA-N 268.788 2.475 10 10 CECE COc1ccc(C2=NN(C)C(=O)C2=Cc2ccc[nH]2)cc1 2332143677 YCJDXYIENRQIBA-UHFFFAOYSA-N 281.315 2.283 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H](C)CN(C)C)c(F)c1 2326785304 OVOWVJILHGCVQA-MNOVXSKESA-N 253.365 2.232 10 10 CECE CCN[C@@H](C)c1ccc(N2CCO[C@@H]3C[C@@H]32)c(F)c1 2330204947 SZRZXVOWODKYNK-NZVBXONLSA-N 264.344 2.474 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC[C@H]3C[C@@H]2CO3)c1 2334124595 AVVALRKQJHYKTP-KWCYVHTRSA-N 263.337 2.058 10 10 CECE CN(CCCN)Cc1cc(OC(F)(F)F)ccc1O 2335915730 RJQMQGIMNQTOPB-UHFFFAOYSA-N 278.274 2.071 10 10 CECE c1cc2c(cc1N1CC[C@H]3CCCN[C@@H]3C1)CCO2 2336191886 QMRMTCUJCHYGBV-IUODEOHRSA-N 258.365 2.200 10 10 CECE CC1(C)COC[C@H]1C(=O)N1CCC(CN=[N+]=[N-])CC1 2336199838 GHEDKLFVWIVPML-NSHDSACASA-N 266.345 2.208 10 10 CECE COc1cc(N2CC[C@@](F)(C(F)F)C2)ccc1CO 2337744828 MVVKOLBKAGUQOA-ZDUSSCGKSA-N 275.270 2.371 10 10 CECE CCN(CCN=[N+]=[N-])Cc1ccccc1CC(=O)O 2337776287 KUTJBWDKRJSKQW-UHFFFAOYSA-N 262.313 2.446 10 10 CECE OCc1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)cc1C1CC1 2339144583 ZIIWSSZABSMDJF-INWMFGNUSA-N 259.349 2.016 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H]2[C@](C)(O)C3)cc1Cl 2339664316 SISZXMHRFBHDHK-NZVBXONLSA-N 280.799 2.409 10 10 CECE Oc1cc2c(cc1O)CN(CCOC1CCC1)CC2 2341217066 USYVXEMITLQSQD-UHFFFAOYSA-N 263.337 2.025 10 10 CECE CCc1cnn(CCN(C)Cc2ccc(N)cc2)c1 2346160405 GILIJIZYCBLWIE-UHFFFAOYSA-N 258.369 2.160 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@H]2C[C@@H]3OCC[C@@H]3O2)C1 2354613157 MOPUTZUSYOEPPM-CRWXNKLISA-N 280.372 2.345 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)CC(=O)NC(C)C 50562112 HXGHSSNTKHDNRK-UHFFFAOYSA-N 289.423 2.208 10 10 CECE COc1ccc(N(C)CC(=O)NC(C)(C)C)cc1OC 63616807 XADFZTXGUPQTOD-UHFFFAOYSA-N 280.368 2.055 10 10 CECE CCN(c1ccc(N)cc1)[C@H](C)C(=O)NCc1ccco1 63114740 QKRNVLVMVQSBDX-GFCCVEGCSA-N 287.363 2.393 10 10 CECE CCCCN(CCO)Cc1ccc(N2CCOCC2)cc1 305728978 KAMIUVRKDVDGRY-UHFFFAOYSA-N 292.423 2.118 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1[C@@H]2C=CC[C@H]1CC2 2357017890 HWGJCXZBSAUBJF-GLQYFDAESA-N 271.364 2.389 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21 2357278924 ZFPLLKSZORCADQ-JVCAYHKKSA-N 273.376 2.450 10 10 CECE NCc1ccc(N2CCCC[C@H]2CO)c(Br)c1 213053479 WYDJEIAKECDXJX-NSHDSACASA-N 299.212 2.259 10 10 CECE Cc1ccc([C@H](C)NCCn2cc([N+](=O)[O-])cn2)c(O)c1 186135466 QQVADPBZEPEJEV-NSHDSACASA-N 290.323 2.156 10 10 CECE CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CCc1ccc(N)cc1 41101786 FUVCQZFJQQWNHL-NWDGAFQWSA-N 292.379 2.048 10 10 CECE CN1CCc2cc([C@H]3[C@@H](CN)CCCN3C)ccc21 226446965 FHEKMBRQAZFTRM-ZBFHGGJFSA-N 259.397 2.021 10 10 CECE CCCN(CC(=O)N(CC)C1CC1)c1ccc(CN)cc1 49292324 HJQNCDYZSTYDHY-UHFFFAOYSA-N 289.423 2.373 10 10 CECE CN1CCCc2cc([C@H]3[C@@H](N)CCCN3C)ccc21 226472561 WSANKZVGRNAWTG-HOCLYGCPSA-N 259.397 2.163 10 10 CECE COCCN(CC(C)C)c1ccc(CN)c(F)c1 135223819 MRTGBABKEUDQNH-UHFFFAOYSA-N 254.349 2.393 10 10 CECE CCCNCc1ccc(N(CC(N)=O)CC(C)C)c(F)c1 42691797 MZRQEFGTXDQNDD-UHFFFAOYSA-N 295.402 2.273 10 10 CECE COC(C)(C)c1noc(-c2ccc(O)c(O)c2)n1 234582960 LAAZXGQEEWLKFF-UHFFFAOYSA-N 250.254 2.029 10 10 CECE COc1ccc(CN2CCC(n3ccnc3)CC2)c(O)c1 92659276 BPWNIRFHHZMXEC-UHFFFAOYSA-N 287.363 2.434 10 10 CECE CC(C)C[C@@H](O)CN[C@@H](C)c1c(O)cccc1O 232595077 YDWBJKKOZGRWBI-WDEREUQCSA-N 253.342 2.155 10 10 CECE CCCCCS(=O)(=O)Nc1ccc(O)c(C(=O)O)c1 274984475 YGFZPFUUQJQOPY-UHFFFAOYSA-N 287.337 2.022 10 10 CECE CCOC(CN1CCCc2cc(CN)ccc21)OCC 700794836 QMHZDAWWNSVXFQ-UHFFFAOYSA-N 278.396 2.297 10 10 CECE Cc1cc(C)c([C@@H](C)N[C@H]2CCC(=O)N(C)C2)c(O)c1 284142254 OUXQRIKYEVZOCE-OLZOCXBDSA-N 276.380 2.280 10 10 CECE Cn1ncc(C2CC2)c1C(=O)c1cccc2c1NCC2 2163950133 TUFGATLHNJHSDB-UHFFFAOYSA-N 267.332 2.497 10 10 CECE CC(C)NCc1ccc(N2CCN(C)[C@H]3CC[C@H]32)cc1 2168355044 NKKIPGBTEGWXMU-DLBZAZTESA-N 273.424 2.467 10 10 CECE CN1CCN(c2ccc(CNC3CC3)cc2)[C@H]2CC[C@H]21 2168355526 QFWUWFZSDXDLPH-SJORKVTESA-N 271.408 2.221 10 10 CECE CCNCc1cc(F)c(N2CC=C[C@H](OC)C2)c(F)c1 2165060855 DMRVQODAMYCLMI-LBPRGKRZSA-N 282.334 2.466 10 10 CECE COc1ccc(N2CC[C@H]([C@@H]3CCCN3)C2)c(OC)c1 2162672004 UXVBMDPLAIWCAA-JSGCOSHPSA-N 276.380 2.282 10 10 CECE CCN[C@@H](C)c1ccc(N(CC)CC(=O)NC)c(F)c1 723192498 RYFUDMQKVABTQT-NSHDSACASA-N 281.375 2.069 10 10 CECE CCN1CCc2cc([C@H](N)c3nc(C)c(C)[nH]3)ccc21 2163071954 TWZGVLTZGBLNFI-HNNXBMFYSA-N 270.380 2.457 10 10 CECE CC[C@H](O)c1ccc(N2C[C@@H](OC)C[C@H](OC)C2)cc1 2165496203 UDGRDUHMXQQNOG-JYJNAYRXSA-N 279.380 2.370 10 10 CECE CN(C[C@@H]1CC12CC2)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2165874079 GFRLUAXKRXXLKB-ISVAXAHUSA-N 276.311 2.048 10 10 CECE CC[C@@H](O)[C@H](N)c1c(O)c(Br)cc(F)c1F 713826869 IHOZGGDCZMXQOT-MUWHJKNJSA-N 296.111 2.204 10 10 CECE CC(C)[C@@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)O 817881687 ZRLVOLVNPVWHQM-IYKSTZQJSA-N 276.380 2.465 10 10 CECE CN1CCCc2cc(CN3C[C@@H](N)C(C)(C)C3)ccc21 720830190 ZOIDHIGPMFDDOO-MRXNPFEDSA-N 273.424 2.238 10 10 CECE CNC(=O)[C@@]1(C)CCN(c2ccc([C@H](C)N)cc2Cl)C1 723197871 HATBUFIMDNFFLJ-BONVTDFDSA-N 295.814 2.322 10 10 CECE CN(C)CC[C@@H]1CCCN1c1c(F)cc(CN)cc1F 700977635 UISITUZDJAEOLO-LBPRGKRZSA-N 283.366 2.344 10 10 CECE Cc1cc(Cl)cc(CN[C@@H](CO)[C@H]2CCCOC2)c1O 840963884 RIQQJUNWWFLXEN-FZMZJTMJSA-N 299.798 2.231 10 10 CECE COC(=O)N1CCN(Cc2c(O)cc(C)cc2Cl)CC1 840911504 DSNCXEDQXUCBRO-UHFFFAOYSA-N 298.770 2.238 10 10 CECE CC(C)CN(C)CCCNCc1cc([N+](=O)[O-])ccc1O 845996344 NQHGXWYJBIIHGJ-UHFFFAOYSA-N 295.383 2.368 10 10 CECE C[C@]1(C(F)F)CN(CCc2ccc(N)cc2)CCO1 698784712 KCVWHASBFRCQBW-CQSZACIVSA-N 270.323 2.167 10 10 CECE Cc1ccc([C@H](C)NC[C@H]2CN(C)C[C@@H](C)O2)c(O)c1 697319319 FFSKUTCABIONIM-RDBSUJKOSA-N 278.396 2.070 10 10 CECE CN(CCCCO)Cc1cc(F)c(N(C)C)cc1F 862339592 ZBACCVFLEGMBFU-UHFFFAOYSA-N 272.339 2.235 10 10 CECE CN(C(=O)c1cccc(N)c1F)c1ccc(N)cc1 1876480326 PXOQOFFLECTYRO-UHFFFAOYSA-N 259.284 2.267 10 10 CECE CN1CCc2cc([C@H](O)C34CCC(CC3)O4)ccc21 1876794421 DCFXVPHIOIVXPD-SIWZUTFBSA-N 259.349 2.424 10 10 CECE COC[C@H](CCCN)N(C)[C@H](C)c1ccccc1O 1877545836 QSDHYRGHVGHAHF-OLZOCXBDSA-N 266.385 2.139 10 10 CECE C[C@@H](c1ccccc1O)N1C(=O)[C@H]2CCC[C@H]2C1=O 1877587750 GAUZNPWDYHRNAT-ZMLRMANQSA-N 259.305 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Cc1cc(CO)ccc1N1CC[C@@H]2CC[C@H](O)[C@H]1C2 2330963612 MOGDADZXFXCHTN-MAZHCROVSA-N 261.365 2.227 10 10 CECE C[C@H](N[C@@H]1[C@H]2COCC[C@H]21)c1ccc(N(C)C)cc1 2331251944 HNBLAFVZPUYAKO-MWNCTCPHSA-N 260.381 2.438 10 10 CECE CN1CCC[C@H]2CCN(Cc3ccccc3O)C[C@H]21 2335552688 GDZINNILTIEKQV-DZGCQCFKSA-N 260.381 2.308 10 10 CECE CCN(CCN=[N+]=[N-])CCS(=O)(=O)C1CCCCC1 2337776263 KMBWLDNRJVVXBA-UHFFFAOYSA-N 288.417 2.366 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H]2C[C@H]3OC)c(C=O)c1 2340769822 ZAIBHPDIMTYVCU-ITDIGPHOSA-N 261.321 2.121 10 10 CECE C[C@H](SCCC1(O)CC1)C(=O)Nc1ccc(N)cc1 2343403763 DRGFESUFGUAFKT-JTQLQIEISA-N 280.393 2.244 10 10 CECE C[C@H]1C[C@](C(=O)O)(N(C)Cc2ccccc2O)CS1 2347550841 UMWFVOHWYBUAQC-HZMBPMFUSA-N 281.377 2.173 10 10 CECE C[C@@H](c1ccccc1O)N1CC(F)(F)[C@@](C)(CN)C1 2351602761 FIVVKYMSAIRJQU-GWCFXTLKSA-N 270.323 2.369 10 10 CECE CSc1cc(N(C)C[C@H]2OCC[C@@H]2F)ccc1CN 2353861377 XOPKZDIEDJDCFA-QWHCGFSZSA-N 284.400 2.430 10 10 CECE C[C@@H](c1ccccc1O)N(C)C[C@@H]1C[C@@H]2COC[C@@H]2O1 2353872229 HPVTXQAOKNCZKY-ZWUHOBOKSA-N 277.364 2.189 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 2353917951 MBKIUMIYAYRPQK-NOWRLKFISA-N 281.302 2.183 10 10 CECE N[C@H]1CCc2cc(N3[C@H]4CCC[C@H]4C[C@@H]3CO)ccc21 2356173331 ZKWCAFPBBIJAQU-YVVXQTMVSA-N 272.392 2.372 10 10 CECE CCC(CC)N(CCOC)c1ccc2c(c1)NC(=O)[C@@H]2N 105459530 ZJXCQOPXAMFICU-OAHLLOKOSA-N 291.395 2.280 10 10 CECE CNC1C[C@H]2CC[C@H](C1)N2c1ccc2c(c1)OCO2 103677153 VTESXESTWDJWDJ-VXGBXAGGSA-N 260.337 2.135 10 10 CECE CCCC[C@H](C)NS(=O)(=O)Cc1ccc(N)cc1 50886750 JMRDUJBZWCPRAE-NSHDSACASA-N 270.398 2.267 10 10 CECE CN(C(=O)c1cc(O)c(O)c(O)c1)[C@H]1CCC[C@@H]2C[C@H]12 2356975480 WUEZVIMWHYVGMP-MIMYLULJSA-N 277.320 2.064 10 10 CECE Oc1c([C@H]2CCN2)cc(Br)c(F)c1F 306837895 WPXGEQCQOSTOJH-ZCFIWIBFSA-N 264.069 2.467 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CCC(C)(C)C1 129731584 JZNHUAWLCWDCEW-LBPRGKRZSA-N 254.334 2.398 10 10 CECE C[C@@H](NC(=O)[C@@H]1[C@H](C)CCN[C@@H]1C)c1ccccc1O 2357867289 IVJJOTWNHIBNGP-RTWAVKEYSA-N 276.380 2.204 10 10 CECE CCN[C@H]1CCN(c2ccc(OCC)c(F)c2)C1 126518010 GGSUUOXNTZFAIB-NSHDSACASA-N 252.333 2.413 10 10 CECE C[C@@H]1[C@@H](N)CC[C@@H](C(=O)NCc2ccccc2O)C1(C)C 219864343 XNWQNFBYRAJIHK-XBFCOCLRSA-N 290.407 2.408 10 10 CECE CNC[C@@H]1CN([C@H]2C[C@H](C)c3c(C)ccc(O)c32)CCO1 125168599 GTQWBYSQOZYMJV-MJBXVCDLSA-N 290.407 2.169 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@@H](C)N(C)C[C@H]2C)c1 89726411 LOVDDFABLJQNQP-LALPHHSUSA-N 278.396 2.219 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@H]1N(C)C 131470112 MXCLDDVNWYAWDK-MFKMUULPSA-N 268.788 2.428 10 10 CECE CN(C)c1ccc(CN2[C@H]3CC[C@@H]2CC(N)C3)cc1 40749244 FSNIFKCQDOASOR-VHRNVKJDSA-N 259.397 2.207 10 10 CECE COc1ccc(CN2CC[C@H](N3CCCCC3)C2)c(O)c1 134128343 LJHADAMVCAEHBV-HNNXBMFYSA-N 290.407 2.461 10 10 CECE Cc1coc(=NCc2cc(Br)ccc2O)[nH]1 381574775 ZGXTYVXDAPSPGX-UHFFFAOYSA-N 283.125 2.485 10 10 CECE Nc1ccc(CC(=O)Nc2ccc3[nH]cnc3c2)cc1 82284191 OYUKLUOUDHMMDZ-UHFFFAOYSA-N 266.304 2.326 10 10 CECE CC(C)(C)OC(=O)NC[C@H](N)c1ccc(F)cc1O 98210496 WTLSYDYDIJTESK-JTQLQIEISA-N 270.304 2.056 10 10 CECE CC1(C)CCC[C@@](NCCCN=[N+]=[N-])(C(N)=O)CC1 90260590 CLDCFDZHEUDXOA-ZDUSSCGKSA-N 267.377 2.491 10 10 CECE Cc1cc(O)c([C@@H]2CCN2)cc1I 238489059 ZLHQVLSKHPPHIK-VIFPVBQESA-N 289.116 2.340 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(N)=O)c1c(F)cccc1Cl 90260569 SCYFQJVXNPLQHO-JTQLQIEISA-N 285.710 2.296 10 10 CECE Cc1cc(/C=C\C(=O)NCCO)c(C)n1-c1ccccc1 230005570 SJAJTOXVPQULEQ-HJWRWDBZSA-N 284.359 2.216 10 10 CECE C[C@@H]1C[C@H](NC[C@H](O)[C@@H]2CCCO2)c2c(O)ccc(F)c21 527955034 LRMWPKTXJOIWAA-OJDJGZDQSA-N 295.354 2.209 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1CCN(C)C[C@H]1C 253290230 POXZQXVWVUKMCC-BXUZGUMPSA-N 291.395 2.198 10 10 CECE CN1CC[C@H]2CCN(Cc3cccc(F)c3O)C[C@@H]21 378488715 BIFCYWKXWBFESD-FZMZJTMJSA-N 264.344 2.057 10 10 CECE C[C@H]1C[C@@H]1N(CCO)c1ccc(CN)cc1C(F)(F)F 2167109678 PJNMJRTXVKURSP-ZANVPECISA-N 288.313 2.371 10 10 CECE CC[C@H](O)c1ccc(N2CCOC[C@]2(CC)CO)cc1 2169033849 UPJRKEVEQASNPA-HOTGVXAUSA-N 279.380 2.108 10 10 CECE CNCc1ccc(N2CC[C@H]3CC[C@@H](O)[C@H]2C3)c(C)c1 722198476 HZMXTFCKGIXZPK-KBRIMQKVSA-N 274.408 2.454 10 10 CECE CCOc1ccc(O)c(CN2C[C@H](C(=O)O)CC[C@H]2C)c1 817880798 GWDRGXOCPBHRGU-VXGBXAGGSA-N 293.363 2.476 10 10 CECE Cc1cc(O)c(CN2CC[C@@H]3CN(C)C[C@H]32)cc1C 814172924 DDXHQBJMVBGIRQ-UKRRQHHQSA-N 260.381 2.145 10 10 CECE Oc1cccc(CN[C@@H]2CC[C@H]3COCC[C@@H]3C2)c1O 723648582 VWNPVBAAWZZDDV-KWCYVHTRSA-N 277.364 2.393 10 10 CECE Cc1cn(C)nc1C[C@H](N)c1ccc(N(C)C)cc1 723945425 LBHJVEWHMVPRFI-AWEZNQCLSA-N 258.369 2.037 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@@H]1C[C@H](O)C12CCC2 827366622 XWONNYHTNPAVLA-CVEARBPZSA-N 274.408 2.454 10 10 CECE COCC(COC)NCc1cc(Cl)cc(C)c1O 824922265 ZGLIUSASRFDHCP-UHFFFAOYSA-N 273.760 2.105 10 10 CECE CN(Cc1cc[nH]n1)Cc1cc2c(cc1O)CCC2 732665499 FKGRYKCMPWTDLH-UHFFFAOYSA-N 257.337 2.236 10 10 CECE COC(=O)c1cnc(SC[C@H]2C[C@@]23CCOC3)s1 917778346 PYZAYUNOQGMPNR-PRHODGIISA-N 285.390 2.448 10 10 CECE CCOc1cccc(CNCCC2(CN)CC2)c1O 844900688 CQVKFJLZUSLASV-UHFFFAOYSA-N 264.369 2.010 10 10 CECE CCN(CC)C[C@H](C)NC(=O)NCc1c(O)cccc1F 914412262 SRUKTCXVASXRQP-NSHDSACASA-N 297.374 2.061 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@@H]3CCC[C@H](C2)N3)c1O 842474011 AIAVLNAFPRTBGQ-OKILXGFUSA-N 292.354 2.060 10 10 CECE Oc1c(F)cc(Cl)cc1CNCC[C@H]1CCNC1 841034457 BLBIYADAKLRTDH-SECBINFHSA-N 272.751 2.274 10 10 CECE COC(=O)CC1(NCc2ccc(N(C)C)cc2C)CC1 846027537 QSQNSRQFBMHREX-UHFFFAOYSA-N 276.380 2.246 10 10 CECE CC12CC(CN1C(=O)/C=C\c1ccc(O)c(O)c1)C2 856511321 VJGTXZWOVWKLCM-HYXAFXHYSA-N 259.305 2.122 10 10 CECE COC(=O)C1=CC[C@H](NCc2c(O)cccc2Cl)C1 862465120 DMZWIKIOCISTFM-JTQLQIEISA-N 281.739 2.397 10 10 CECE CCn1nc(C)c(C(=O)N2Cc3cccc(O)c3C2)c1C 871200489 CQEAOZPHWJVHCZ-UHFFFAOYSA-N 285.347 2.381 10 10 CECE CC[C@H](C)[C@@H](NC)C(=O)N[C@H](C)c1ccccc1O 1877590401 SWWQTKNUJWRACK-MISXGVKJSA-N 264.369 2.204 10 10 CECE C[C@@H](NS(=O)(=O)[C@H]1CC12CCC2)c1ccccc1O 1877590057 PTHPDYOGLKHAJV-MFKMUULPSA-N 281.377 2.315 10 10 CECE C[C@H](O)c1cc(F)c(N2CCC[C@@]2(C)CO)c(F)c1 1880479379 NBFFOVMUSYWFHR-XPTSAGLGSA-N 271.307 2.369 10 10 CECE C[C@H](O)c1cc(F)c(N(C)[C@@H]2COC[C@H]2C)c(F)c1 1880479195 LOBZRCNCOWQHTQ-VYUIOLGVSA-N 271.307 2.489 10 10 CECE CC[C@H](NCCC1CS(=O)(=O)C1)c1ccc(C)cc1O 794813266 IEJGZMWQCUNDBO-AWEZNQCLSA-N 297.420 2.176 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCCN(C)CC2)c(F)c1 1880924704 ATUNFZREAYVDCM-SNVBAGLBSA-N 269.339 2.126 10 10 CECE COC[C@H](CNCc1cc(OC)ccc1O)C(C)C 1334331107 CZISROKACHIQBH-ZDUSSCGKSA-N 267.369 2.409 10 10 CECE CC[C@H](C(=O)OC(C)C)N1CCOc2cc(CN)ccc21 74338339 CUFFGQIHOHUZSJ-CYBMUJFWSA-N 292.379 2.074 10 10 CECE CO[C@@H]([C@H](C)NCc1cccc(O)c1O)C(F)(F)F 1889387013 JTOGZUOHYCQFGX-CPCISQLKSA-N 279.258 2.153 10 10 CECE COC[C@H]1C[C@H]1Nc1c(N)cccc1Br 1962225497 PGOGERWZJFDSLV-GMSGAONNSA-N 271.158 2.478 10 10 CECE Nc1ccc(-n2c(=O)[nH]c3ccc(F)c(F)c32)cc1 75946726 ZTSBUOYDNFWKQU-UHFFFAOYSA-N 261.231 2.179 10 10 CECE CC(C)(C)[C@@]1(C)NC(=O)N(Cc2ccc(N)cc2)C1=O 57848780 OAVFYYBIWMJGAG-HNNXBMFYSA-N 275.352 2.125 10 10 CECE C[C@@H]1O[C@H](C)[C@H](CNC(=O)Nc2ccc(N)cc2)[C@H]1C 701052602 BGKWLKGWTOLGJN-KZWBYHQPSA-N 277.368 2.450 10 10 CECE C[C@H]1C[C@]1(C)CN(C)CC(=O)c1ccc(O)c(O)c1 704080913 IGIXVZPPDIIONB-ZUZCIYMTSA-N 263.337 2.258 10 10 CECE CN(Cc1c(O)cccc1Br)[C@@H](CN)C1CC1 706867066 NDYYEOHJKXWYKR-LBPRGKRZSA-N 299.212 2.324 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC34CCCC4)ccc21 707680179 JEBQOPBRJXXQLE-AWEZNQCLSA-N 271.364 2.422 10 10 CECE C[C@H](O)c1ccc(N2CCNC(=O)CC2(C)C)cc1Cl 708089900 SIVHAOANNGYECH-JTQLQIEISA-N 296.798 2.498 10 10 CECE C[C@@H]1CCC[C@H](CNCc2cc3c(cc2O)OCO3)O1 688879046 NXAXPCRZPZTADO-ZYHUDNBSSA-N 279.336 2.168 10 10 CECE C[C@H]1CC[C@@H](NCc2ccc(O)c(O)c2)CS1 689614559 ZDXFTESEWFRFMN-GXSJLCMTSA-N 253.367 2.472 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1NC(=O)CCc1ccc(N)cc1 717144964 SVISHSQMGADRGQ-KJEVXHAQSA-N 258.365 2.362 10 10 CECE COc1ccc(N(C)C[C@@H]2CNCCC2(F)F)cc1 717379727 YQQYUCYQWCPYGN-NSHDSACASA-N 270.323 2.376 10 10 CECE Nc1ccc(CCC(=O)NCCOC2CCCC2)cc1 69052066 UWJZLRGEGUWWOB-UHFFFAOYSA-N 276.380 2.277 10 10 CECE CC[C@@]1(C)CN(c2ccc3c(c2)OCO3)[C@H](C)CN1 86216710 ZICOHVPULXLOFY-ABAIWWIYSA-N 262.353 2.382 10 10 CECE CCN(CCCO[C@H]1CCOC1)c1ccc(CN)cc1 699577395 GIYIPMAQPHFJED-INIZCTEOSA-N 278.396 2.167 10 10 CECE CCOC(=O)[C@@H](Cc1ccccc1)NCCCN=[N+]=[N-] 90260075 QQFSALBGFUKUQN-CYBMUJFWSA-N 276.340 2.451 10 10 CECE CC(C)CN1C(N)=NC[C@@]1(C)c1ccc(N(C)C)cc1 93376052 BTUJKKUSWWJISE-INIZCTEOSA-N 274.412 2.254 10 10 CECE COc1ccc(CNCCN(C)C(=O)[C@@H]2C[C@@H]2C)cc1C 1267342908 HCEOACNRFPWYOW-SWLSCSKDSA-N 290.407 2.208 10 10 CECE Cc1ccc(/C=C/C(=O)N(C)c2ccc(C)nn2)cn1 1265385605 JKRMIPZHOBTMJE-VQHVLOKHSA-N 268.320 2.165 10 10 CECE CN(C)c1ccc([C@]2(O)C[C@H](CN)C23CCC3)cc1 2116605985 MXIWEJSASPZHIZ-CZUORRHYSA-N 260.381 2.089 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1CCC2(CCC2)CC1 1449148197 KYKYCOBDGITVBT-UHFFFAOYSA-N 275.348 2.433 10 10 CECE CCOc1cc(CNCC(C)C)ccc1N(C)CC(=O)O 211979588 UTZOGSOWBNQFEU-UHFFFAOYSA-N 294.395 2.352 10 10 CECE COc1cc(CNCCC(=O)O)ccc1N1CCCCC1 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COC1(CN(C)Cc2c(C)cccc2O)CCOCC1 2166144186 JITGYGOAHLWLCJ-UHFFFAOYSA-N 279.380 2.328 10 10 CECE Nc1ccc(OCCNc2cccc3ccnn23)cc1 2162475179 LOJRLWWZIMVDTC-UHFFFAOYSA-N 268.320 2.407 10 10 CECE CCC(=O)c1cc(Cl)ccc1OCC(=O)C(C)=O 808015782 XPXNEEDGMGNLJJ-UHFFFAOYSA-N 268.696 2.470 10 10 CECE c1cc2c(cc1N1CCC[C@@H]3CNCC[C@H]31)OCCO2 2162655521 LCATZVQENCPBJR-TZMCWYRMSA-N 274.364 2.036 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCN(C)C2=O)cc1Cl 723191175 FIAVELCLHPQCRI-NOZJJQNGSA-N 281.787 2.027 10 10 CECE CC[C@@H]1CNCC[C@]1(O)c1ccc2c(c1)CCCN2C 2163092928 XHMUECNHJPGMBW-RHSMWYFYSA-N 274.408 2.276 10 10 CECE CN1CCCc2cc(N3CC[C@@H]4CNC[C@H]4C3)ccc21 2163102860 OGWWDHNDPJZSGK-CABCVRRESA-N 271.408 2.115 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)CC1(F)CCCC1 2165889592 BAVCNGAGLVVLMC-UHFFFAOYSA-N 279.359 2.421 10 10 CECE C[C@H](N[C@H]1CNCC[C@H]1C)c1cc(F)cc(F)c1O 817968865 NWGKYYKKBWPDOQ-ZDMBXUJBSA-N 270.323 2.319 10 10 CECE CN(C)c1ccc([C@H](N)CN[C@H]2CCCc3n[nH]cc32)cc1 817941812 LBBIIRQQCUUQCN-CVEARBPZSA-N 299.422 2.143 10 10 CECE CN1CCC([C@@H]2C[C@H]2NCc2ccc3c(c2)CCO3)CC1 585505277 GRQXVBRSAFTAFK-DLBZAZTESA-N 286.419 2.441 10 10 CECE CCC(C)(C)C(=O)C(=O)NCc1cc(OC)ccc1O 901131869 PQXHGKHKUHQERD-UHFFFAOYSA-N 279.336 2.022 10 10 CECE Cc1nocc1/C=C1\SC(=S)N(C2CC2)C1=O 841496811 SEVVVCHGFQZLDL-WTKPLQERSA-N 266.347 2.347 10 10 CECE CCN(CC)c1ccc(CN[C@@H](C)[C@H](C)N)cc1F 841077039 XBRVJCXYOSSZTQ-RYUDHWBXSA-N 267.392 2.497 10 10 CECE CCOc1ccc(CN2[C@@H](C)CC[C@H]2C(=O)O)c(O)c1 844934132 KTNZYJYIYLAEOB-GWCFXTLKSA-N 279.336 2.228 10 10 CECE CC(C)(C)N1CC[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 850343856 RNZHZDVXBPCMDN-ZDUSSCGKSA-N 293.367 2.263 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H](C)[C@@H]3CCCO3)C2)cc1 850489441 UPRHFWSOJWXQLY-ZQIUZPCESA-N 290.407 2.431 10 10 CECE COc1ccc(N2CC[C@@H](NCc3ccc(C)nn3)C2)cc1 850346730 IQKPZSOEGAHZEG-OAHLLOKOSA-N 298.390 2.162 10 10 CECE CCOC(=O)C1=CC[C@H](NCc2cccc(C)c2O)C1 862488624 NDKAPQSYKFRHQW-AWEZNQCLSA-N 275.348 2.442 10 10 CECE COc1cc(C)nc(N2Cc3cccc(O)c3C2)n1 866120073 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CC(C)(C)OC(=O)Nc1ccc([C@H](N)CCO)c(O)c1 1536219452 KSIIWVPCHLCUSK-LLVKDONJSA-N 282.340 2.121 10 10 CECE COc1cc(/N=N/N2CCOCC2)cc(OC)c1OC 208935893 IVZUBGWQAZOFCM-CCEZHUSRSA-N 281.312 2.043 10 10 CECE O=C(O)[C@@H](NCc1ccccn1)c1cc(Cl)ccc1O 211830788 VECWOSQKCHWEOO-ZDUSSCGKSA-N 292.722 2.356 10 10 CECE CC[C@@H](C)CC[C@H](O)CC(=O)NCc1c(O)cccc1O 1558533454 FYWVUCNUKXBSGO-NEPJUHHUSA-N 295.379 2.291 10 10 CECE COC(=O)[C@H]1CC[C@@](F)(CN(C)CCN=[N+]=[N-])CC1 2122072609 ALGCMBCBMXTSGV-UMSPYCQHSA-N 272.324 2.300 10 10 CECE COc1ccc(N2[C@H](C)CNCC2(C)C)c(OC)c1 217110773 QTOQLKNBEGVNLH-LLVKDONJSA-N 264.369 2.281 10 10 CECE COc1ccc(CNCCN(C)C(=O)C(C)C)cc1C 1481206747 AMRWSNJTJQBBPO-UHFFFAOYSA-N 278.396 2.208 10 10 CECE C[C@H](O)[C@H]1CCN(c2ccc(CN)cc2Cl)C1 161571074 DZTPKNDJRPWMMN-ONGXEEELSA-N 254.761 2.006 10 10 CECE CO[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1O 1631540112 JNQSBALXZQQBHP-INIZCTEOSA-N 285.343 2.266 10 10 CECE O=C(NCc1cc(O)ccc1O)c1c(F)ccc(F)c1F 1633598975 JPBZODZPQZNXEJ-UHFFFAOYSA-N 297.232 2.445 10 10 CECE O=C(C[C@H]1CCC2(CCC2)O1)NCc1c(O)cccc1O 1635850543 OLSONJHIXRYCDS-LLVKDONJSA-N 291.347 2.206 10 10 CECE CCO[C@@H]1CCN(c2ccc(C=CC(=O)O)cc2)C1 1911859288 KZGVDLVUAPOZKL-CQSZACIVSA-N 261.321 2.400 10 10 CECE C[C@H](CCC(F)F)NC(=O)c1cccc(O)c1O 1965296441 IBDSDJIMBJGFMI-SSDOTTSWSA-N 259.252 2.261 10 10 CECE CC[C@@H](NC(=O)CCc1ccc(N)cc1)c1ncc[nH]1 138362502 CAYTXYCAJJBXAS-CYBMUJFWSA-N 272.352 2.192 10 10 CECE CN(C[C@H]1CCOC1)c1ccc2c(c1)CCC[C@@H]2N 2128275093 SMWVWFBHXPVUME-WBMJQRKESA-N 260.381 2.495 10 10 CECE CN[C@H]1CCCc2cc(N(C)[C@H]3C[C@H](O)C3)ccc21 2128275283 UCOGBKWEIDFIQD-DZKIICNBSA-N 260.381 2.243 10 10 CECE N[C@H]1CCc2cc(N3CCC[C@H](CCO)C3)ccc21 2128324149 AKHMXQPYKOIOCD-WBMJQRKESA-N 260.381 2.231 10 10 CECE CCN1CC[C@H](N(C)c2ccc3c(c2)CC[C@H]3N)C1 2128315506 SPGVRCIXCZEHEI-GOEBONIOSA-N 259.397 2.163 10 10 CECE CCOC12CC(C1)N(c1ccc3c(c1)CC[C@@H]3O)C2 2129032669 YOVDIIGPSCSYCK-SIWZUTFBSA-N 259.349 2.424 10 10 CECE C[C@@H](CCNCc1ccc(Cl)cc1O)N(C)C 1659753853 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2.446 10 10 CECE Cc1ccc(S(=O)(=O)N2CCC[C@H]2CN=[N+]=[N-])cc1 95807872 CPNQBAVFTMTHMA-NSHDSACASA-N 280.353 2.458 10 10 CECE CCn1ccnc1C[C@@H](N)c1ccc(N(C)C)cc1 97304873 QYAYDFCYOCGZRA-CQSZACIVSA-N 258.369 2.212 10 10 CECE Cc1nnc([C@@H]2CCCN2Cc2ccc(N)cc2)o1 2115185183 IIUIWZMJYXXYBH-ZDUSSCGKSA-N 258.325 2.297 10 10 CECE CC(=O)N1CCN(/N=N/c2ccc(F)cc2F)CC1 1860488472 SZDQETMXWHOMJI-FOCLMDBBSA-N 268.267 2.128 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H]2CCC[C@H]2C(N)=O)c1 2117465363 GNEMHGLWKIJTHN-LOWVWBTDSA-N 262.353 2.005 10 10 CECE CCn1cc(C(=O)NCC2(CN=[N+]=[N-])CC2)c(C)n1 2117730499 DFFGPONZYLEHAV-UHFFFAOYSA-N 262.317 2.032 10 10 CECE CNC[C@@H]1Sc2cc(OC)ccc2N(C)[C@H]1C 215032341 GYKPFYKQHYPFFN-ZANVPECISA-N 252.383 2.214 10 10 CECE C[C@@H]1CN(c2cc(Cl)c(CN)cc2F)C[C@@H](C)C1O 2120881004 HBIKPAOOEPEKBO-RKDXNWHRSA-N 286.778 2.391 10 10 CECE CC(C)(C)[C@]1(O)CCN(c2ccc(CO)cc2F)C1 2120982465 VQWDMTKKSXBDLD-HNNXBMFYSA-N 267.344 2.305 10 10 CECE CC1=NNC(=O)[C@@H]1N=Nc1ccc(Cl)cc1[N+](=O)[O-] 255975367 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CCN1CCCN(c2ccc(CN)c(F)c2)[C@@H](C)C1 320198856 RAXVVFHIPOBQMK-LBPRGKRZSA-N 265.376 2.205 10 10 CECE CCNCc1ccc(N2CC[C@H]2c2ncon2)c(C)c1 2160459280 MVCKARRXDSNWGT-AWEZNQCLSA-N 272.352 2.439 10 10 CECE COc1ccc(CN2CC[C@@H](CCN(C)C)C2)c(O)c1 701493725 RVGRJRIWRHVPST-CYBMUJFWSA-N 278.396 2.174 10 10 CECE CC[C@H](NC)c1ccc(N2CC(O)(C(F)(F)F)C2)cc1 2170380160 TVDQDIZWECEVGW-LBPRGKRZSA-N 288.313 2.471 10 10 CECE NC(=O)[C@H](Nc1ccccc1F)c1c(O)cccc1F 2160772366 LLZGFOYNXRVYNH-CYBMUJFWSA-N 278.258 2.309 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2CC(C(=O)O)C[C@@H]2C1 2160787475 IRMXDNPXSIHZSB-CHWSQXEVSA-N 275.348 2.243 10 10 CECE CN1CC[C@H]2[C@@H](CCN2Cc2cc(F)cc(F)c2O)C1 2170943348 RBBZKLCYABGARK-HZMBPMFUSA-N 282.334 2.196 10 10 CECE Nc1ccc(CCCN2CCOc3ncccc32)cc1 2171215939 NSSMCLQJHVDAGX-UHFFFAOYSA-N 269.348 2.495 10 10 CECE CNCc1cc(F)c(N2CC(C(F)F)C2)c(F)c1 706477702 VADSVJPJRCPGGK-UHFFFAOYSA-N 262.250 2.386 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CCC[C@@H]43)c(Cl)cc21 706801527 IJAQHFNAISPSIH-XDYOCTJHSA-N 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COc1ccc(CN2CCOCC23CCC3)c(O)c1 93510721 KXXFTIKQZKEFOQ-UHFFFAOYSA-N 263.337 2.156 10 10 CECE CC[C@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(C)cc1O 279949800 BQHMZDCXHXRNLQ-OCCSQVGLSA-N 276.380 2.362 10 10 CECE CO[C@@H](C)[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 276147965 OOVSSCOOKGNRKB-AEJSXWLSSA-N 268.313 2.374 10 10 CECE Nc1ccc(NC(=O)[C@@H]2Cc3ccccc3CO2)cc1 700661075 JWCKCQZHDCBQDS-HNNXBMFYSA-N 268.316 2.349 10 10 CECE CSC[C@](C)(O)CNCc1cc(Cl)c(F)cc1O 293575632 JJASPRKTEKEJKX-GFCCVEGCSA-N 293.791 2.388 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N3CCC4(CC3)CC4)cc21 707103561 ZARYFPFFHSJQOU-CQSZACIVSA-N 271.364 2.043 10 10 CECE Oc1ccccc1CN(CC1CCNCC1)C1CC1 94021477 CCNWDIQBYFFYED-UHFFFAOYSA-N 260.381 2.356 10 10 CECE C[C@H](O)c1ccc(N2CC3(CC(N(C)C)C3)C2)c(F)c1 2164448496 SCXQXVLPEDDYQO-NSHDSACASA-N 278.371 2.409 10 10 CECE COc1cccc(CN2C[C@@H](C(=O)O)CC2(C)C)c1O 2162156789 UZAXLMUCOHPFKU-NSHDSACASA-N 279.336 2.086 10 10 CECE C[C@H]1C[C@@H]1C(=O)NCc1cc(Br)ccc1O 804736348 SKYHNICBPQYULK-XVKPBYJWSA-N 284.153 2.427 10 10 CECE c1cc2c(cc1N1CC[C@]3(CNCCO3)C1)CCCC2 2162669682 DWSQDIFPCUXJMC-KRWDZBQOSA-N 272.392 2.134 10 10 CECE c1cc2c(cc1N1CC[C@H]([C@H]3CCCN3)C1)OCCO2 2162669402 DFBOIQVPDPWCEL-GXTWGEPZSA-N 274.364 2.036 10 10 CECE CN1CCc2cc([C@@](C)(N)[C@H]3C[C@H]4CC[C@H]3O4)ccc21 2163066895 QJYAIZDGIADWMI-YALNPMBYSA-N 272.392 2.420 10 10 CECE CN1CCc2cc([C@@H](O)C[C@H]3CC4(CC4)CN3)ccc21 2163066354 LGTUDQGQBRHIAR-HOCLYGCPSA-N 272.392 2.245 10 10 CECE CN1CCc2cc([C@@H](O)C3CC4(CCCN4)C3)ccc21 2163069668 DETNMDPRKFXGBG-ARWYELJZSA-N 272.392 2.245 10 10 CECE CCN1CCc2cc([C@H](O)c3ccnn3CC)ccc21 2163076400 NJONJTCMRSCMPH-INIZCTEOSA-N 271.364 2.367 10 10 CECE CCN1CCc2cc([C@@H](O)c3ccnn3CC)ccc21 2163076401 NJONJTCMRSCMPH-MRXNPFEDSA-N 271.364 2.367 10 10 CECE CN1CCCc2cc([C@]3(O)C[C@@H]4OCCC[C@H]43)ccc21 2163107547 OWLAULOXKJIQJH-HYVNUMGLSA-N 273.376 2.456 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H]3OCC[C@@H]3C2)c(F)c1 724693539 QBDMHOZYYHEQFD-JVLSTEMRSA-N 265.328 2.494 10 10 CECE Oc1ccc2c(c1CNc1cncc3ncnn13)CCCC2 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CO[C@@H]1CCC[C@@H](C(=O)NCc2c(O)cccc2F)C1 928706854 XINUQBULDWOROH-GHMZBOCLSA-N 281.327 2.353 10 10 CECE O=C1/C(=C/c2cn[nH]c2)SC(=S)N1c1cccnc1 751526354 LZDJWYPBBGXYQO-WMZJFQQLSA-N 288.357 2.211 10 10 CECE Cc1ccncc1COC(=O)c1cccc(O)c1O 758545738 BDSPIWKEYJZBNB-UHFFFAOYSA-N 259.261 2.158 10 10 CECE C[C@@H]1CCC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)O1 855798688 RYAXVKFSYNEDKM-CFLAWFISSA-N 291.347 2.185 10 10 CECE Cc1cc(CN2C[C@@H](C)[C@H](CCN)C2)ccc1N(C)C 923429256 RXWLMEPLGCRILC-GDBMZVCRSA-N 275.440 2.478 10 10 CECE COc1cc(CC(=O)NCc2ccc(N(C)C)cc2)ccn1 854270906 UMHQZQBYUCKZPT-UHFFFAOYSA-N 299.374 2.015 10 10 CECE CC[S@@](=O)CCN[C@H](C)c1cc(Cl)ccc1O 756578040 VQAUDESUXOXYQY-VVVCHXIZSA-N 275.801 2.465 10 10 CECE C[C@@]1(C(F)F)CN(Cc2cccc(F)c2O)CCO1 698940216 FCPQTBCFTOORSI-ZDUSSCGKSA-N 275.270 2.387 10 10 CECE CCOc1ccc(CN[C@H]2CCOC[C@H]2C)c(O)c1 762504700 VTPZCADTXBKAAW-RISCZKNCSA-N 265.353 2.306 10 10 CECE CC[C@@H](C)[C@H](O)CNCc1ccc(F)c(F)c1O 877025167 YLUXLWSDZMVNER-LDYMZIIASA-N 259.296 2.167 10 10 CECE COC/C(C)=C/C(=O)NCc1ccc2cccnc2c1O 862024850 IRWNSLSBZZDAPE-DHZHZOJOSA-N 286.331 2.149 10 10 CECE CC[C@H](NCCOCCCN)c1ccc(C)cc1O 863546614 LRTTVDXMUAXPMW-AWEZNQCLSA-N 266.385 2.107 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1[C@@H]2CCCO[C@H]21 779952459 YJRKWULZVOKRHM-ARFHVFGLSA-N 288.391 2.102 10 10 CECE c1csc(SCc2cn(C[C@@H]3CCOC3)nn2)n1 871649989 OVPWRRKZBLCOSS-VIFPVBQESA-N 282.394 2.063 10 10 CECE Cc1cccc(O)c1CNCCCCN1CCOC1=O 1876022578 FGLWVBWKGLRWRC-UHFFFAOYSA-N 278.352 2.023 10 10 CECE Nc1ccc(CNC(=O)c2ccc(N)c(Cl)c2)cc1 1876516109 USBPKFXLVICOEL-UHFFFAOYSA-N 275.739 2.434 10 10 CECE Cc1cncc(/C=C\C(=O)NCc2ccccc2O)c1 772717331 QJGBCTSJEIEFQO-SREVYHEPSA-N 268.316 2.425 10 10 CECE Cc1ccc([C@H](CN)N(C)Cc2ccccc2O)o1 1877518707 XHMQOXZSXROFTP-ZDUSSCGKSA-N 260.337 2.425 10 10 CECE CN(CCN(C)CC(F)(F)F)Cc1ccccc1O 1877544169 CDDHLLGHSDTPAJ-UHFFFAOYSA-N 276.302 2.318 10 10 CECE C[C@H](c1ccccc1O)N(C)c1ccc(N)c(N)n1 1877538134 LFJGPESKXNCBBH-SECBINFHSA-N 258.325 2.149 10 10 CECE 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2194716110 XCODGIHIJGQFBF-ZETCQYMHSA-N 298.255 2.346 10 10 CECE CN(C(=O)/C=C\c1cnn(C)c1)c1cccc(Cl)n1 1275212683 JXIWOAUGEGACKA-SREVYHEPSA-N 276.727 2.145 10 10 CECE C[C@]1(F)CC[C@@H](Nc2c(N)cccc2C(N)=O)CC1 2117567863 DRHQIIVZVOETFF-DEZZCRIOSA-N 265.332 2.450 10 10 CECE CC[C@@H](O)c1ccc(N(C)CC2[C@@H]3COC[C@@H]23)cc1 2118050183 AHKFJZRVNRGMCV-HRCADAONSA-N 261.365 2.459 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N[C@@H]1[C@H]2COC[C@H]21 2118013311 ARRZFTQZZDXJQO-GBNBPPIOSA-N 259.349 2.483 10 10 CECE O=C(/C=C\c1cncc(F)c1)N1CCc2nc(F)ccc21 1532093018 WXKKRKCOXNUVMJ-RJRFIUFISA-N 287.269 2.357 10 10 CECE N[C@H](c1c(O)cccc1Br)C(F)F 1536124226 AILIFGSXHPCAMD-SSDOTTSWSA-N 252.058 2.420 10 10 CECE COc1cccc(CN(C)C[C@H]2CCO[C@@H]2C)c1O 2121125333 FBZNYGNRXGJHGN-VXGBXAGGSA-N 265.353 2.258 10 10 CECE CCc1cccc(CNCc2ccc(O)cc2O)n1 2121952665 VMZUZMLNHRXVGO-UHFFFAOYSA-N 258.321 2.345 10 10 CECE CN(c1ccc(CO)c(C(F)(F)F)c1)[C@H]1C[C@H](O)C1 2122887635 JZIUEPGQEYWCRX-XYPYZODXSA-N 275.270 2.157 10 10 CECE 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2140969896 BVEIDCXZFDPKOC-NWDGAFQWSA-N 265.353 2.258 10 10 CECE COc1ccc(CN2C[C@H](C)C[C@@H](OC)C2)c(O)c1 2140987094 GJBZFBBYCGEKJA-BXUZGUMPSA-N 265.353 2.258 10 10 CECE CN(c1ccc(CN)cc1)C1CCC2(CC1)OCCO2 1942004318 HDMKGTNGXBUFGX-UHFFFAOYSA-N 276.380 2.267 10 10 CECE C[C@@H]1SCCC[C@]1(O)[C@H](N)c1ccccc1O 1943692041 WJEXVAYIEVNTEQ-ZWKOPEQDSA-N 253.367 2.039 10 10 CECE Nc1ccc(CCCN2CCC[C@@H]2C2OCCO2)cc1 1944621465 FGVSRAVTGJMMHQ-OAHLLOKOSA-N 276.380 2.039 10 10 CECE O=[N+]([O-])c1ccc(N2C[C@H]3CCC[C@H]3C2)cc1CO 236520489 QLQAZGMZKZPXIG-PHIMTYICSA-N 262.309 2.323 10 10 CECE CCn1cc(CNC(=O)Nc2ccc(N)cc2)c(C)n1 2143437785 HYPFVTUJFLBVAR-UHFFFAOYSA-N 273.340 2.115 10 10 CECE Cc1nn(C)cc1CN(Cc1ccc(N)cc1)C1CC1 2143441890 FLMPABRFKPYZJT-UHFFFAOYSA-N 270.380 2.475 10 10 CECE C[C@@H](NC(=O)c1cccs1)C(=O)Nc1ccc(N)cc1 237580984 QUSWFDWTQWWTQP-SECBINFHSA-N 289.360 2.087 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H]2COCCO2)c(Cl)c1 2143689540 XUZNUHRXTBHVFS-AAEUAGOBSA-N 298.814 2.472 10 10 CECE 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286.169 2.014 10 10 CECE Nc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1 36283933 QBJAJHWTAQSIRG-UHFFFAOYSA-N 290.344 2.005 10 10 CECE Cc1ccc(Cn2ccc3c(CCN)cccc32)nn1 2145804649 NTRMIFANOYKVJU-UHFFFAOYSA-N 266.348 2.289 10 10 CECE CN(Cc1ccc(N)cc1)S(=O)(=O)C1[C@H]2CCCC[C@H]12 2150971363 KTWMYYVNPQAGLX-KBPBESRZSA-N 294.420 2.219 10 10 CECE C[C@H](N)c1ccc(N2C[C@]34CC[C@@]3(COC4)C2)c(F)c1 2146559141 CKHWIBOTVBASOY-UVBJJODRSA-N 276.355 2.462 10 10 CECE CCNC(=O)CN(CC)c1ccc2c(c1)CC[C@@H](C)N2 168359645 QXMUDMMKQVYIGR-GFCCVEGCSA-N 275.396 2.396 10 10 CECE OC[C@@H]1[C@H]2CN(c3ccc(CNC4CC4)cc3Cl)C[C@H]21 2146870366 FDBOPPPWMXZVMS-WDNDVIMCSA-N 292.810 2.267 10 10 CECE C[C@H](NC[C@@H](C)c1ccn(C)n1)c1cc(O)ccc1O 2147080404 OVYCCIKWKKDWPU-MNOVXSKESA-N 275.352 2.286 10 10 CECE CCCNCc1ccc(N2CC[C@H](O)[C@H](C)C2)cc1 166507325 VRQHYUUCZBJZCM-CJNGLKHVSA-N 262.397 2.393 10 10 CECE CC[C@@H](C)CC(=O)N1CCN(c2ccc(N)cc2)CC1 167064261 SMVFYIYKVQJSFP-CYBMUJFWSA-N 275.396 2.354 10 10 CECE CN[C@@H](c1ccoc1)[C@@H](O)c1ccc2c(c1)CCN2C 2147426539 VOYYMTRGWBRGEA-HOTGVXAUSA-N 272.348 2.266 10 10 CECE Cc1ccc(O)c(CN[C@H](C(=O)O)C2CC(F)(F)C2)c1 2152642010 AHOWHHWHJBCENE-LBPRGKRZSA-N 285.290 2.289 10 10 CECE C[C@H](O)c1ccc(N2CC=C[C@H]2CO)cc1Br 2007532134 SQUMXUMUNMBGSE-ONGXEEELSA-N 298.180 2.240 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1nccnc1Cl 2009441859 QUXYJMFIWRSCGJ-QMMMGPOBSA-N 252.709 2.405 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@H](N)C[C@]12CCOC2 2154542731 VWBAYADNGKLEFR-XPKDYRNWSA-N 276.380 2.035 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)c2nnc(Cl)s2)CC1 2011522498 ORQHDEPBMKYBMG-UHFFFAOYSA-N 272.721 2.106 10 10 CECE C[C@H](N[C@H]1C[C@@H]2CC[C@H](C1)N2C)c1cc(O)ccc1O 2154912832 FNVVNXHRVIKCQN-ZDEQEGDKSA-N 276.380 2.374 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C12COC(C)(C1)C2 2156697496 FEVPTHOJJOFTTA-VHWKEVPUSA-N 275.348 2.481 10 10 CECE CNCc1ccc(N2CC[C@]3(CCO3)C2)c(Cl)c1 2035805406 YYGJAGFUMRTECU-AWEZNQCLSA-N 266.772 2.429 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H]2[C@@H](CO)C3)c(C)c1 2157232899 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CC[C@@H](c1ccccc1O)N1CCC(O)(CCN)CC1 717955174 FIOAAPXGUFDRMH-AWEZNQCLSA-N 278.396 2.019 10 10 CECE CCN[C@H](C)c1ccc(N(C)CCCS(C)(=O)=O)cc1 694151028 FDVUOTVNNJVYRE-CYBMUJFWSA-N 298.452 2.228 10 10 CECE COc1ccc(N2CCN[C@@](C)(C3CC3)C2)cc1OC 86123235 BCYCAYXYRBRTAI-MRXNPFEDSA-N 276.380 2.282 10 10 CECE CC[C@@H]1CNCCN1c1ccc2c(c1)OC(F)(F)O2 86176936 FIRJRMYBMBGTFU-SECBINFHSA-N 270.279 2.196 10 10 CECE COc1cccc(CN[C@@H]2CCC[C@H](C(=O)O)C2)c1O 86786856 NWXRXQCVWULTFY-CMPLNLGQSA-N 279.336 2.134 10 10 CECE CCCn1ncnc1CN(CC)Cc1ccc(N)cc1 88595664 RYPWGZHUZLAUAN-UHFFFAOYSA-N 273.384 2.292 10 10 CECE CC[C@@H]1COC[C@H]1N[C@@H](C)c1cc(OC)ccc1O 699544163 FSSQPWLYCFYFDK-MISXGVKJSA-N 265.353 2.476 10 10 CECE C[C@H](NCc1ccc(F)cc1O)C(=O)OC(C)(C)C 1964558917 VGLWNTHKVLBEIX-VIFPVBQESA-N 269.316 2.351 10 10 CECE CN(C)c1ccc2c(c1)OCCN2Cc1ncco1 1964594768 PIUUUSXBLJFXHC-UHFFFAOYSA-N 259.309 2.140 10 10 CECE COc1ccc(N2CC(O)(C(F)F)C2)cc1Cl 2214333888 UTUSNKLYFXTNIV-UHFFFAOYSA-N 263.671 2.165 10 10 CECE CCN[C@@H](CC)c1ccc(N2CC([S@@](C)=O)C2)cc1 2115313149 DRMXCTQLSOFHGH-HNAYVOBHSA-N 280.437 2.314 10 10 CECE COc1ccc(N(C)C(=O)/C=C/c2cccnc2C)nc1 1521607288 DWNSXVNPKRXHNS-RMKNXTFCSA-N 283.331 2.470 10 10 CECE c1cc(N2CCCC2)ccc1CN[C@H]1[C@H]2COC[C@H]21 2118016304 KDNCGIKPGLAQGE-MUJYYYPQSA-N 258.365 2.021 10 10 CECE CC[C@H](C)[C@H](C(=O)O)N(C)Cc1ccc(O)cc1O 2118359008 UJMXAIHVXFQKCV-TVQRCGJNSA-N 267.325 2.029 10 10 CECE COc1cccc(O)c1CN[C@@H](CO)c1ccsc1 2119007407 QPGXSOQPUVAKAG-LBPRGKRZSA-N 279.361 2.286 10 10 CECE C[C@H](N(C)C(=O)c1ccc(N=NC(N)=O)cc1)C(C)(C)O 1468228176 ZHBORHLJRHLVCQ-VIFPVBQESA-N 292.339 2.080 10 10 CECE Cc1cc(N(C)CC23CC(CCO2)C3)ccc1CO 2122922633 MACRUZIYHKJDNC-UHFFFAOYSA-N 261.365 2.493 10 10 CECE CCOCCOC1CCN(C(=O)c2cc(O)cs2)CC1 1544379035 ZSPDJZVLKLRENJ-UHFFFAOYSA-N 299.392 2.111 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCC(C1CC1)C1CC1 1629080602 VSMUGCSZIOTXIO-UHFFFAOYSA-N 275.348 2.193 10 10 CECE NCc1ccc(N(C[C@H]2OCC[C@@H]2F)C2CC2)cc1 2122528847 WUTRGGOZGASVNZ-LSDHHAIUSA-N 264.344 2.241 10 10 CECE CC[C@@H](CCCN1CCC[C@H]1CN=[N+]=[N-])S(=O)(=O)O 2123009002 JAFUOOLPWIRENS-QWRGUYRKSA-N 290.389 2.208 10 10 CECE C[C@H]1OCC[C@]1(C)NC(=O)c1ccc(N=NC(N)=O)cc1 1632714812 DIYWNQKKZWCORE-OTYXRUKQSA-N 290.323 2.146 10 10 CECE Cc1ccc(/C=C/C(=O)NCc2ccc(O)cc2O)cn1 1639444295 FYRLTCIVXKFDCQ-QPJJXVBHSA-N 284.315 2.131 10 10 CECE Cc1ccc(C(=O)NCc2cccc(Cl)c2O)nn1 1640405104 LWSZTKJKPHPZIT-UHFFFAOYSA-N 277.711 2.074 10 10 CECE CN(CCCN=[N+]=[N-])S(=O)(=O)c1ccsc1 1912159036 CAUBBLVVLWADJY-UHFFFAOYSA-N 260.344 2.069 10 10 CECE CC[C@@H](CCOC)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1912192584 HTGZQXIKAZVRPD-WDEREUQCSA-N 254.334 2.350 10 10 CECE CC12CCC(C(=O)NCCCN=[N+]=[N-])(CC1)CO2 1964885319 YYVVNQRVXGGHOO-UHFFFAOYSA-N 252.318 2.152 10 10 CECE [N-]=[N+]=NC1CN(C(=O)Cc2ccc(F)cc2F)C1 1912158643 YIZDHMNIHNUAAS-UHFFFAOYSA-N 252.224 2.028 10 10 CECE Cc1cc(CO)ccc1N(C)Cc1cc(C)n(C)n1 2126782451 QUVRKEPDTZSHAX-UHFFFAOYSA-N 259.353 2.166 10 10 CECE CN(C(=O)CN1CC[C@@H]2CCCC[C@@H]21)c1ccc(N)cc1 162402737 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[N-]=[N+]=NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 34669752 AZUDCZWLUKQDMD-UHFFFAOYSA-N 262.634 2.247 10 10 CECE Cc1nc(CNCc2cc(F)ccc2O)oc1C 220910232 NZFALZUWLCSYCG-UHFFFAOYSA-N 250.273 2.426 10 10 CECE COc1cc(OC)c(N2CCCNCC2)cc1Cl 86287805 IWNYSGOIGZSSTB-UHFFFAOYSA-N 270.760 2.157 10 10 CECE CC[C@@H]1CN[C@H](C2CC2)CN1c1ccc2c(c1)OCCO2 86181442 GBLLSPNAYMCMSZ-HIFRSBDPSA-N 288.391 2.425 10 10 CECE COc1ccc(N(C)CC(=O)N(C)CC2CC2)c(OC)c1 131639928 IFOCIKGDRHJHOH-UHFFFAOYSA-N 292.379 2.008 10 10 CECE CN[C@@H](C[C@@H]1[C@@H]2COC[C@@H]21)c1ccc(N(C)C)cc1 2132381221 IHKDAMUDBJGKKM-FZKCQIBNSA-N 260.381 2.296 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CCO[C@@H]1C1CC1 226618184 YCMDVDOSCZFEIO-TZMCWYRMSA-N 251.301 2.188 10 10 CECE CNCc1ccc(N(CCO)C2CC2)cc1Br 234420243 HYSZHPHPXVSMNL-UHFFFAOYSA-N 299.212 2.130 10 10 CECE CSC[C@](C)(O)CN[C@@H](C)c1cc(F)ccc1O 230662933 HYCYELRHBSZXDE-TVQRCGJNSA-N 273.373 2.296 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1n[nH]c(C2CC2)n1 95055531 CVAAHNRUGFRSPI-VIFPVBQESA-N 286.335 2.221 10 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Nc1ccc(O)c(CNC(=O)C2C[C@H]3CC[C@@H]3C2)c1 2132551843 IUMPBLSAZOTHIS-NXEZZACHSA-N 260.337 2.027 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H](C)[C@H]1CCCO1 720575219 WMWYWBHOZIYILM-IUODEOHRSA-N 276.380 2.432 10 10 CECE Cc1cc(Cl)cc(CN(CCO)[C@H]2CCO[C@@H]2C)c1O 825130375 WZTCQOIJUHSAMZ-RISCZKNCSA-N 299.798 2.326 10 10 CECE C[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc(N)cc2)CS1 2132952668 KKTRMZUPISGGBY-GXFFZTMASA-N 279.409 2.033 10 10 CECE O=C(OCc1nc(-c2ccoc2)no1)c1cc(O)cs1 732352774 GNUJZCYBWAVLFW-UHFFFAOYSA-N 292.272 2.454 10 10 CECE CCOC(=O)CC(C)(C)CNCc1cc(OC)ccc1O 838947369 LNBOWEPLIUALAA-UHFFFAOYSA-N 295.379 2.470 10 10 CECE CN(C)c1ccc(CN2C[C@H](N)C(C)(C)C2)cc1F 903984704 TWJXXXANAYEZBG-AWEZNQCLSA-N 265.376 2.061 10 10 CECE COC[C@@](C)(CCO)NC/C=C/c1ccc(N(C)C)cc1 835041423 CBWLXXFYFCUXBU-FUTAKVPZSA-N 292.423 2.143 10 10 CECE C[C@@H](Cn1cncn1)NC/C=C\c1ccc(N(C)C)cc1 835035280 FRCWDVVVRODNLU-WSNITJDQSA-N 285.395 2.036 10 10 CECE CN(C)c1ccc(/C=C/CN2CC[C@@H](CN)C2)cc1 843048309 IPRHULVVUQSORL-BWPKMQGJSA-N 259.397 2.046 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)c1ccns1 2223381747 VMCPLEREOCMGQC-UHFFFAOYSA-N 284.362 2.266 10 10 CECE CN(C)c1ccc([C@@H](N)CNC(=O)/C=C\C(C)(C)C)cc1 843298118 MJTQQUWURDPKGS-WOLCWHLNSA-N 289.423 2.471 10 10 CECE CC[C@@H](NC[C@@H](O)c1ccnn1C)c1ccc(F)cc1O 927126258 DLYBBVJFHRHDES-IUODEOHRSA-N 293.342 2.039 10 10 CECE COc1ccc(N2CC[C@@H](N[C@H](C)c3ccnnc3)C2)cc1 926679091 ALUUVYSUGZIJLW-UKRRQHHQSA-N 298.390 2.415 10 10 CECE COC(C)(C)CCOC(=O)c1cccc(O)c1O 758557583 JJDXGPNGDULEPN-UHFFFAOYSA-N 254.282 2.070 10 10 CECE Cn1cc(CCC[C@@H](O)CCc2ccc(N)cc2)cn1 695804640 INGOZPANTSUPKD-MRXNPFEDSA-N 273.380 2.319 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)/C=C/C3CC3)C2)cc1 855231089 JMUOIIRVARBWBC-MDDUGHTDSA-N 286.375 2.356 10 10 CECE C[C@@H]1C[C@H](N[C@H]2CCc3cccc(O)c32)c2ncnn21 850499805 XTBXZMPHRVKOBS-USWWRNFRSA-N 270.336 2.267 10 10 CECE C[C@@H](NC(=O)COCC(F)F)c1ccc(N(C)C)cc1 860950695 QSQAEDSIVDMJEK-SNVBAGLBSA-N 286.322 2.212 10 10 CECE CN(C[C@H]1C[C@H]1CF)c1ccc([N+](=O)[O-])c(CO)c1 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CCCN(CCN(C)C)Cc1cccc(OC)c1O 133169816 XPWHDNZDUHACQL-UHFFFAOYSA-N 266.385 2.174 10 10 CECE C[C@H](N[C@H]1C[C@@]12CCCOC2)c1cc(O)ccc1O 1896323315 GZJBPORPGWFQDT-NZVBXONLSA-N 263.337 2.318 10 10 CECE CCCN(CCCCC(N)=O)Cc1ccccc1O 1884286287 AHVORUUKMMRDDM-UHFFFAOYSA-N 264.369 2.260 10 10 CECE Nc1ccc(CCn2cnc3cscc3c2=O)cc1 1885885358 KXLNMTCIGNYZPL-UHFFFAOYSA-N 271.345 2.283 10 10 CECE CC(C)c1ncc(Cl)c(C(=O)NCCN=[N+]=[N-])n1 701304769 BYKNMWOCHGJDRR-UHFFFAOYSA-N 268.708 2.294 10 10 CECE CCN(C)[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 1474763232 ZPNCYEWDDICMMF-LBPRGKRZSA-N 270.323 2.196 10 10 CECE COc1ccc([C@H]2NCCc3cccc(O)c32)c(O)c1 83593808 SUJLPQNSGPFXFF-MRXNPFEDSA-N 271.316 2.342 10 10 CECE Cc1cc(O)ccc1[C@@H]1NCCc2cc(O)c(O)cc21 83724492 GKYBLLLWGNNGMG-INIZCTEOSA-N 271.316 2.347 10 10 CECE CC(C)N(C)CCCNCc1ccc(F)c(F)c1O 703211737 BQIIEGDPOPDSJT-UHFFFAOYSA-N 272.339 2.490 10 10 CECE O=C(NOc1ccccc1F)c1cc(O)cs1 1177109756 PDHCTHRTSACENL-UHFFFAOYSA-N 253.254 2.317 10 10 CECE COCC1(N(C)c2ccc([C@@H](C)O)cc2F)CC1 706385256 LLHUQXGTYMPURZ-SNVBAGLBSA-N 253.317 2.494 10 10 CECE CN(CCNCc1c(O)cccc1Br)C1CC1 706852077 LZHXWWZSOMOOEI-UHFFFAOYSA-N 299.212 2.339 10 10 CECE CCN[C@@H](C)c1ccc(N2CCNC(=O)C[C@@H]2C)cc1 707637022 RQNGVRCQKCQSSF-STQMWFEESA-N 275.396 2.072 10 10 CECE O=C(O)CC12CCC(CC1)N2Cc1ccc(O)c(O)c1 714126558 GNBQQIQHSQZIHA-UHFFFAOYSA-N 277.320 2.070 10 10 CECE CCN(CCC(F)(F)F)C(=O)COc1ccc(N)cc1 689109107 GPIFBERQBCEPDM-UHFFFAOYSA-N 290.285 2.449 10 10 CECE Oc1ccc(CNCC2CC3(CSC3)C2)c(O)c1 717914374 DYIFQBYSMGVBQR-UHFFFAOYSA-N 265.378 2.331 10 10 CECE CN(C[C@@H]1CCC[C@H]1O)c1ccc(CN)c(F)c1F 689817557 ZQZWXOIWWZLXDS-CMPLNLGQSA-N 270.323 2.021 10 10 CECE CCNCc1ccc(N2CC[C@H]3COC[C@@H]3C2)cc1 690287202 XPYNTVYTFSWEAP-GJZGRUSLSA-N 260.381 2.269 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CCCN3CCSC[C@H]23)c1 720514290 MLNQXIXRQMVOMR-HUUCEWRRSA-N 292.448 2.370 10 10 CECE CC(C)O[C@]1(CNCc2cc(F)ccc2O)CCOC1 722356431 PMADWBHXEQLVFB-HNNXBMFYSA-N 283.343 2.205 10 10 CECE C[C@H]1C[C@H](NCc2ccc(O)cc2O)C[C@@H](C)O1 694773597 UPAKJCQTFAJIAJ-PEGIJTEDSA-N 251.326 2.143 10 10 CECE CCN1CCC[C@@H]1CN(C)CCOc1ccc(N)cc1 92622917 AWFZBDMVCKBFNF-OAHLLOKOSA-N 277.412 2.064 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@H](N(C)C)C2)cc1O 93671933 CRIJRGIWRODOBD-JSGCOSHPSA-N 277.412 2.203 10 10 CECE Nc1ccc(CO[C@H]2CCO[C@]3(CCOC3)C2)cc1 94362277 JGKJHXQEPSFDFY-LSDHHAIUSA-N 263.337 2.124 10 10 CECE CCN[C@@H](Cc1ccn(C)n1)c1ccc(N(C)C)cc1 97380554 BBIPAFUXJAKXFO-INIZCTEOSA-N 272.396 2.379 10 10 CECE CN(C)c1ccc(CNC(=O)c2cc3cccn3cn2)cc1 1264262289 ZVGUKXPSVCOWEU-UHFFFAOYSA-N 294.358 2.330 10 10 CECE C/C(=C\C(=O)NCc1ccc(N(C)C)cc1)c1cnccn1 1351266259 SPYMNYPTARQCMP-JLHYYAGUSA-N 296.374 2.262 10 10 CECE Cc1nc(C)c(CNC(=O)Cc2ccc(O)c(O)c2)s1 1444851433 DEMONNPPOWZLIF-UHFFFAOYSA-N 292.360 2.030 10 10 CECE CNCc1ccc(N2CC[C@@H](CO)C[C@H]2C)cc1C 2115831503 XAJPCGDNIMIRFT-ZIAGYGMSSA-N 262.397 2.312 10 10 CECE O=C(COc1ccc(F)cc1)NCc1c(O)cccc1F 1456082620 BCAZUXZCSFMENT-UHFFFAOYSA-N 293.269 2.366 10 10 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C[C@H](N[C@H]1C[C@@H]2[C@H](C(=O)O)[C@@H]2C1)c1ccc(F)cc1O 2169239432 PISCFCVFFDXVLX-HTGFPNDXSA-N 279.311 2.291 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@H]1CO[C@@]2(CCOC2)C1 2179020839 XAUMBDOQAOQPFV-HIFRSBDPSA-N 297.782 2.217 10 10 CECE C[C@H](O)c1ccc(N(C[C@@H]2CCOC2)C2CC2)cc1O 2170066050 FDEDFOPGKVQIJU-RYUDHWBXSA-N 277.364 2.451 10 10 CECE CCc1nn(Cc2c(O)cccc2F)c(N)c1CC 2079644226 IPLQNLNSMHNZDN-UHFFFAOYSA-N 263.316 2.483 10 10 CECE CN(C)c1ccc([C@@](C)(N)CS(=O)(=O)C(C)(C)C)cc1 2170538038 RPKIDAJFTXVBIY-HNNXBMFYSA-N 298.452 2.140 10 10 CECE CCO[C@]1(CN(C)Cc2cccc(C)c2O)CCOC1 2188189562 UKACCPKGKUHPID-INIZCTEOSA-N 279.380 2.328 10 10 CECE Fc1cc(OC[C@@H]2C[C@@H]2F)ccc1N1CCCNCC1 2188355083 CRITVWNOURUVIL-AAEUAGOBSA-N 282.334 2.362 10 10 CECE COC[C@@H]1CC[C@@H](CNC(=O)Nc2ccc(N)cc2)C1 2181944152 YFJLURJPLLBIAC-VXGBXAGGSA-N 277.368 2.453 10 10 CECE NCc1ccc2c(c1)CCCN2[C@H]1CC(F)(F)C[C@@H]1O 2189838228 BUBRSLXQJYAISE-KBPBESRZSA-N 282.334 2.057 10 10 CECE COCc1ccnc([C@H](N)c2ccc(N(C)C)cc2)c1 2199325863 NVDBKLTYWVWQKC-MRXNPFEDSA-N 271.364 2.342 10 10 CECE Nc1ccc(CO[C@@H]2CCCC(F)(F)[C@@H]2O)cc1 2042044727 ATAJKNLFRPXZAO-VXGBXAGGSA-N 257.280 2.334 10 10 CECE C[C@]12CCO[C@H]1[C@H](NCc1c(O)cccc1F)C2 2042599252 KUNUNKBZWJDIOM-KWCYVHTRSA-N 251.301 2.188 10 10 CECE COc1ccc(N2C[C@@H](C)NCC2(C)C)cc1F 2044306008 YEUUFASBLNPWLO-SNVBAGLBSA-N 252.333 2.411 10 10 CECE COc1ccc(N2C[C@@H](C)CC[C@@H]2CN)cc1F 2044326627 RMCLIJKOEUGGMW-CMPLNLGQSA-N 252.333 2.398 10 10 CECE CSC1([C@@H](O)[C@@H](N)c2ccc(N(C)C)cc2)CC1 2044755412 XOAZTXZGXPYUOR-STQMWFEESA-N 266.410 2.009 10 10 CECE CCCOc1cc(N2C[C@@H]3CC(O)C[C@H]3C2)ccc1N 2185191967 GONDHKDGUHSHSG-RYUDHWBXSA-N 276.380 2.265 10 10 CECE C[C@H](O)c1cc(F)c(N(C)Cc2cncn2C)c(F)c1 2194516721 JMMOPXFKKHRMCA-VIFPVBQESA-N 281.306 2.388 10 10 CECE C[C@@H](N)c1cc(F)c(N2[C@H]3CC[C@H]2CC(O)C3)c(F)c1 2194698573 YFMKXXQXLLSRGE-MIMYLULJSA-N 282.334 2.477 10 10 CECE C[C@H](O)c1ccc(N2CCN(C)[C@@H]3C[C@@H]32)c(Cl)c1 2049407059 FKPDVNXIYGNDAB-FZZIBODNSA-N 266.772 2.286 10 10 CECE CN(C(=O)COC[C@@H]1CC[C@H]2C[C@@H]21)c1ccc(N)cc1 2191067217 WTPLWLAAOCLYLL-HUBLWGQQSA-N 274.364 2.294 10 10 CECE [N-]=[N+]=NCCN1CCC[C@@H](CN2CCCCC2)C1 2050949678 IUNLHZWCIUWQQN-ZDUSSCGKSA-N 251.378 2.495 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3C[C@@]3(O)C2)c(Cl)c1 2051367943 VQIFLZAZGZBCSM-NURSFMCSSA-N 266.772 2.321 10 10 CECE C[C@H](COC(F)(F)F)NCCc1ccc(N)cc1 2053148629 CCBIRAPURYLGMC-SECBINFHSA-N 262.275 2.326 10 10 CECE COCc1cc(CN2CCC[C@H]2CN=[N+]=[N-])on1 2059052119 YDKFPTYLZACYOE-JTQLQIEISA-N 251.290 2.096 10 10 CECE CCNCc1ccc(N2CCn3nncc3C2)c(Cl)c1 2186613031 BLVUFRFVZZLRLE-UHFFFAOYSA-N 291.786 2.061 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@H]4CC[C@@H](C3)N4)ccc2O1 2106337848 BSWOVXIKCWEGBL-BNOWGMLFSA-N 258.365 2.341 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3C[C@H]3[C@H]2CO)c(F)c1 2198991667 CHYOMQJDDVULDA-WOSRLPQWSA-N 278.371 2.141 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)CCC4(CC4)C3)ccc21 2199066196 PRTCWUZQVJORNY-RDJZCZTQSA-N 272.392 2.374 10 10 CECE COc1ccc(N2CC[C@H](C)[C@](C)(O)C2)c([N+](=O)[O-])c1 2192169930 CCQKXSDBYROGGS-IINYFYTJSA-N 280.324 2.201 10 10 CECE OC[C@@]1(CNCc2cccc(F)c2O)C[C@H]1C(F)(F)F 2192588024 VNGZEDMNAPJJRF-PWSUYJOCSA-N 293.260 2.182 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCO2)c1nncs1 2077148614 NDLMWFPKGCOXHK-SECBINFHSA-N 261.350 2.324 10 10 CECE Cc1nc2c(s1)CN(c1ccc([N+](=O)[O-])c(CO)c1)C2 2201398698 YWAPWFYVVHVHJP-UHFFFAOYSA-N 291.332 2.372 10 10 CECE CN[C@@H](C)c1ccc(N2CC(OC(C)C)C2)cc1O 2102491575 UISJHGQURNWFPT-NSHDSACASA-N 264.369 2.286 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1COC(C)(C)C1 2103139768 MMJYGKHSUOHISG-LBPRGKRZSA-N 262.353 2.042 10 10 CECE C[C@H](O)c1ccc(N2CCOCCOCC2)cc1Cl 2103239476 SULJDNVRMIQVHK-NSHDSACASA-N 285.771 2.247 10 10 CECE CC(C)CN(C1CNC1)[C@H](C)c1cc(O)ccc1O 2103944269 PKVBSSNLKPOORK-LLVKDONJSA-N 264.369 2.089 10 10 CECE CN(C)c1ccc(CNc2ccn(C)c(=O)c2)cc1 2104185055 IKEJYWYNQWEGIS-UHFFFAOYSA-N 257.337 2.063 10 10 CECE CN(Cc1ccc(F)cc1O)[C@H]1CCOC[C@H]1F 2084093103 MSJJGKABYMFFIP-NEPJUHHUSA-N 257.280 2.090 10 10 CECE COc1cccc(O)c1CN[C@@H]1CO[C@H](C(C)C)C1 2104434212 RWBZAELEGLGWKG-NHYWBVRUSA-N 265.353 2.304 10 10 CECE C[C@@H]1CC[C@@H](CC(=O)N(C)Cc2ccc(N)cc2)O1 2104801915 LICKRPACTWEDRU-RISCZKNCSA-N 262.353 2.185 10 10 CECE CO[C@H]1C[C@@H](C)CN(c2ccc(CN)c(F)c2)C1 2085079323 WHDPQHYSJOIDFE-MFKMUULPSA-N 252.333 2.146 10 10 CECE CCN(C[C@H]1CCCN1)c1ccc(OC)cc1OC 2106343307 CALBBKZRAJRNLS-GFCCVEGCSA-N 264.369 2.282 10 10 CECE COc1cc(C)c(N2CC[C@H](C3CNC3)C2)cc1C 2106380461 UOXNQIROJROUFO-ZDUSSCGKSA-N 260.381 2.358 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H]3CSCCO3)ccc21 2106792444 CULJTDBFLPASDY-LSDHHAIUSA-N 278.421 2.201 10 10 CECE N[C@@H]1C=C[C@H]([C@@H](O)c2ccc(N3CCCC3)cc2)C1 2106823419 OYXKRTONXIMNFB-LZWOXQAQSA-N 258.365 2.224 10 10 CECE CN1CCc2cc([C@H](NN)[C@@H]3[C@H]4CCC[C@H]43)ccc21 2106861898 NYTVHOOVGUYQLM-XNISGKROSA-N 257.381 2.229 10 10 CECE CCCN[C@H](c1ccc2c(c1)CCN2C)C(C)(C)O 2106861055 WJGJZYPEAFVZCC-OAHLLOKOSA-N 262.397 2.491 10 10 CECE CN1CCc2cc([C@H](NN)C3CC4(CC4)C3)ccc21 2106856770 DHBJBLYRPXLJKH-HNNXBMFYSA-N 257.381 2.374 10 10 CECE O=C(O)[C@H]1[C@H]2CC[C@H]1N(Cc1c(O)cccc1Cl)C2 2107502198 CMRPIRMQINIEJP-KDDOJWQBSA-N 281.739 2.341 10 10 CECE CC(C)c1nn(C)cc1[C@@H](O)Cc1ccc(N)cc1 2087546757 UPDPXGJXGNSGQV-AWEZNQCLSA-N 259.353 2.402 10 10 CECE C[C@@H](CCC(F)F)NS(=O)(=O)Cc1ccc(N)cc1 2089955005 WEJUEIXTGRRWOT-VIFPVBQESA-N 292.351 2.122 10 10 CECE C[C@@H]1CC[C@@H](CO)N(CCCc2ccc(N)cc2)C1 2110605955 MAWMKAZJLPTHOF-CJNGLKHVSA-N 262.397 2.294 10 10 CECE Oc1ccc(CNC2[C@H]3CCCCC[C@H]23)c(O)c1O 2110967369 MIEFTKYVALYWKX-QWRGUYRKSA-N 263.337 2.472 10 10 CECE CNCc1ccc(N(C)C[C@H]2C[C@H]3CC[C@H]2O3)cc1 2111769789 GXHCJMZZGIZLNL-FVQBIDKESA-N 260.381 2.410 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)cc1Cl 2093096733 AYCLKIDGMNOBEZ-HBEIAFGSSA-N 280.799 2.424 10 10 CECE Cc1cc(N)ccc1N1C(=O)CC(C(F)F)CC1=O 2094489627 QCLNBLMNXMBDBF-UHFFFAOYSA-N 268.263 2.112 10 10 CECE Oc1cccc(CNC[C@]23CCC[C@H]2CCO3)c1O 2096718425 OVYUOAWAEVEHMH-SWLSCSKDSA-N 263.337 2.147 10 10 CECE COc1ccc(N2CCOCCC23CCC3)c(N)c1 2097876850 JAWVYJSIHRFPFU-UHFFFAOYSA-N 262.353 2.427 10 10 CECE COCC1(CC(=O)N2CCC[C@H](N=[N+]=[N-])CC2)CC1 2099330298 VUGSJTIKZKTSSS-NSHDSACASA-N 266.345 2.495 10 10 CECE COc1cc(Cl)cc(CNCC2CC(CO)C2)c1O 2112391955 QIORYVFWMHWJQM-UHFFFAOYSA-N 285.771 2.162 10 10 CECE CCN(CC)CCN(C)[C@@H](C)c1c(O)cccc1O 2113716444 NYXPJXHFLGWKOE-LBPRGKRZSA-N 266.385 2.432 10 10 CECE COc1ccc(N(C)[C@@H]2CCN(C)C[C@@H]2C)c(N)c1 2113998697 KJEGDXYQUTZWIM-SMDDNHRTSA-N 263.385 2.054 10 10 CECE C[C@H](c1ccccc1O)N1CC[C@H]2CN(C)CC[C@H]21 2114503521 MIFGOUMCQCZPAM-VNHYZAJKSA-N 260.381 2.479 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)c(F)c1 2203131076 MGHQUDKYXFCLMK-VSBTWAGUSA-N 278.371 2.313 10 10 CECE CN[C@@H]1CCCC[C@H]1N(C)Cc1cccc(OC)c1O 2203604363 VWTCYLVKMRMLCJ-ZIAGYGMSSA-N 278.396 2.363 10 10 CECE COc1cc(N2CCC[C@@H]2CO)ccc1CNC(C)C 2204555650 VAFMBQWPNSGPIR-OAHLLOKOSA-N 278.396 2.154 10 10 CECE Cc1cccc(CNC(=O)[C@H](N)[C@H]2CC=CCC2)c1O 2204627870 VNBGNNQICDLWNG-GXTWGEPZSA-N 274.364 2.000 10 10 CECE CC[C@@H]1CCN1Cc1ccc(N2CCNCC2)cc1 2270552501 BAYYVZCJMZOEHZ-OAHLLOKOSA-N 259.397 2.081 10 10 CECE COCC1(CC(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])CC1 2218734163 BTTPSTHBKCZHGL-UWVGGRQHSA-N 252.318 2.151 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1cncc(Cl)n1 2218741924 PBXMGYHVBSVXKM-RQJHMYQMSA-N 266.692 2.091 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CC[C@H]2C[C@@]2(F)C1 2230319278 CBJSGSMUXAINCF-GXFFZTMASA-N 266.272 2.025 10 10 CECE CO[C@@H]1CC[C@@H]1C[S@](=O)CCCc1ccc(N)cc1 2230444020 GFDKEYVZRMMFBM-ZXYWRSMDSA-N 281.421 2.375 10 10 CECE CNCc1cc(OC)ccc1N1C[C@@H](F)[C@H](C)C1 2220415966 XEWGROZPHALQIB-ZWNOBZJWSA-N 252.333 2.209 10 10 CECE OCc1ccc(N2C[C@H]3CCCC[C@]3(CO)C2)cc1 2230620248 DRNSJUHUOWYHFY-GDBMZVCRSA-N 261.365 2.168 10 10 CECE Nc1ccc(NC(=O)N2CC[C@H](OC(F)F)C2)cc1 2230736561 MQOOKBMOHRLFOD-JTQLQIEISA-N 271.267 2.114 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCC2(CN(C)C2)C1 2232098391 NMRYEXQVDXXMCP-ZDUSSCGKSA-N 259.397 2.157 10 10 CECE CCC1(C(=O)N(C)[C@H](C)c2ccccc2O)CC(N)C1 2233423173 VHQADBCELUJDLD-OPGSHWCFSA-N 276.380 2.429 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCOC[C@@H]1CF 2223971685 OYMIPEMWRCYJCA-AAEUAGOBSA-N 253.317 2.223 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[S@@](=O)[C@H](C)C1 2223982901 HWQKDEYXRCJKIL-FTLABTOESA-N 267.394 2.006 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@H]1CCCC[C@H]1C(=O)O 2234172726 UQOFMYXRVFNRFC-OUAUKWLOSA-N 280.328 2.179 10 10 CECE O[C@@H]1CC[C@H]2CN(c3ccc4c(c3)OCCCO4)C[C@@H]12 2235127731 AJCOSAPVVWDQKP-IACUBPJLSA-N 275.348 2.055 10 10 CECE C[C@@H](C[C@@H](C)C(=O)O)C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2225791386 CXNPAHVKCMOGMF-JLIMGVALSA-N 268.317 2.081 10 10 CECE CCNCc1cc(OC)ccc1N1CC[C@H](O)C[C@H]1C 2235966495 UGZPSOMNDOPDKS-OCCSQVGLSA-N 278.396 2.154 10 10 CECE COc1ccc(N2CCC[C@@H](O)C2)c(CNC(C)C)c1 2235965402 DCQRRVVBVXLSCE-CQSZACIVSA-N 278.396 2.154 10 10 CECE O[C@@H]1CN(c2ccc(OCC(F)(F)F)cc2)C[C@H]1F 2226736961 QWUJAFYRFAHSTA-GHMZBOCLSA-N 279.233 2.147 10 10 CECE COc1ccc(N2CC[C@@H](CO)[C@@H](C)C2)c(OC)c1 2226804777 KKLUBGWUFPHXSI-RYUDHWBXSA-N 265.353 2.159 10 10 CECE COc1cc(N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@H]3C2)ccc1CN 2236969139 VSFBVXJZEHQWQU-NOXHYTERSA-N 270.376 2.412 10 10 CECE CCN(C[C@@H](C)OC)c1ccc(OC)cc1CNC 2227686805 WWBMMPVQOMEGEN-GFCCVEGCSA-N 266.385 2.276 10 10 CECE CNCc1cc(OC)ccc1N1CCP(C)(=O)CC1 2227674856 DEWXSWFSKXKSGI-UHFFFAOYSA-N 282.324 2.228 10 10 CECE COc1ccc(N2CCC([C@H](C)O)CC2)c(C=O)c1 2227696977 QLUYGALJTBHASD-NSHDSACASA-N 263.337 2.105 10 10 CECE CCO[C@@H](CCOc1ccc(N(C)C)cc1)C(=O)O 2229377134 KWOYZCYIRWRHTK-ZDUSSCGKSA-N 267.325 2.011 10 10 CECE CN(C)c1ccc(OCc2csc(C(=O)O)n2)cc1 2229373617 NBJDHKPYVLSSIP-UHFFFAOYSA-N 278.333 2.486 10 10 CECE COc1ccc(O)c(CN[C@@H](C(F)F)[C@@H]2CCOC2)c1 2239530657 PNLGMIACNNAXEJ-NOZJJQNGSA-N 287.306 2.161 10 10 CECE NC(=O)C1(NCc2c(O)cccc2Cl)CC2(CCC2)C1 2240650434 QAYCWMXNFYZZER-UHFFFAOYSA-N 294.782 2.323 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCc2ncn(C)c2C1 2240840133 OEKDSISNIPHBBI-LBPRGKRZSA-N 271.364 2.345 10 10 CECE CCNC[C@@H](C)CNCc1cnc(SC)s1 2243839599 GCWHEVAMPWBONZ-SECBINFHSA-N 259.444 2.200 10 10 CECE CSc1ncc(CN[C@@H]2CCCC[C@@H]2N)s1 2243834215 ZZBLMGFAATYWQP-VHSXEESVSA-N 257.428 2.225 10 10 CECE CSc1ncc(CN[C@H]2C[C@H]3C[C@H]2C[C@H]3N)s1 2248706422 XHGJYRCRGDNVOO-MKHNBGRSSA-N 269.439 2.080 10 10 CECE CSc1ncc(CNC[C@H]2CNC[C@@H](C)C2)s1 2248733026 HMNNZOOGHRIVQZ-VHSXEESVSA-N 271.455 2.200 10 10 CECE Oc1ccccc1CNCCN1CCC2(CC1)CC2 2271529788 IHTYUCQLSLTUEE-UHFFFAOYSA-N 260.381 2.358 10 10 CECE Cc1nnccc1CNCc1cc(F)cc(F)c1O 2274267637 KDIHVAWWKASHST-UHFFFAOYSA-N 265.263 2.059 10 10 CECE N[C@@H]1CCN(Cc2ccccc2O)[C@H](C(F)(F)F)C1 2266306055 TXPKYJSMMZJZHX-PWSUYJOCSA-N 274.286 2.246 10 10 CECE CC1(C)OCCN(c2ccc3c(c2)CCC3)[C@@H]1CO 2267736681 DLLVQJRWWGDYGS-OAHLLOKOSA-N 261.365 2.151 10 10 CECE NC[C@H]1CC(F)(F)CN1c1ccc(OC2CC2)cc1 2278989247 OUUYLNMWHXLYBW-LLVKDONJSA-N 268.307 2.401 10 10 CECE CN[C@H]1CCc2cc(N3CCC=C[C@@]3(C)CO)ccc21 2279079877 ISUWLYRZCKOVQK-IRXDYDNUSA-N 272.392 2.411 10 10 CECE COC[C@@]1(C)C=CCN1c1ccc2c(c1)CC[C@H]2O 2269097154 AVSPVFBMLZZVAU-HZPDHXFCSA-N 259.349 2.448 10 10 CECE Cc1cccc(O)c1CN1C[C@@H](S(C)(=O)=O)CC[C@H]1C 2279352523 LPWCYDLDDJUTNK-OLZOCXBDSA-N 297.420 2.098 10 10 CECE Cc1cccc(CN2C[C@H](S(C)(=O)=O)CC[C@@H]2C)c1O 2279354512 PVAQNSHNYUNZNE-GXTWGEPZSA-N 297.420 2.098 10 10 CECE Cc1cc(N2CC(N(C)C3CC3)C2)ccc1[C@H](C)N 2269658568 SCWKSLGOBVELLT-LBPRGKRZSA-N 259.397 2.298 10 10 CECE CN[C@H](C)c1ccc(N2CCCN(C)CC2)cc1C 2269659647 XIOWIBBFNMRWPC-CQSZACIVSA-N 261.413 2.417 10 10 CECE C[C@@H](N)c1ccc(N2CC3(CCC(=O)NC3)C2)c(Cl)c1 2280249971 JYQVPXBNNUMZGT-SNVBAGLBSA-N 293.798 2.076 10 10 CECE CCS(=O)(=O)C[C@H](C)N(C)c1ccc([C@H](C)O)c(C)c1 2285169115 RBRGWHPBLQAECB-STQMWFEESA-N 299.436 2.308 10 10 CECE CN[C@H](C)c1ccc(N(C)CCn2cnnc2)cc1C 2285127947 FYLPWLZJIAEGIJ-CYBMUJFWSA-N 273.384 2.003 10 10 CECE c1cc(N2CCNCC2)ccc1CN1C[C@H]2CC[C@H]1C2 2286072704 FSCSDGJTQWEPKV-RDJZCZTQSA-N 271.408 2.081 10 10 CECE Cc1ccc(/C=C/C(=O)N2CCCc3n[nH]cc32)cn1 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Cc1ccc(O)c(CN2CC[C@@H](c3cnn(C)c3)C2)c1 128514279 ZINRDKMGUVKGCR-CYBMUJFWSA-N 271.364 2.424 10 10 CECE Cc1ccc(O)c([C@H](C)NCCCN2CCCC2=O)c1 184888651 OIYWPVJQBYNDKS-ZDUSSCGKSA-N 276.380 2.364 10 10 CECE CCCNCc1ccc(N2CCCC[C@H]2C(N)=O)c(F)c1 42405721 XEGRHEFMSLSVDC-HNNXBMFYSA-N 293.386 2.170 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)C[C@@H]2CCCCO2)cc1 48947404 QKKWXHOTFVUAKV-DLBZAZTESA-N 291.439 2.253 10 10 CECE CCc1nc(CC)n(CCOc2ccc(N)cc2)n1 88739730 NIUVCMAZHODCSN-UHFFFAOYSA-N 260.341 2.064 10 10 CECE O=C(NCc1ccccc1O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1 228421924 SCZCMNRBZNQAHD-QEJZJMRPSA-N 288.391 2.319 10 10 CECE CCC[C@](NCCN=[N+]=[N-])(C(N)=O)c1ccccc1 90258062 BXILHSXUPWOYRS-CYBMUJFWSA-N 261.329 2.067 10 10 CECE COc1ccc(Br)c([C@@H]2CCN2)c1O 95785214 NDDKQTVAKWECEG-ZETCQYMHSA-N 258.115 2.198 10 10 CECE CN(C)c1ccc([C@H](N)CCc2ccnn2C)cc1 231006760 YLMPGTNFVRQACU-OAHLLOKOSA-N 258.369 2.119 10 10 CECE O=Cc1cccc(NC(=O)c2cccc(O)c2O)c1 236613612 OIAJGJFXWVCLCD-UHFFFAOYSA-N 257.245 2.163 10 10 CECE CNCc1ccc(N2CCC[C@H](N(C)C)C2)c(C)c1 91395327 SVNMEBZRCULCGI-HNNXBMFYSA-N 261.413 2.245 10 10 CECE CCOC(=O)[C@]1(N)CC[C@H](Sc2nccs2)C1 93851745 STJXDJHWYDKYPW-KWQFWETISA-N 272.395 2.048 10 10 CECE Cc1cc(C)cc(S(=O)(=O)NCc2ccccc2O)c1 1259525122 ATPZMPPEWIFFIS-UHFFFAOYSA-N 291.372 2.488 10 10 CECE CC(=O)c1cc(F)cc(CN[C@H]2CCOC[C@H]2C)c1O 277373046 HIJNXESVGXGRSI-OTYXRUKQSA-N 281.327 2.249 10 10 CECE COc1ccc(CN[C@@H](CO)C[C@@H](O)C(C)(C)C)cc1C 283800103 AKDUUOJIWYCJEK-GDBMZVCRSA-N 295.423 2.251 10 10 CECE CN1CCCN(Cc2cc(Cl)c(F)cc2O)CC1 295026685 XBYVEPDUMDMPAA-UHFFFAOYSA-N 272.751 2.322 10 10 CECE CCc1cccc(CNCc2ncoc2COC)c1O 2164747673 MVKCJLFGARSWHV-UHFFFAOYSA-N 276.336 2.379 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCCCC[C@@H]1O 2165035134 UXZUJOGFTXOIHV-OLZOCXBDSA-N 278.352 2.161 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 808549626 JXTGVBTXQVXYND-RWMBFGLXSA-N 266.337 2.294 10 10 CECE Cc1cc([C@@H](N)c2ccc(N3CCCC3)cc2)nn1C 2163098676 DKPLTKJEVXZABT-INIZCTEOSA-N 270.380 2.377 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@](C)(O)C1(F)CC1 2163138091 JYKYUORTBZBVEG-HUUCEWRRSA-N 278.371 2.193 10 10 CECE CCOc1ccc(O)c(CN2CCC[C@H](CO)CC2)c1 816665355 DBVOLUHAPBBQIH-ZDUSSCGKSA-N 279.380 2.385 10 10 CECE CNCCN(Cc1cc(Cl)cc(OC)c1O)C(C)C 720805429 HUOHJLXTYNCKQY-UHFFFAOYSA-N 286.803 2.484 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C1(C)CCCC1 720324576 VHLVJEMICRFUMB-UHFFFAOYSA-N 261.369 2.472 10 10 CECE Cc1cc(O)c(CNCCCn2ccnn2)cc1Cl 825497395 HXWSVFKXTSNFBG-UHFFFAOYSA-N 280.759 2.125 10 10 CECE C[C@@H]1CNC[C@H]1CCNCc1cccc(Cl)c1O 903975061 VMDJQSMGAFVNQA-GHMZBOCLSA-N 268.788 2.381 10 10 CECE CC(C)Cn1ccnc1CNC(=O)Nc1ccc(N)cc1 841300161 PJSIMLPBQBMHQX-UHFFFAOYSA-N 287.367 2.443 10 10 CECE O=C(NCc1ccccc1O)c1cccc2c1C(=O)CC2 1154407566 SPXZVROEDHDPPC-UHFFFAOYSA-N 281.311 2.451 10 10 CECE CC(=O)C(=O)COC(=O)[C@H](C)c1ccc(Cl)cc1 845333763 DVMBOTKITSCYPO-MRVPVSSYSA-N 268.696 2.145 10 10 CECE CCO[C@H](CN[C@@H](C)c1ccc(C)cc1O)CN(C)C 926963937 WASSBOXMFXKRAH-UONOGXRCSA-N 280.412 2.318 10 10 CECE CO[C@H]1CCCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 841897092 UKSHCTXWOBBPSL-GJZGRUSLSA-N 291.395 2.068 10 10 CECE CO[C@H]1CC[C@@H]1CNCc1cnc(SC)s1 2243772589 CMKSNDAEKCOTTF-SCZZXKLOSA-N 258.412 2.380 10 10 CECE C[C@H](N[C@H]1CNOC1)c1ccc(N2CCCCC2)c(F)c1 925868878 AGINBDWXHYRZEG-JSGCOSHPSA-N 293.386 2.370 10 10 CECE COc1cccc([C@H](C)NCCc2cncc(C)n2)c1O 850549318 FWRJJIZOEXYPQU-LBPRGKRZSA-N 287.363 2.393 10 10 CECE CCN(C[C@@H]1C[C@@H]2COC[C@H]2O1)c1ccc(OC)cc1 929904886 QOGOIXTVBDKVJW-UHOFOFEASA-N 277.364 2.325 10 10 CECE CCOc1cccc(CN2CC[C@@](F)(COC)C2)c1O 1875795271 IXTHUCJBVQUMOP-HNNXBMFYSA-N 283.343 2.351 10 10 CECE COc1cc(N(C)Cc2ncc(C)[nH]2)cc(OC)c1OC 862306260 HSZIQNNPJQRMCQ-UHFFFAOYSA-N 291.351 2.380 10 10 CECE C[C@@H](N[C@H]1C[C@](C)(CO)C1)c1cc(F)ccc1O 1876194317 XVVAHHZNVNWQID-GLXFQSAKSA-N 253.317 2.343 10 10 CECE C[C@H](NC(=O)N[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 773316640 XUQIRTOFQYTXPC-GXTWGEPZSA-N 291.395 2.292 10 10 CECE C[C@H](c1ccccc1O)N1C(=O)[C@H]2CC[C@H](C2)C1=O 1877585113 DAQYRYUYKZGWQJ-MXWKQRLJSA-N 259.305 2.238 10 10 CECE C[C@H](N)c1cccnc1N(C)Cc1ccccc1O 1877524553 RXWUSWBPFKOTTA-NSHDSACASA-N 257.337 2.443 10 10 CECE C[C@@H](NC(=O)[C@H]1CC2(CC2)CO1)c1ccccc1O 1877567530 NMPWTYBSOHIACE-ZWNOBZJWSA-N 261.321 2.139 10 10 CECE CNc1cncc(N(C)[C@H](C)c2ccccc2O)n1 1877545859 QVOFXLOHIDLXPZ-SNVBAGLBSA-N 258.325 2.421 10 10 CECE COc1cc(C)cc(CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)c1O 895440511 SEHIIHQZCIBNCJ-UODUUCHISA-N 289.375 2.222 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H]3OCC[C@@H]3C2)c(F)c1 1880490590 PWPBPWIYQHOULL-JRKPZEMJSA-N 269.291 2.243 10 10 CECE CC[C@H](CO)N(C)c1c(F)cc([C@H](C)NC)cc1F 1880970036 FTMXFIUDXHPOSN-GXSJLCMTSA-N 272.339 2.452 10 10 CECE CC(C)C[C@H](N[C@@H](C)c1cc(O)ccc1O)C(=O)O 43432205 VXARHCYNTSBBGY-CABZTGNLSA-N 267.325 2.248 10 10 CECE CCCN(CC(=O)NC)[C@H](C)c1ccc(F)cc1O 133291141 UUMAWTMDDODZDX-SNVBAGLBSA-N 268.332 2.050 10 10 CECE CCNC(=O)CN(CC)[C@@H](C)c1cc(F)ccc1O 133620588 KNNFUZOMKQUHTB-JTQLQIEISA-N 268.332 2.050 10 10 CECE Oc1c(Cl)cc(Cl)cc1CN[C@H]1CC[C@H]1O 1898103618 RFFXCVZTALTCQU-VHSXEESVSA-N 262.136 2.312 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@H]3COC[C@@H]32)c(F)c1 1899110205 HRVMYQYRUUUBGL-ZDMBXUJBSA-N 269.291 2.243 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2CC[C@@H](C)O2)cc1O 1885281925 MZJTXYWBVFWGNJ-NTZNESFSSA-N 265.353 2.449 10 10 CECE c1cnnc(CNCc2ccc3c(c2)CCCO3)c1 1964048880 QDWUXGYDDVAFCC-UHFFFAOYSA-N 255.321 2.091 10 10 CECE Cc1cc(O)ccc1[C@H]1NCCc2c(O)ccc(O)c21 75799423 FJNSLYCJRONTSO-MRXNPFEDSA-N 271.316 2.347 10 10 CECE Oc1cc2c(cc1F)CCN[C@H]2c1cccc(O)c1O 83623423 JXDXJDMFQPWKRW-AWEZNQCLSA-N 275.279 2.178 10 10 CECE Nc1cc(F)ccc1[C@H]1NCCc2cc(O)c(O)cc21 83621064 OSSOZHRPHDGATC-OAHLLOKOSA-N 274.295 2.054 10 10 CECE COc1ccc(N2CCN(C)CC(C)(C)C2)cc1N 84629705 RAIPGYDNYYUUOB-UHFFFAOYSA-N 263.385 2.055 10 10 CECE Oc1cc(Br)ccc1CN1C[C@@H](O)C2(CC2)C1 1328201477 WGZPCUJWSOQGHE-GFCCVEGCSA-N 298.180 2.111 10 10 CECE CC1(C)[C@H](O)[C@@H]2CCCN(c3ccc(CN)cc3)[C@H]21 703159214 GPMPBOWZEHMAIN-RBSFLKMASA-N 260.381 2.131 10 10 CECE CCN(CCc1nccs1)C(=O)c1cccc(O)c1O 187202666 LMUWXOIRUVGAKD-UHFFFAOYSA-N 292.360 2.259 10 10 CECE C[C@@H]1CC[C@H]1NCc1ccc(N2CCN(C)CC2)c(F)c1 1323700373 OAGXEFZVCAGQRM-CZUORRHYSA-N 291.414 2.466 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@H]2CCCN(C)C2)cc1 705148610 OYLQOVYRSLNQJG-KBPBESRZSA-N 261.413 2.484 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@@H]2CCCC[C@@H]21 706810096 JMKBOOKZRKQWIU-XUJVJEKNSA-N 273.380 2.470 10 10 CECE C[C@H]1[C@H](N(C)C)CCN1Cc1cc(F)cc(F)c1O 708397417 CPMSMYUNBLHLEU-TVQRCGJNSA-N 270.323 2.195 10 10 CECE Nc1ccc(N2CCO[C@@H](C(F)(F)F)CC2)cc1 687565874 GLFJGFDPGDEFQQ-LLVKDONJSA-N 260.259 2.426 10 10 CECE CC[C@H]1C[C@H](N(C)C(=O)Nc2ccc(N)cc2)CO1 688480077 SKEGKMJSJAOUJY-STQMWFEESA-N 263.341 2.300 10 10 CECE Cc1cc(O)ccc1NS(=O)(=O)N1CCCC[C@H]1C 80357824 UWIOZVYNXDRAII-LLVKDONJSA-N 284.381 2.232 10 10 CECE CNCc1ccc(N2C[C@@H](CO)CC[C@@H]2C)cc1C 688724367 HNTRWYKEULOTSZ-KBPBESRZSA-N 262.397 2.312 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H]3COC[C@@H]32)cc1O 690315511 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Cc1nc2c([nH]1)CCN[C@@H]2c1ccc(N(C)C)cc1 215543230 XZBWOCYWVDNAFU-CQSZACIVSA-N 256.353 2.019 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@@]23CCC[C@@H](C2)OC3)CC1 2117725054 QBDNSGJPLLYJHW-GWCFXTLKSA-N 264.329 2.152 10 10 CECE CN(C[C@]1(F)CC[C@@H](C(=O)O)C1)c1ccc(N)cc1 2117855443 FFJYKWQNBCCDQX-YGRLFVJLSA-N 266.316 2.298 10 10 CECE C[C@@](O)(c1ncccc1Cl)[C@@H](N)c1ccccc1O 2120056631 HDTWDOFXUPNMED-JSGCOSHPSA-N 278.739 2.348 10 10 CECE COc1ccc(N(C)CCOC(C)C)c(CN)c1 2220416042 WNGAEADRTTXSCU-UHFFFAOYSA-N 252.358 2.015 10 10 CECE CCOC1(CN2CCC[C@@H]2CN=[N+]=[N-])CCOCC1 2123017495 HEACMNGZAQVYKJ-GFCCVEGCSA-N 268.361 2.347 10 10 CECE CCn1nccc1C(=O)NCc1cc(Cl)ccc1O 1557385723 JEPLFCDOLATMCO-UHFFFAOYSA-N 279.727 2.192 10 10 CECE COc1ccc(F)cc1C(=O)NCc1ccc(O)cc1O 1630302358 ZAXDTESHSMYGRH-UHFFFAOYSA-N 291.278 2.176 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H]2[C@@H](C1)C2(F)F 1912147315 XFONFEMQFHOGMJ-NGZCFLSTSA-N 288.298 2.253 10 10 CECE CO[C@H](C)CCC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 1912156479 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C[C@@H](NC[C@H]1C[C@@H](N(C)C)C1)c1c(O)cccc1O 2128495772 VTQMOPGLOMZAPB-UTUOFQBUSA-N 264.369 2.089 10 10 CECE COC(=O)c1ccc(N)c(Sc2nccs2)n1 167653582 MMNSHUBMLWFBAR-UHFFFAOYSA-N 267.335 2.058 10 10 CECE O=C1/C(=C\c2ccc[nH]2)SC(=S)N1C1CC1 1858591266 HNWSQVHLCBWNRJ-RMKNXTFCSA-N 250.348 2.378 10 10 CECE CC(=O)N[C@@H](C)CN=NNc1cc([N+](=O)[O-])ccc1C 1860492381 QGECBXGXYDFQOW-VIFPVBQESA-N 279.300 2.207 10 10 CECE C[C@@]1(CC(=O)O)CCN(c2ccc3c(c2)OCO3)C1 259354281 JVJMVPJPYXDOCR-AWEZNQCLSA-N 263.293 2.106 10 10 CECE Cc1cccc(CN[C@@H]2C[C@H]3[C@H]4CC[C@@H](O4)[C@@H]23)c1O 2132230862 HJLPJNKXYIAJRL-NJVJYBDUSA-N 259.349 2.356 10 10 CECE CN(c1ccc(CO)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCC[C@H]21 2132057369 CXDJCADQJXZTRB-IMRBUKKESA-N 262.309 2.322 10 10 CECE Cc1cc(CN2CC[C@]23CCOC3)ccc1N(C)C 1117990518 YVDFXPMPOVVLAJ-MRXNPFEDSA-N 260.381 2.426 10 10 CECE Oc1c(F)cc(F)cc1CNCC[C@@H]1CCC[C@@H]1O 1913771106 GTJVFBSMSACGEP-ZANVPECISA-N 271.307 2.311 10 10 CECE Nc1ccc(CC(=O)OC[C@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 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253.729 2.313 10 10 CECE OC[C@@]12CCC[C@]1(CNCc1cccc(F)c1O)C2 2143018371 NJYHOSBNFLLLLJ-CABCVRRESA-N 265.328 2.174 10 10 CECE CN(CCCNC(=O)OC(C)(C)C)CCN=[N+]=[N-] 1953341329 OODFGQVOHDLWMQ-UHFFFAOYSA-N 257.338 2.143 10 10 CECE CO[C@H](C)COc1ccc(N2CCC[C@H](N)C2)cc1C 252812299 HHCCXBNNSGQWRU-KGLIPLIRSA-N 278.396 2.336 10 10 CECE CC12COC(CNCc3ccc4c(c3)CCO4)(C1)C2 1973312812 ZZVZUJNOCXZRAW-UHFFFAOYSA-N 259.349 2.280 10 10 CECE CP(C)(=O)[C@@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1 1973925373 QCHCRINNYKFBIP-UONOGXRCSA-N 294.335 2.471 10 10 CECE Oc1cccc2c1[C@H](NC[C@H]1C[C@]13CCOC3)CC2 1974225610 PWJSBSYIRPKZQU-IOASZLSFSA-N 259.349 2.396 10 10 CECE COc1cccc(O)c1CNCC[C@H]1C[C@@H](OC)C1 1974338635 GBDNWIRWZBGITI-TXEJJXNPSA-N 265.353 2.306 10 10 CECE CO[C@@H]1CC[C@H]2CN(C(=O)Nc3ccc(N)cc3)C[C@@H]21 2144208715 PQYRTUBQBIIGCT-LEWSCRJBSA-N 275.352 2.158 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@]1(O)CCOC[C@@H]1C 2148162004 IDEOEILOSGHFNN-APHBMKBZSA-N 279.380 2.220 10 10 CECE CN1CCc2cc(CN3CCC[C@@]34CCNC4)ccc21 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CC(=O)c1cc(F)cc(CN2CCN(C3CC3)CC2)c1O 48994953 ZRGNHRAKHHAXAY-UHFFFAOYSA-N 292.354 2.014 10 10 CECE COc1cc(Cl)cc(CNCc2c[nH]cn2)c1O 229052653 GARDDDJXLBQBQP-UHFFFAOYSA-N 267.716 2.067 10 10 CECE O[C@@H]1CC[C@@H]2CN(c3ccc(CNC4CC4)cc3F)C[C@H]21 228062806 BOWNVOIGMKAIFX-SUYBPPKGSA-N 290.382 2.285 10 10 CECE CN(Cc1ccccc1O)C(=O)CC[C@H]1CCCCN1 50947756 COUBVZRPNNGBSY-CQSZACIVSA-N 276.380 2.273 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@H]2C[C@@H]21 385482304 OFMQTDMBXLUNDP-NHCYSSNCSA-N 252.318 2.008 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@](C)(C(=O)O)C1 94622261 WLDCLECSDGAFIL-YMTOWFKASA-N 267.300 2.389 10 10 CECE CN1CCc2c(F)cc3ccn(C)c3c2[C@H]1CCN 606596600 CCPLUHRXADSBOD-CYBMUJFWSA-N 261.344 2.195 10 10 CECE Oc1c(Br)ccc(C2CCNCC2)c1O 258486260 LYGYERVPDRVDHT-UHFFFAOYSA-N 272.142 2.327 10 10 CECE CCCN(Cc1nc(C)cc(O)n1)c1ccc(N)cc1 700468174 CMYZWCQULJIETQ-UHFFFAOYSA-N 272.352 2.489 10 10 CECE CNC1C[C@@H]2CC[C@H](C1)N2c1ccc(OC)c(OC)c1 54627458 DETLESCWKVPEHW-YHWZYXNKSA-N 276.380 2.423 10 10 CECE Oc1c(OCc2ccccc2)cccc1[C@@H]1CNCCN1 380932695 HKOWMBLGGFBRPR-HNNXBMFYSA-N 284.359 2.205 10 10 CECE CN(C)c1ccc(CNCCS(=O)(=O)C(C)(C)C)cc1 113345243 RYXUUCSBTGIOHI-UHFFFAOYSA-N 298.452 2.056 10 10 CECE CC(C)[C@@H](N)[C@H](N)c1cc(Br)ccc1O 396764466 UPIFZGKAFSQTQZ-GHMZBOCLSA-N 273.174 2.138 10 10 CECE C[C@H]1CNC[C@@H](C)[C@]1(O)c1ccc2c(c1)CCCN2C 2163102768 NQLZSFHSADQMFH-FVCICTRLSA-N 274.408 2.132 10 10 CECE NC[C@@H]([C@H](O)c1ccc(N2CCCC2)cc1)C(F)(F)F 2163107709 PNAUMLLUMAHGLK-QWHCGFSZSA-N 288.313 2.457 10 10 CECE Cc1ncc([C@@H](N)c2ccc(N3CCCC3)cc2)n1C 2163126312 HVPYSXUOXRALHP-INIZCTEOSA-N 270.380 2.377 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@H](O)c2ccc(F)nc2)cc1 2163131226 OZTCFCPGFLPASS-CABCVRRESA-N 275.327 2.020 10 10 CECE CCN1CCc2cc([C@H](NC)[C@@](C)(O)CSC)ccc21 2163138840 RDDRIBJVWOASDP-HOTGVXAUSA-N 294.464 2.444 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@](C)(O)c1cncs1 2163140600 LDAVULOWXSSSCA-HUUCEWRRSA-N 291.420 2.377 10 10 CECE CC[C@@]1([C@H](NN)c2ccc3c(c2)CCN3C)CCCO1 2163144425 RDWNWYKHUOVZIT-CVEARBPZSA-N 275.396 2.143 10 10 CECE CCN(CC)c1ccc([C@H](NN)c2snnc2C)cc1 2163151823 MTYBMIRFCOIVSZ-ZDUSSCGKSA-N 291.424 2.245 10 10 CECE CC1(C)CC=CCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 2165833173 FOKWHRODHWGCMX-AWEZNQCLSA-N 271.364 2.431 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1CC2CC(F)(C2)C1 2163730342 FIXTZQHREXUHGX-RWWNRMGGSA-N 277.343 2.030 10 10 CECE CN1CCc2cc([C@@H](N)c3sccc3C(=O)O)ccc21 2164029482 YOBCNPJSCNCTFK-CYBMUJFWSA-N 288.372 2.487 10 10 CECE CCc1nccn1CCNCc1ccc2c(c1)CCO2 719727234 CYROVNRBMJLIKY-UHFFFAOYSA-N 271.364 2.170 10 10 CECE CCc1nccn1CCN[C@H](C)c1c(O)cccc1O 719735241 QREMFDJYCIWMHL-LLVKDONJSA-N 275.352 2.208 10 10 CECE Nc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1Cl 722213176 SFNLBJSZOFEPSI-UHFFFAOYSA-N 298.751 2.429 10 10 CECE CC[C@@H](NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccccc1O 724604142 NCWQKSDOBKIQFW-FIRUKDTASA-N 277.364 2.237 10 10 CECE Cc1cccc(CNC[C@@H]2CNCCC2(F)F)c1O 903954873 HMRHYKRBMXCORS-LBPRGKRZSA-N 270.323 2.035 10 10 CECE O=C(CC(F)(F)C(F)F)NCc1ccc(O)cc1O 910958331 ZPFVEGSDPDKQPD-UHFFFAOYSA-N 281.205 2.005 10 10 CECE CC[C@H](NC[C@](C)(CO)OC)c1cc(Cl)ccc1O 848557072 BYQLAIZATGXOHO-GXTWGEPZSA-N 287.787 2.484 10 10 CECE CCN1C[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)OC1=O 846861755 RFGJONOIGUPQSY-WFASDCNBSA-N 291.395 2.244 10 10 CECE C[C@@H]1COCC[C@@H]1CNC(=O)NCc1c(O)cccc1F 922443286 BLIZROBDQVGRFE-GHMZBOCLSA-N 296.342 2.003 10 10 CECE O=C(O)[C@@H](CNCc1cc(F)ccc1O)C1CCC1 854245534 BIXKPCNNCHUPKG-LBPRGKRZSA-N 267.300 2.122 10 10 CECE CC(C)NC[C@H]1CCN1c1ccc(CN(C)C)cc1 696300140 SXASUKQCUXCMSN-MRXNPFEDSA-N 261.413 2.325 10 10 CECE CCNCc1ccc(N2CC(N3CCCC3)C2)cc1 697751037 MYPUWMHUHIOYKK-UHFFFAOYSA-N 259.397 2.081 10 10 CECE C[C@@H](N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)O 930614162 TYXHSMCBWNYTKH-CQSZACIVSA-N 292.423 2.114 10 10 CECE C[C@]1(C(=O)N2Cc3cccc(O)c3C2)CCCCO1 871206177 VDDSPALEKMOGPX-OAHLLOKOSA-N 261.321 2.194 10 10 CECE CO[C@H]1CCCC[C@H]1C(=O)N1Cc2cccc(O)c2C1 871205221 RVJKQEFFWSJZIQ-DOMZBBRYSA-N 275.348 2.440 10 10 CECE C[C@@H]1C[C@H]2CN(Cc3c(O)cccc3F)CCN2C1 1876166355 ABBYENDIQZLIDR-NEPJUHHUSA-N 264.344 2.057 10 10 CECE COC(=O)c1cc(C)cc([C@H](N)C(F)(F)F)c1O 72195599 WKYQTYPTHUOXIE-VIFPVBQESA-N 263.215 2.049 10 10 CECE CN(C(=O)c1cc(N)cc(F)c1)c1ccc(N)cc1 1876480018 MXTDMGWXSBLMMP-UHFFFAOYSA-N 259.284 2.267 10 10 CECE CCCSC[C@H](N)C(=O)N[C@H](C)c1ccccc1O 1877594796 CAPQNQAUEOQMHN-PWSUYJOCSA-N 282.409 2.040 10 10 CECE CCCC[C@H](N)CC(=O)N[C@@H](C)c1ccccc1O 1877590722 WYGKAVCRXJNIRA-RYUDHWBXSA-N 264.369 2.477 10 10 CECE Cc1nscc1C(=O)[C@H](O)c1ccc(N(C)C)cc1 1877633445 XEVJGKRQAYQGEO-CYBMUJFWSA-N 276.361 2.434 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@@H]1CNCc1ccccc1O 1955965123 YTWGGGVFKGEBLE-OLZOCXBDSA-N 292.379 2.395 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@H]3C[C@H]2CO3)c(F)c1 1880484607 GXPMSRMNPGUFNV-MIMYLULJSA-N 269.291 2.386 10 10 CECE CC[C@H]1CN(c2c(F)cc([C@H](C)N)cc2F)C[C@H]1O 1880926962 JXEQASFGMVQWRN-MWODSPESSA-N 270.323 2.192 10 10 CECE CCN[C@@H](C)c1cc(F)c(N(C)C[C@H](C)O)c(F)c1 1880963488 WHLGCLKFKGLYDM-UWVGGRQHSA-N 272.339 2.452 10 10 CECE Oc1cc(Cl)ccc1CNC[C@H]1CN2CCC1CC2 1308965278 CVMYAMDJMCIHIR-ZDUSSCGKSA-N 280.799 2.477 10 10 CECE Cc1cccc(NCc2ccc(O)c(O)c2O)c1O 83444018 POMKZYPRVNICOH-UHFFFAOYSA-N 261.277 2.430 10 10 CECE Oc1cc(O)c2c(c1)[C@@H](c1cc(F)ccc1O)NCC2 83598351 CHHRCJVMJLZTSW-HNNXBMFYSA-N 275.279 2.178 10 10 CECE Cc1c(O)cccc1[C@@H]1NCCc2cc(O)c(O)cc21 83724407 VDOCQYFWBKHTJA-INIZCTEOSA-N 271.316 2.347 10 10 CECE [N-]=[N+]=NCCN1C(=O)COc2ccc(Br)cc21 42416108 LPSOVTOBDCBKEV-UHFFFAOYSA-N 297.112 2.485 10 10 CECE C[C@H]1CN(C)CCN1Cc1c(O)cccc1Br 707156090 SCZLTCNZEPJMRD-JTQLQIEISA-N 299.212 2.291 10 10 CECE COc1ccc(CN2CCO[C@H](C(C)C)C2)c(O)c1 709024452 BTRXAESUYRXHQL-HNNXBMFYSA-N 265.353 2.258 10 10 CECE CCCN(C)CCNCc1ccc(OC)c(C)c1 688688634 NYJAMNWKPRQHHU-UHFFFAOYSA-N 250.386 2.435 10 10 CECE CCN(c1ccc(CO)c(Cl)c1)[C@H]1CCN(C)C1 693442896 VCKLOHKJHRKFDQ-ZDUSSCGKSA-N 268.788 2.363 10 10 CECE Cc1cc(N(C)[C@H]2C[C@H]3CCCN(C2)C3)ccc1CN 717451312 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CECE Nc1ccc(CCCO[C@H]2CC[C@H](C(=O)O)C2)cc1 2122962213 DXKRKLFWQSDDHI-JSGCOSHPSA-N 263.337 2.471 10 10 CECE Cc1cccc(C(=O)NCc2c(O)cccc2F)n1 1646029268 UMKDHUNFDXISHG-UHFFFAOYSA-N 260.268 2.165 10 10 CECE Cc1ccc(O)c(CNC(=O)[C@@H]2CCCN(C(C)C)C2)c1 1640800518 PWGXFXCXGUXTPO-CQSZACIVSA-N 290.407 2.437 10 10 CECE CN(C)c1ccc(OC[C@@H](N)C2(Br)CC2)cc1 2215965420 ABNSKNKURCRSDK-GFCCVEGCSA-N 299.212 2.386 10 10 CECE C[C@H](NC(=O)c1c(F)ccc(O)c1O)c1ccc[nH]1 1654464732 UZOSJBWOZXNIGO-ZETCQYMHSA-N 264.256 2.056 10 10 CECE Oc1cccc(O)c1CNc1nc(C2CC2)ns1 1651448783 CFKBQLZCPDUANH-UHFFFAOYSA-N 263.322 2.439 10 10 CECE C[C@@H]1CC[C@H](C(=O)O)CN1Cc1ccc(F)cc1O 1964725623 CUXWTDZHRNRTCS-KOLCDFICSA-N 267.300 2.216 10 10 CECE O[C@@H]1CCCc2cc(N3CC(OC(F)F)C3)ccc21 2128278050 VABDUUOXCDARGD-CYBMUJFWSA-N 269.291 2.484 10 10 CECE CN[C@@H]1CCc2cc(N3CCCN(C)CC3)ccc21 2128314969 MSQTTWWKCHEDNF-MRXNPFEDSA-N 259.397 2.035 10 10 CECE CN[C@@H]1CCc2cc(N3CC4(C=CCO4)C3)ccc21 2128313875 YVPXEQFDMSKLEB-OAHLLOKOSA-N 256.349 2.039 10 10 CECE CCCN[C@@H](C)c1ccc(N2C[C@@H](CO)OC[C@@H]2C)cc1 221138955 YZAUMLBABCLDEF-ZQIUZPCESA-N 292.423 2.333 10 10 CECE C[C@@H]1SC(=S)N(CC(=O)Nc2cccc(F)c2)C1=O 11635398 MTXRRAKUUAONQH-ZETCQYMHSA-N 298.364 2.013 10 10 CECE COc1cc(C)c(N(C)[C@H](C)CCN)c(OC)c1 259231254 BMHKEAPJIYMYRX-LLVKDONJSA-N 252.358 2.186 10 10 CECE COc1ccc(N(C)Cc2cc(N)n[nH]2)c(C)c1C 259315666 VPZNKZXYSWQMQO-UHFFFAOYSA-N 260.341 2.254 10 10 CECE CC(C)CC1(O)CN(c2ccc(CN)c(F)c2F)C1 2131837687 SCUOGOZHGBNKSR-UHFFFAOYSA-N 270.323 2.021 10 10 CECE NCc1ccc(N2CCC[C@H](C3(O)CC3)C2)cc1F 2130498907 QQUQRYWBBGZJPR-LBPRGKRZSA-N 264.344 2.026 10 10 CECE CN(C[C@H]1CCSC1)c1ccc(CO)c([N+](=O)[O-])c1 2132059858 VTPBUWXHSAEBER-SNVBAGLBSA-N 282.365 2.276 10 10 CECE C[C@@H](N[C@@H]1CCc2cccc(O)c21)c1nccn1C 850573222 XCJBSLLZOHUFNH-ZYHUDNBSSA-N 257.337 2.464 10 10 CECE CN(Cc1ccc(Cl)s1)C(=O)CN1CC(N=[N+]=[N-])C1 1912152253 QNEHCRILEKCMHH-UHFFFAOYSA-N 299.787 2.354 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C[C@@H](C(=O)O)c2ccccc2)C1 1912192121 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COc1ccc(CNC[C@](C)(O)c2ccc(C)o2)c(O)c1 174496670 CTGUYRHACHTELD-INIZCTEOSA-N 291.347 2.300 10 10 CECE CC(C)(C)[C@@H](Cn1ccnc1)NCc1ccc(O)c(O)c1 37156319 BJHJBZMHJLXNPQ-OAHLLOKOSA-N 289.379 2.499 10 10 CECE CCCN(CCOCCOC)c1ccc(N)cc1 70481099 ODRDXWLTTNWJIR-UHFFFAOYSA-N 252.358 2.148 10 10 CECE Cc1cc(N2C[C@H](C)[C@H](N(C)C)C2)ccc1/C=C/C(=O)O 124713862 GLJMMCMFPLRUAK-HDZMBNNRSA-N 288.391 2.479 10 10 CECE CNCc1cc(Br)c(OC)c(C)c1O 213305846 BCADHDYPQNHBPY-UHFFFAOYSA-N 260.131 2.191 10 10 CECE CCN1CC[C@H](CN)[C@@H]1c1ccc2c(c1)CCN2C 70282175 LQOZRQVBHUACGO-ZBFHGGJFSA-N 259.397 2.021 10 10 CECE O=C(O)c1cccc(NCc2cc3c(cc2O)OCO3)c1 42879669 UNSMHVLMRVUYEV-UHFFFAOYSA-N 287.271 2.431 10 10 CECE CCOc1cccc(CN[C@H](C)C(=O)NCC(C)C)c1O 228976109 SDMYUNOFULOQLL-GFCCVEGCSA-N 294.395 2.041 10 10 CECE CCO[C@H]1CCCN([C@@H](CN)c2ccc(N(C)C)cc2)C1 42421725 IFPQMPCVWPMMSX-IRXDYDNUSA-N 291.439 2.253 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@](C)(CN)C1 385472987 APTKHHBFAYQRMD-QMTHXVAHSA-N 252.333 2.263 10 10 CECE O=C(O)C1CCC(O)(CSc2nccs2)CC1 236430656 MUQWUERAEJAKRQ-UHFFFAOYSA-N 273.379 2.241 10 10 CECE Cc1cccc(O)c1[C@H](N)CNC(=O)OC(C)(C)C 238536915 AEKZXTJNSUMACW-SNVBAGLBSA-N 266.341 2.225 10 10 CECE CCCN(CC(=O)OCC)Cc1ccc(OC)cc1O 92380562 KFAYFJXYWDZVOP-UHFFFAOYSA-N 281.352 2.176 10 10 CECE CCOc1ccc(O)c(CN(C)Cc2cnccn2)c1 92591627 XYZXCUYDEYWKBF-UHFFFAOYSA-N 273.336 2.213 10 10 CECE [N-]=[N+]=NC[C@H]1CN=C(N)N1c1ccccc1Br 93386428 YMZXDOKUDCXBRN-SSDOTTSWSA-N 295.144 2.263 10 10 CECE CC(=O)Cc1c(F)cc(O)c(O)c1Br 258553555 WLIYRDDONZUYHE-UHFFFAOYSA-N 263.062 2.131 10 10 CECE Cc1cccc(CNS(=O)(=O)c2cccs2)c1O 1250948324 JBQJEWATWRFYTK-UHFFFAOYSA-N 283.374 2.241 10 10 CECE CC[C@]1(C)CN(c2ccc3c(c2)OCCCO3)CCN1 86122750 MPNCYMYOVLCLDN-MRXNPFEDSA-N 276.380 2.426 10 10 CECE CCCNC(=O)C1CN(c2ccc([C@@H](C)O)cc2Cl)C1 2168052491 DWUYROYLQPAWTM-SNVBAGLBSA-N 296.798 2.356 10 10 CECE COC(=O)[C@H](C1CC1)[C@@](C)(N)c1ccc(N(C)C)cc1 2166998950 CLSMGJQDAXBZEP-HOCLYGCPSA-N 276.380 2.126 10 10 CECE CNNCc1cc(Cl)cc(Br)c1O 708124981 KPOQNDFZGZPXJY-UHFFFAOYSA-N 265.538 2.032 10 10 CECE FC1(F)Oc2ccc(N3CCC[C@]34CCNC4)cc2O1 2162672377 XFVJDQUSHLJGMV-CYBMUJFWSA-N 282.290 2.340 10 10 CECE CC[C@@H](Nc1c(N)cccc1C(=O)OC)c1ncc[nH]1 2165037555 VVESWJZHLMFQIH-LLVKDONJSA-N 274.324 2.342 10 10 CECE N[C@@H]1CC[C@@H](C(F)(F)F)N(c2ccc3c(c2)CCO3)C1 2162847610 OMJVZRZQSVWZST-MFKMUULPSA-N 286.297 2.480 10 10 CECE C[C@@H]1CNCC[C@@H]1N(C)c1ccc2c(c1)OC(F)(F)O2 2162872528 NFYKIWRNSZVLON-KOLCDFICSA-N 284.306 2.442 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3NC[C@H]4CC[C@@H]43)ccc21 2163061889 INUOJECJDYFXTE-WTTBNOFXSA-N 272.392 2.100 10 10 CECE CN1CCc2cc([C@H](N)[C@@](C)(O)c3ccoc3)ccc21 2163136181 QNXAABABDYXDCQ-HOTGVXAUSA-N 272.348 2.179 10 10 CECE COc1cccc(CNC(=O)C2(C)C[C@H]3C[C@@H]3C2)c1O 815834281 BLYWBMDSQFYDIS-VXGBXAGGSA-N 275.348 2.453 10 10 CECE CCN(CC)c1ccc(CNc2cn(C)nn2)cc1F 812345731 LPUVAYSEOPBSHE-UHFFFAOYSA-N 277.347 2.413 10 10 CECE C[C@H]1C[C@@H](C(=O)NCCCSc2nccs2)CCN1 829528127 KURBGMMWCOJQGU-QWRGUYRKSA-N 299.465 2.130 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CC(C)(O)C1 822809176 QJZNBKZRXDWSNV-UHFFFAOYSA-N 290.407 2.262 10 10 CECE O=C1O[C@@H](CSc2nccs2)CN1C1CC1 845305366 FYAXWFHDZMSJST-MRVPVSSYSA-N 256.352 2.218 10 10 CECE CN(C)c1ccc(/C=C/CNC[C@@H]2C[C@H](F)CN2)cc1 841077864 DXAVLWDSYWZTAB-WCYDHSITSA-N 277.387 2.055 10 10 CECE N=c1cc[nH]cc1C(=O)NCc1c(O)ccc2c1CCCC2 843489938 OHPMOBIMAYTQNK-UHFFFAOYSA-N 297.358 2.009 10 10 CECE CCc1cccc(CN[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)c1O 848898573 WENUBRLVJLPOHX-NILFDRSVSA-N 288.391 2.054 10 10 CECE Cc1cccc(CN2CC[C@]3(CCCNC3)C2)c1O 843118264 GGJDDCMBAGXEGM-INIZCTEOSA-N 260.381 2.276 10 10 CECE CCCCNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 849224901 LHIBKWYQAKBTLB-CYBMUJFWSA-N 291.395 2.373 10 10 CECE C[C@H](NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1cc(F)cc(F)c1O 926948538 NHXVDMSARZFFGL-VKZHRDFRSA-N 299.317 2.125 10 10 CECE C[C@@H]1C[C@H](NC(=O)NCc2c(O)cccc2F)CS1 922881992 LBMWOOMXBXVZQP-BDAKNGLRSA-N 284.356 2.225 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)N1CC(CC2CC2)C1 857738399 YMKJLHXMGQQRPE-XQRVVYSFSA-N 273.332 2.370 10 10 CECE C[C@H]1CCC[C@H]1N(C)CC(=O)N(C)c1ccc(N)cc1 690985267 KQKBZNFGZHVTON-SWLSCSKDSA-N 275.396 2.352 10 10 CECE Oc1c(Cl)cccc1CN1C[C@@H]2[C@H]3CC[C@@H](NC3)[C@H]2C1 863653230 FYTMBLRVXJNUCA-QMPIGLIWSA-N 292.810 2.475 10 10 CECE CCO[C@H](C(=O)N1Cc2cccc(O)c2C1)C1CC1 871207723 RMKMNZKJWCYTDD-AWEZNQCLSA-N 261.321 2.050 10 10 CECE CN(Cc1ccc(N)cc1)c1cc(N)c(N)cc1F 1876335186 KNXXAVFNIFGWHY-UHFFFAOYSA-N 260.316 2.209 10 10 CECE CC(C)[C@@H]1NCC12CCN(c1ccc(N)cc1)CC2 1876354757 YYVBUMNKSYHRQA-HNNXBMFYSA-N 259.397 2.483 10 10 CECE CN(Cc1ccccc1O)c1cncc([N+](=O)[O-])c1 1877522362 DRZOETNZULVMMZ-UHFFFAOYSA-N 259.265 2.332 10 10 CECE Cc1cccc(CN(C)[C@@H]2CCN3CC[C@H]2C3)c1O 1877839789 NEVPKOAXHHKWEH-DZGCQCFKSA-N 260.381 2.227 10 10 CECE CCOc1cccc(CN(CCOC)[C@H]2CCOC2)c1O 787333800 CDMYPLUQQNLIBW-AWEZNQCLSA-N 295.379 2.028 10 10 CECE C[C@H](O)c1cc(F)c(N2CCCC[C@H](O)C2)c(F)c1 1880480675 YHEDICHNOFTBQU-ONGXEEELSA-N 271.307 2.369 10 10 CECE CC1=C[C@@H](C)CN(C(=O)c2ccc(C)c(O)c2O)C1 797778673 XOCMGCWGVJTMFW-SECBINFHSA-N 261.321 2.444 10 10 CECE C[C@@H](NC(=O)c1cnc2c[nH]nc2c1)c1ccccc1O 1151892237 MCTSFTGXCOFNGT-SECBINFHSA-N 282.303 2.155 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H]3COC[C@H]32)cc1 1899109332 FHSBNHBFTGOVQX-GXTWGEPZSA-N 259.305 2.010 10 10 CECE Oc1cc2c(cc1CN[C@@H]1C[C@@H]3CCC[C@H]31)OCO2 897952648 IASXJZPRAACWOX-MVWJERBFSA-N 261.321 2.399 10 10 CECE O=Cc1ccc(/C=C\C(=O)NCc2c(O)cccc2O)cc1 1304054792 YRPJWGFZHQDOJX-HJWRWDBZSA-N 297.310 2.240 10 10 CECE [N-]=[N+]=NCCCCNC(=O)Cc1ccc(Cl)nc1 1963732460 OEMXJICOXSOQGF-UHFFFAOYSA-N 267.720 2.484 10 10 CECE CC(C)[C@H](O)[C@@H](C)NCc1cc(F)cc(F)c1O 1964055098 FLWORQKIDRFNPW-PELKAZGASA-N 259.296 2.165 10 10 CECE Cc1cccc(O)c1CN1CCC[C@@H](CC(=O)O)C1 1963063876 IERCAVDZSCYQJZ-LBPRGKRZSA-N 263.337 2.387 10 10 CECE O=C(O)[C@H]1CN(Cc2ccccc2O)CC12CCC2 1963598688 BIAISVOHAFTIJD-GFCCVEGCSA-N 261.321 2.079 10 10 CECE C[C@@H](NC(=O)Cc1ccc(F)cn1)c1ccccc1O 1171722733 CFIFWMRNSZZVJP-SNVBAGLBSA-N 274.295 2.346 10 10 CECE Nc1ccc(Cc2n[nH]c(CC(F)(F)F)n2)cc1 82752273 QIPUMYQLRQMJMS-UHFFFAOYSA-N 256.231 2.083 10 10 CECE C/C=C/C=C/c1nnc([C@H](N)c2ccc(O)cc2O)o1 83537661 FLKJDQPNNJVUQO-XRCCYUMASA-N 273.292 2.118 10 10 CECE Oc1cc(F)c2c(c1)[C@H](c1cccc(O)c1O)NCC2 83627742 ZWLHXVHQYXZNDC-AWEZNQCLSA-N 275.279 2.178 10 10 CECE COc1cc2c(cc1Cl)N(C)C[C@@]21CCNC1 84798462 KTUGAQNZPKUGQA-ZDUSSCGKSA-N 252.745 2.030 10 10 CECE Oc1c(CNCCCn2cccn2)ccc(F)c1F 703215476 SQOFWSSOYJLPTR-UHFFFAOYSA-N 267.279 2.047 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2nn(C)cc2C)c1 723488189 KZFVTMXCARJMIP-LLVKDONJSA-N 275.352 2.294 10 10 CECE COc1ccc(N(C)[C@](C)(CN)[C@H]2CCCCO2)cc1 705988086 UDSXSRZOFCUBLW-HZPDHXFCSA-N 278.396 2.418 10 10 CECE Cc1cc(N(C)[C@H]2CO[C@@H](C3CC3)C2)ccc1CO 691758624 ZTKGNSHBKKKVJX-HZPDHXFCSA-N 261.365 2.491 10 10 CECE C[C@H](N)c1ccc(N2CCCC[C@@H]2[C@@H](C)O)cc1O 708477456 QYYIJMFUGCFGKC-MISXGVKJSA-N 264.369 2.152 10 10 CECE Cc1ccc(O)c([C@H](C)N(C)C2CC(S(C)(=O)=O)C2)c1 716082055 KLUJVHQFRHHVTQ-HIFPTAJRSA-N 297.420 2.269 10 10 CECE Oc1ccccc1CN[C@H]1CCCN2CCSC[C@@H]12 718430289 AXTYMUYXPSDUNG-KBPBESRZSA-N 278.421 2.062 10 10 CECE CCN(CC1CC1)[C@H](CN)c1ccc(N(C)C)cc1 69237353 YJGPCUPSEYAYJB-MRXNPFEDSA-N 261.413 2.484 10 10 CECE CN(C)Cc1ccc(N2[C@H]3CC[C@H]2CC(=O)C3)cc1 689498861 CSUUSHZFKOGXNG-GJZGRUSLSA-N 258.365 2.449 10 10 CECE C[C@H](CO)CNCc1ccc(N2CCCCC2)cc1 88195524 KCGXERFPIZFLKG-AWEZNQCLSA-N 262.397 2.395 10 10 CECE COC[C@H]1CC[C@H](NCc2cc(F)ccc2O)C1 1918666019 YTCUMHOFXFFUQA-GWCFXTLKSA-N 253.317 2.436 10 10 CECE C[C@@H]1SC(=S)N(CCC(=O)Nc2ccccc2)C1=O 11635890 IDKCAKSSSLYTLZ-VIFPVBQESA-N 294.401 2.264 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)cc1 2117689985 PZKLBQDNSAIUCK-DARAHFNDSA-N 261.365 2.195 10 10 CECE COc1ccc([C@H](C)N[C@H]2[C@H]3OCCC[C@@H]32)c(O)c1 2119891099 IAIBXORXSFVDLN-FFFUXKDYSA-N 263.337 2.229 10 10 CECE CNCc1ccc(N(C)CCc2ccccn2)cc1 34824303 TXYONZLHDDMDRC-UHFFFAOYSA-N 255.365 2.480 10 10 CECE COc1cccc(C(=O)NCc2c(O)cccc2F)c1O 1558455792 YQBGECVIBOUUNW-UHFFFAOYSA-N 291.278 2.176 10 10 CECE O=C(NCC(=O)c1c(F)cccc1F)c1cc(O)cs1 1627055385 LVJKMWWXJWULSR-UHFFFAOYSA-N 297.282 2.345 10 10 CECE CNc1ccc(C(=O)NCc2cc(O)ccc2O)cc1F 1558175406 PENXQHXTJPYLPY-UHFFFAOYSA-N 290.294 2.209 10 10 CECE CCCC[C@H](O)CCC(=O)NCc1ccc(O)c(O)c1 1630273492 PYTBAEWOIXUOMS-LBPRGKRZSA-N 281.352 2.045 10 10 CECE C[C@H](NC(=O)C1(N(C)C)CCCC1)c1ccccc1O 1635803984 MGUQQDUSPOGQSU-LBPRGKRZSA-N 276.380 2.444 10 10 CECE O=C1CCN(c2ccc(OC(F)F)cc2)CCC1=O 1615891450 UEKKISDMTROAEK-UHFFFAOYSA-N 269.247 2.026 10 10 CECE Oc1cccc(O)c1CNc1cc(C2CC2)ncn1 1640453114 PCUSORKIBPXGDX-UHFFFAOYSA-N 257.293 2.377 10 10 CECE C[C@@H]1CC[C@H](C2OCCO2)N(CCCN=[N+]=[N-])C1 1912156174 LFNNULFHHKSLSX-GHMZBOCLSA-N 254.334 2.160 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccc2c(c1)COCC2 1912162031 QNFIBOKRXKOZTK-UHFFFAOYSA-N 260.297 2.190 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@H]2CC23CCOCC3)C1 1912163790 NRVJGHDKISEMRL-NWDGAFQWSA-N 278.356 2.352 10 10 CECE 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CN[C@@H](C)c1ccc(N2CC3(CC3)C[C@@H]2CO)cc1O 2155344894 KOZZULSQPJNZMH-WCQYABFASA-N 276.380 2.024 10 10 CECE CC(C)CNC(=O)[C@@H](C)N[C@@H]1CCc2cccc(O)c21 312857390 RGVRCTDPXQABQN-DGCLKSJQSA-N 276.380 2.130 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@]23CC[S@](=O)C3)c(F)c1 2158464725 KBYCKCWXMDZZNM-PLTJGGDTSA-N 296.411 2.337 10 10 CECE CCN1CCCN(c2ccc(CN)cc2F)[C@H](C)C1 319803504 JKSCMAPUGODPRA-GFCCVEGCSA-N 265.376 2.205 10 10 CECE COc1ccc([N+](=O)[O-])cc1C(=O)NCCCN=[N+]=[N-] 701317658 SVBBJISVFUPCTD-UHFFFAOYSA-N 279.256 2.034 10 10 CECE [N-]=[N+]=NCCCNC(=O)CCc1nc2ccccc2[nH]1 701303225 LBSYBLJYFDNXQV-UHFFFAOYSA-N 272.312 2.312 10 10 CECE CCNCc1ccc(N2CCN(CC)C(=O)C2)cc1Cl 2158780781 LQHMIHLUQKHVDL-UHFFFAOYSA-N 295.814 2.118 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CC[C@](F)(C(F)(F)F)C1 2159063691 QSWZKIRPOARFNC-LLVKDONJSA-N 293.216 2.214 10 10 CECE COCc1nn(C)cc1N[C@H](C)c1ccc(O)cc1O 2159307368 YSQFCGBHEKMNKA-SECBINFHSA-N 277.324 2.151 10 10 CECE CC[C@H](N[C@H]1CCc2nncn2C1)c1ccccc1O 2159984914 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272.751 2.139 10 10 CECE CCN(CC)[C@@H]1CCN(c2c(F)cc(CN)cc2F)C1 62967184 QLOKPSUTLKDVQC-GFCCVEGCSA-N 283.366 2.344 10 10 CECE COc1ccc(CNCc2cccc(O)c2O)c(C)n1 2157059000 KIORKRFLKMTPPG-UHFFFAOYSA-N 274.320 2.100 10 10 CECE CO[C@H]1CCCN(c2ccc(CN)c(F)c2)[C@H]1C 2037813732 WQZVBHYHZIJZFM-HZMBPMFUSA-N 252.333 2.288 10 10 CECE C[C@@H]1CN(C)CCCN1[C@H](C)c1c(O)cccc1O 300550714 QUVKQTDLCCPJIN-VXGBXAGGSA-N 264.369 2.185 10 10 CECE C[C@](N)(c1ccccc1O)c1cnc2sccn12 2038273092 LKYJYLUYNANWFR-ZDUSSCGKSA-N 259.334 2.324 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CCSC[C@@H]3C)ccc21 70220136 QUKXNHBADIUOEJ-HZMBPMFUSA-N 291.420 2.231 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)C[C@H]2CCCCO2)C1 403641595 CKDAIHOSITWUHT-GHMZBOCLSA-N 252.318 2.247 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H](C)OC)cc1O 310679251 KIKHBKOWHHSPRU-WDEREUQCSA-N 252.358 2.144 10 10 CECE Cc1ccoc1CN(C)c1ccc2c(c1)NC(=O)[C@H]2N 312665462 IETJIHDYLNXFEH-AWEZNQCLSA-N 271.320 2.176 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)[C@H]1CN2CCC1CC2 312965382 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CC[C@@H]1[C@@H]2CNC[C@@H]2CN1c1ccc2c(c1)C[C@H](C)O2 2162633329 XISWYXIZYAWTBF-KSZJFAHPSA-N 272.392 2.444 10 10 CECE COC(=O)C1(NCCN=[N+]=[N-])CCC(F)(F)CC1 688305283 IJFFQMRWHSMCMQ-UHFFFAOYSA-N 262.260 2.007 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CNCC1(C)C 711370378 RIZLESAYTHNHHP-DGCLKSJQSA-N 276.380 2.157 10 10 CECE COCCn1cc(N[C@H]2CCc3cccc(O)c32)cn1 380681494 CPWWZLUVDUOUTI-ZDUSSCGKSA-N 273.336 2.335 10 10 CECE CO[C@@H](C(C)C)[C@H](NN)c1ccc2c(c1)CCCN2C 2163101780 DYTUFAWYYWXSCD-CVEARBPZSA-N 277.412 2.244 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H](S(C)(=O)=O)CC1(C)C 2179902700 RFRQRPYJFDFXTL-NWDGAFQWSA-N 297.420 2.351 10 10 CECE C[C@H](O)c1ccc(N(C)CC23CCN(CC2)C3)c(F)c1 715789460 BBMYHYWOTRUALD-LBPRGKRZSA-N 278.371 2.411 10 10 CECE Oc1cccc(CNC[C@H]2CCCSC2)c1O 384101059 DZUVQTOWIUAKMV-SNVBAGLBSA-N 253.367 2.331 10 10 CECE Cc1cccc([C@@H](NCCN=[N+]=[N-])C(=O)O)c1F 384498003 OIGDLCXHSCNKDC-SNVBAGLBSA-N 252.249 2.160 10 10 CECE CNCc1ccc(N(C)[C@@H]2C[C@H](C)O[C@@H]2C)c(C#N)c1 384794120 ROAIEYTXXYUHKD-HWWQOWPSSA-N 273.380 2.280 10 10 CECE CC1(C)CN(Cc2cccc(F)c2O)[C@@H]2COC[C@@H]21 384772396 BQDWSVCGGRGRBN-WCQYABFASA-N 265.328 2.388 10 10 CECE C[C@H]1C[C@@H](O)CN1c1ccc(CN)cc1C(F)(F)F 384806305 ZQDSJSQDEUPKTM-WCBMZHEXSA-N 274.286 2.124 10 10 CECE CCNCc1ccc(N2CCC[C@@H](O)[C@@H]2C)c(C#N)c1 384881168 QWZJATFROCWSPA-BLLLJJGKSA-N 273.380 2.017 10 10 CECE CC1(C)CO[C@@H](CNCc2cccc(O)c2O)C1 717285553 RFUZNHHWSHGPJJ-LLVKDONJSA-N 251.326 2.003 10 10 CECE CO[C@H]1CCN(c2c(F)cc(CN)cc2F)[C@H](C)C1 394021033 NWRHJYPACCIUCC-KOLCDFICSA-N 270.323 2.427 10 10 CECE CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(c2ccc(CN)c(F)c2)[C@H]31 394331073 RACUJXPQNAOTRQ-XNHOIOAFSA-N 276.355 2.144 10 10 CECE CCCNCc1ccc(N2CC(O)C2)cc1C(F)(F)F 394925329 IYHPEKBLGNJJCS-UHFFFAOYSA-N 288.313 2.386 10 10 CECE COC[C@H]1CCCCN1c1cc(OC)c(OC)cc1N 396160469 ZMRJXJOYKMZVFE-LLVKDONJSA-N 280.368 2.291 10 10 CECE C[C@H](C[S@](C)=O)N(C)[C@H](C)c1cc(F)ccc1O 399850621 HIAMVHVMKQJDSE-MHNGPXOMSA-N 273.373 2.291 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2cnns2)cc1O 400040805 ZVCBZNFCLKONQM-VIFPVBQESA-N 278.381 2.161 10 10 CECE CC(C)N1CCC(C(=O)Nc2ccc(O)c(O)c2)CC1 2062773321 PQWRTZYXTPHASU-UHFFFAOYSA-N 278.352 2.157 10 10 CECE Cc1cc(CO)ccc1N1CC[C@](CO)(C(F)(F)F)C1 2167690669 VATODQOTNLBEMQ-ZDUSSCGKSA-N 289.297 2.238 10 10 CECE CCN[C@H](c1ccccc1O)[C@H]1C[C@H](OC)[C@H](OC)C1 2174835270 GANXDGVZMHBNAH-KSYCFECVSA-N 279.380 2.483 10 10 CECE Cc1cccc([C@@H](C)n2nccc2C(=O)NC2CC2)c1O 2069940090 NPNBLTAHZIBKSX-LLVKDONJSA-N 285.347 2.399 10 10 CECE COc1ccc(N(C)[C@H](CN)[C@@H]2C[C@H]3CC[C@H]2O3)cc1 2168148789 RCRDZLCVTYCSLL-QKPAOTATSA-N 276.380 2.026 10 10 CECE CCN1CCc2cc([C@H](N)C3(O)CC(CF)C3)ccc21 2174972127 SEWAOGZDKFZQJL-AJQRCPHMSA-N 278.371 2.179 10 10 CECE CC1(C)C[C@H](CC(=O)O)CN1Cc1ccc(O)cc1O 2175330758 BOZABRTVQMNUJB-JTQLQIEISA-N 279.336 2.173 10 10 CECE O[C@H]1CCN(c2ccc(CNC3CC3)cc2)C2(CC2)C1 2169875869 NXKMKWMXFICYTB-INIZCTEOSA-N 272.392 2.432 10 10 CECE CCCN1CCCN(c2ccc([C@H](C)O)c(O)c2)CC1 2170030549 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CC[C@@H](COC(F)F)NCc1cccc(O)c1O 2067264347 YGJBLVDXVQHKSF-VIFPVBQESA-N 261.268 2.205 10 10 CECE CC[C@@](C)(COC)NCc1cc(OC)ccc1O 2067430866 QLAJPVAMEFHWSC-AWEZNQCLSA-N 253.342 2.306 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3C[C@@H]2CN(C)C3)c(Cl)c1 2067427130 QCHIGAPYZODVHY-JLLWLGSASA-N 265.788 2.252 10 10 CECE CCOc1cccc(CNC2(C(F)(F)F)COC2)c1O 2195346020 WWJMJLAQTRZGBP-UHFFFAOYSA-N 291.269 2.212 10 10 CECE COC[C@]1(C)CCCN(C(=O)Cc2ccc(N)cc2)C1 2192204108 YOWJOEXAMXWVAI-MRXNPFEDSA-N 276.380 2.086 10 10 CECE COC[C@H](C)N(C)c1c(F)cc([C@H](C)N)cc1F 2074220686 GYRUKCVPPQZKAM-IUCAKERBSA-N 258.312 2.456 10 10 CECE NCc1ccc2c(c1)CCCN2CC1(CO)CCC1 2100173263 QEBMRXAAVBRYIM-UHFFFAOYSA-N 260.381 2.061 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H]2CCN(C)[C@@H]2C1 2102329102 CNDLBWQDPPJEIY-GDBMZVCRSA-N 260.381 2.018 10 10 CECE CC[C@@H]1CN(Cc2ccc(F)cc2O)CC[C@@H]1N 2084080076 PWOZSJBISJKIGR-MFKMUULPSA-N 252.333 2.091 10 10 CECE COc1cc(N2CCS[C@@H]3CC[C@@H]32)ccc1CO 2084019042 ITEDLXMRNJAUEP-GXTWGEPZSA-N 265.378 2.272 10 10 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2.231 10 10 CECE CN(CCc1ncccn1)c1ccc(CN)cc1Cl 2090749633 BYLIPGGLKICFRE-UHFFFAOYSA-N 276.771 2.268 10 10 CECE CN(C)[C@@]1(C)CCN(CCCc2ccc(N)cc2)C1 2093540364 OYWXEOWWKMPRJL-INIZCTEOSA-N 261.413 2.227 10 10 CECE Cc1c(CN2C[C@H]3C[C@@]3(N)C2)n(C)c2ccccc12 2095129983 RPPMYBUKQVXPMM-MLGOLLRUSA-N 255.365 2.020 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CCS[C@@H]2CC[C@H]21 2095860683 WGUVQEPKOBDQOD-DGCLKSJQSA-N 280.349 2.171 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccncc2O)CC1 2099332815 KRVGCHZPQBTGOQ-SECBINFHSA-N 261.285 2.092 10 10 CECE [N-]=[N+]=NCC1CCN(Cc2n[nH]c3c2CCC3)CC1 2113110829 USKVCDSMXKGWFD-UHFFFAOYSA-N 260.345 2.421 10 10 CECE CN1CCCc2cc(N3CCC[C@H](N)CC3)ccc21 606595334 DPCIHOOOCJVMDN-AWEZNQCLSA-N 259.397 2.387 10 10 CECE CNCc1ccc(N2CCCCC23COC3)cc1OC 2204558217 ZQVAGEFYLCHWBK-UHFFFAOYSA-N 276.380 2.174 10 10 CECE COc1cc(N2CC[C@H](O)CC23CCC3)ccc1CN 2204546722 CQDVHQBLPRGTLM-AWEZNQCLSA-N 276.380 2.038 10 10 CECE CCN(CC)[C@H]1CCN(c2ccc(CN)c(OC)c2)C1 2204548949 QFXRPBXCKMRTGA-HNNXBMFYSA-N 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10 10 CECE CSc1ncc(CNC/C=C(\CO)C(F)(F)F)s1 2314012663 YESDNCLEDURGHK-FARCUNLSSA-N 298.355 2.436 10 10 CECE CC(C)Oc1ccc(N(C)[C@@H]2CNC[C@H]2F)cc1 2320529137 CUHZLNWEBSKQFU-ZIAGYGMSSA-N 252.333 2.220 10 10 CECE CN(C[C@H]1C[C@H](F)C1)C(=O)Cc1ccc(N)cc1 2327361158 GFUMISQZSBXNLW-HAQNSBGRSA-N 250.317 2.018 10 10 CECE CSc1cc(N2CC[C@@H](CO)[C@@H]2C)ccc1CN 2328536354 MBWQYCYRTDIVIZ-JQWIXIFHSA-N 266.410 2.074 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)C[C@@H]2C[C@H]1CC2(F)F 2329127377 OCVKOQTZKBTFQY-OYNCUSHFSA-N 274.271 2.165 10 10 CECE C[C@@H](NC[C@@H]1[C@@H]2CCOC[C@@H]21)c1ccc(F)cc1O 2331249607 MAHJBCXKCKPYSG-PCDDKUFXSA-N 265.328 2.464 10 10 CECE CN1CCC2(CC1)CCN(c1ccc(CO)cc1)C2 2335543275 DPKYFZATRHCJIA-UHFFFAOYSA-N 260.381 2.101 10 10 CECE Cc1cc(F)c[nH]c1=NCCc1ccc(O)c(O)c1 2336690245 WHTJYGCTUWBTTG-UHFFFAOYSA-N 262.284 2.017 10 10 CECE C[C@H]1C[C@@H](C)[C@@H]1[C@@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2339096508 KKYKIETWUREFGG-ZEDHKUJTSA-N 262.397 2.405 10 10 CECE C[C@H]1[C@@H](O)CCCN1c1ccc(CN)c(C2CC2)c1 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2.248 10 10 CECE CCCCN(CC(N)=O)[C@H](C)c1cc(F)ccc1O 132872591 BZXTURZZCMMBQP-SNVBAGLBSA-N 268.332 2.180 10 10 CECE CCCO[C@H]1CCCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 42422853 QMFHACSEAKFCDY-SWLSCSKDSA-N 289.379 2.034 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@@H]1CCN2CCC[C@@H]12 226110273 WGTDSLMIPGHVFU-KGLIPLIRSA-N 289.379 2.094 10 10 CECE CCOc1cccc(CNC[C@@H]2CCC[C@H]2C(=O)O)c1O 89448267 SOBDXRCIIMEAAX-WCQYABFASA-N 293.363 2.381 10 10 CECE C[C@@H]1OCCC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 190707799 HZYPHKNQMNGCEH-AAEUAGOBSA-N 294.370 2.323 10 10 CECE CCC(C)(CC)NC(=O)COc1ccc(N)cc1 230952280 USUHDBSVYWTZNR-UHFFFAOYSA-N 250.342 2.343 10 10 CECE Cc1ccc(CN2CCC[C@@]23CCCNC3)c(O)c1 1222247384 DWFUVDUYSFOCTE-MRXNPFEDSA-N 260.381 2.419 10 10 CECE CC(C)N(CC(=O)O)[C@H](C)c1cc(F)ccc1O 94622201 SBYYMVTVYVKMFR-SECBINFHSA-N 255.289 2.387 10 10 CECE C[C@@](NCCCN=[N+]=[N-])(C(=O)O)c1cccc(F)c1 90259195 WEEQFEBRTRHHKT-LBPRGKRZSA-N 266.276 2.416 10 10 CECE CC1(C)OC[C@@H]2C[C@@]21NCc1ccc2c(c1)CCO2 527767089 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CN(Cc1ccccc1O)C(=O)c1nnc(-c2ccco2)o1 1137345388 GHPHDISPEFFLHU-UHFFFAOYSA-N 299.286 2.307 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H]2CN(CCN=[N+]=[N-])C[C@H]21 1882910392 QGIHTBFHOFYIAX-GHMZBOCLSA-N 281.360 2.238 10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)CCCN=[N+]=[N-] 1882298896 YXRJVXVBNZVABB-SECBINFHSA-N 285.348 2.058 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCO[C@@H](CF)C2)c(F)c1 1880488468 VSDYBNCUVDEBPV-SCZZXKLOSA-N 275.270 2.193 10 10 CECE COc1cc(N)c(N2CCCCC[C@H]2CO)cc1OC 133130857 IHIKFERKTIOVRG-NSHDSACASA-N 280.368 2.027 10 10 CECE [N-]=[N+]=NCCCn1cc(Br)ccc1=O 1885133414 VWXGRRFOVDFSOL-UHFFFAOYSA-N 257.091 2.311 10 10 CECE Nc1ccc(OCc2nnc(Br)s2)cc1 1959221310 JCEIGRVMZYDKEP-UHFFFAOYSA-N 286.154 2.462 10 10 CECE CCCNCc1ccc(N2CC[C@@H]3COC[C@H]32)cc1 1899145216 APDVDEWEORHPMP-GDBMZVCRSA-N 260.381 2.411 10 10 CECE CC1(C)CCC[C@@H](CNC(=O)Cc2ccc(N)cc2)O1 1345490882 PCDKYLIOPQUSLA-AWEZNQCLSA-N 276.380 2.275 10 10 CECE Cn1c(CNCc2ccc(O)cc2O)nc2ccccc21 76271294 JLQFAEZRZLGFMV-UHFFFAOYSA-N 283.331 2.274 10 10 CECE Cn1c(C(=O)NCCN=[N+]=[N-])cc(Cl)c1Cl 701282758 WUFZRHZPMCDDKD-UHFFFAOYSA-N 262.100 2.372 10 10 CECE Cc1nnc2sc([C@@H](C)Cc3ccc(N)cc3)nn12 82585095 RCZJDONJFAUEGF-QMMMGPOBSA-N 273.365 2.423 10 10 CECE CN(C)Cc1ccc(N2CCC(C(=O)O)CC2)cc1 82719719 WZZZWSRMITZWFF-UHFFFAOYSA-N 262.353 2.049 10 10 CECE COc1ccc([C@]2(C)CO[C@@H](C(C)C)CN2)c(O)c1 83482222 ACBBFCMUBKGTEK-CABCVRRESA-N 265.353 2.260 10 10 CECE N[C@@H](c1nnc(C2CCC2)o1)c1cccc(F)c1O 83458398 JYCCFBSEGJTTBD-SNVBAGLBSA-N 263.272 2.230 10 10 CECE Oc1ccc2c(c1)CCN[C@@H]2c1cccc(O)c1O 83594415 BTOGYXYWXYNZJM-AWEZNQCLSA-N 257.289 2.039 10 10 CECE C[C@@H](NCC1(O)CCSCC1)c1ccc(O)cc1O 702239417 KRLPWYCKKMQDEU-SNVBAGLBSA-N 283.393 2.007 10 10 CECE CCOC1CCC(Nc2c(N)cccc2C(N)=O)CC1 703834756 CZLAIVOJLUZWQN-UHFFFAOYSA-N 277.368 2.127 10 10 CECE CO[C@@H]1CCCN(c2ccc(CN)cc2F)CC1 692023678 WIBDWPWNKFKNQA-GFCCVEGCSA-N 252.333 2.290 10 10 CECE C[C@H](O)c1ccc(NCCc2ccc(N)cc2)nc1 686076393 PSHIBCIJOGBQEM-NSHDSACASA-N 257.337 2.372 10 10 CECE 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CC[C@H](C)N[C@H](C(=O)O)c1ccc(N(C)C)cc1 211859185 JIIJVHUDBNAVPU-GWCFXTLKSA-N 250.342 2.266 10 10 CECE COc1ccc2c(c1)SC[C@@H](CC(=O)O)N2C 215056618 ZOWLWYMNUTZUJQ-MRVPVSSYSA-N 253.323 2.080 10 10 CECE Nc1ccc2c(ccn2CCC(=O)NC2CCC2)c1 2116880482 BREYAFCFSIKULD-UHFFFAOYSA-N 257.337 2.282 10 10 CECE Cc1cccc(O)c1CN[C@H](C)Cc1ccnn1C 2117693764 YKEDBFJXTBNAEU-GFCCVEGCSA-N 259.353 2.155 10 10 CECE OCc1ccc(N2C[C@@H](O)CCC23CCC3)c(F)c1 2117888424 SEZARYASSDCBJB-LBPRGKRZSA-N 265.328 2.202 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3[C@@H]4CCO[C@@H]43)ccc21 2119807928 YRSLZWATCHPVQK-TUUVXOQKSA-N 259.349 2.137 10 10 CECE CN1CCc2cc([C@@H](O)C3CC4(COC4)C3)ccc21 2119973426 LJEXYWGTPCRUBI-OAHLLOKOSA-N 259.349 2.139 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)C1(C(F)(F)F)CC1 2122718079 DHTVVHKWQWNLAP-WDEREUQCSA-N 275.270 2.356 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)C1(C(F)(F)F)CC1 2122718071 DHTVVHKWQWNLAP-GHMZBOCLSA-N 275.270 2.356 10 10 CECE CCN([C@@H]1CCNC1)[C@H](C)c1cc(OC)ccc1O 221554595 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282.771 2.108 10 10 CECE CCOc1cccc(CN[C@H](C)[C@H]2CCCO2)c1O 20206655 UIQBECKHJRJDHA-DGCLKSJQSA-N 265.353 2.448 10 10 CECE C[C@@H](Sc1nncs1)C(=O)Nc1ccc(N)cc1 19846491 OGOLCAWVSUFBAP-SSDOTTSWSA-N 280.378 2.240 10 10 CECE C/C=C/CCNC(=O)c1ccn(-c2ccc(N)cc2)n1 161601511 AJOULXLPEXJAMX-NSCUHMNNSA-N 270.336 2.151 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC1(O)CCOCC1 162607393 AXLMTMCMQVASCA-QWHCGFSZSA-N 291.391 2.380 10 10 CECE CCNCc1ccc(OC)c(CN(C)[C@@H]2CCO[C@@H]2C)c1 158737174 YIFKMDSWVCFGSQ-CZUORRHYSA-N 292.423 2.414 10 10 CECE CN(c1ccc(CN)cc1C(F)(F)F)C1(CO)CC1 2128176239 FDYMOYRXVZFNQF-UHFFFAOYSA-N 274.286 2.125 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCC[C@H]3O)C[C@@H]1CO 2128279274 NVEFFJPHJKNUGK-NORZTCDRSA-N 261.365 2.121 10 10 CECE C[C@@H]1CCCN(c2ccc3c(c2)CC[C@@H]3O)[C@@H]1CO 2128316020 ZDUDRGRCUGXUCN-LYRGGWFBSA-N 261.365 2.263 10 10 CECE CO[C@@H]1C[C@H]2[C@H]1CCN2c1ccc2c(c1)CC[C@H]2O 2128315286 QCNKLWNBHJTLAL-QKPAOTATSA-N 259.349 2.280 10 10 CECE CC1CC(CO)(CN[C@@H](C)c2ccc(O)cc2O)C1 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C[C@H]1C[C@H]2C[C@](C(=O)N3CC[C@H](CN=[N+]=[N-])C3)(C2)O1 2342646635 MVYGPCSDYTTWMN-SRRSOLGSSA-N 264.329 2.103 10 10 CECE CSc1cc(N2C[C@@H](O)C[C@@H]2C(C)C)ccc1CN 2353857590 VVPVNWCLPJJMCN-UONOGXRCSA-N 280.437 2.463 10 10 CECE C[C@@H](N[C@H]1C[C@@H]2CC[C@@]1(CO)C2)c1cc(O)ccc1O 2354527681 VQHPHHWAZCQARI-OVTCNUJSSA-N 277.364 2.300 10 10 CECE C[C@@H](Cc1cc(O)c(O)c(Br)c1)[N+](=O)[O-] 2519310 KOPDFVBYXUMLCL-YFKPBYRVSA-N 276.086 2.068 10 10 CECE CN1CC[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)CC[C@@H]2O 2356172888 MPRPADRIQFCNIT-LXZKKBNFSA-N 272.392 2.339 10 10 CECE CCNC(=O)CN(CC)c1ccc(CNC2CC2)cc1C 50561863 KZNAEEBCXBUWBL-UHFFFAOYSA-N 289.423 2.209 10 10 CECE c1ccc(CNCCSc2nccs2)nc1 53646796 HHGHVJRNQXLWJB-UHFFFAOYSA-N 251.380 2.420 10 10 CECE COc1cccc(CNC(=O)c2nc(C)sc2C)c1O 179035042 BUMYGMMZSQXONW-UHFFFAOYSA-N 292.360 2.404 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2[C@@H]1[C@@H]1CC[C@H]2O1)c1cc(O)ccc1O 2356931970 RYULLPXOIYVWNK-RLHREDSESA-N 275.348 2.314 10 10 CECE Oc1ccc(Cl)cc1CN1CCN(C2CC2)CC1 127910061 IHCJVAYYCONRNK-UHFFFAOYSA-N 266.772 2.326 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@H](N)C[C@@]12CCOC2 2154542730 VWBAYADNGKLEFR-XNRPHZJLSA-N 276.380 2.035 10 10 CECE CC(C)CN(C(C)C)S(=O)(=O)Cc1ccc(N)cc1 44353614 UPKICECZVOHSMZ-UHFFFAOYSA-N 284.425 2.465 10 10 CECE COc1cc(N)c(N2CCC(CN(C)C)CC2)cc1OC 213741976 YYUSSDOPNFPVON-UHFFFAOYSA-N 293.411 2.064 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@H]2C[C@H]3CC[C@@H]2C3)c1 42174167 FSEIZOXYKWQUQK-CWSCBRNRSA-N 260.337 2.027 10 10 CECE CCN(CC(=O)N(C)C)c1ccc(CNC(C)C)cc1F 49024749 CNHCQLBHNISDJV-UHFFFAOYSA-N 295.402 2.238 10 10 CECE Cc1nc(NC(=O)c2ccc(O)c(O)c2)sc1C 226955206 XOJRAUUQXVWFLU-UHFFFAOYSA-N 264.306 2.423 10 10 CECE CCN[C@@](C)(CSc1nccs1)C(=O)OCC 45596149 CGZKYLUAIUYPEI-NSHDSACASA-N 274.411 2.167 10 10 CECE C[C@H]1C[C@H]1NCc1cc(O)cc(Br)c1O 380231216 LMEUETVUNLZVMT-QUBYGPBYSA-N 272.142 2.358 10 10 CECE CCSCc1noc(COc2ccc(N)cc2)n1 87105219 VREUJLWTYPNCJE-UHFFFAOYSA-N 265.338 2.484 10 10 CECE CCN[C@H](C)c1ccc(N2CCS(=O)CC2)c(F)c1 49691909 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CN1CCCc2cc([C@]3(O)CN[C@@H]4CCC[C@@H]43)ccc21 2163105495 JSMUGBSBCJEDGK-ZMSDIMECSA-N 272.392 2.029 10 10 CECE COC1(CN(C)c2ccc([C@@H](C)O)cc2[N+](=O)[O-])CC1 2167890539 RTCVPPPJMZAZMR-SNVBAGLBSA-N 280.324 2.263 10 10 CECE CCC[C@@H](CN)NC(=O)/C=C\c1ccc(N(C)C)cc1 701397929 BLOLQCGLJUOZSH-MSKHEQNASA-N 275.396 2.009 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C1=C(F)CNCC1 2167999485 PTGIPELEDYECQQ-SNVBAGLBSA-N 278.327 2.129 10 10 CECE CCOc1ccc(O)c(CNCC[C@H](O)C(F)(F)F)c1 809742648 CCGVUTANUZECDB-LBPRGKRZSA-N 293.285 2.194 10 10 CECE Oc1cccc(CN[C@H](C2CC2)[C@H]2CCCOC2)c1O 724006767 FSFCVDIYSQSTAO-DZGCQCFKSA-N 277.364 2.393 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@H](O)c3ccsn3)ccc21 2167132451 GCVCVAXVXWNPEI-CABCVRRESA-N 289.404 2.259 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc(C[C@H](C)N)c(C)c1)C2 2165444588 UICIXMYDONLGDE-YSVLISHTSA-N 274.408 2.357 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)CCC(N)=O)cc1 723151210 VJJRRGNZIDWSEP-LBPRGKRZSA-N 263.385 2.059 10 10 CECE O=C(O)/C=C\c1cc2scc(O)c2cc1CC(=O)O 725380787 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MSTVPJYVBUCMCM-ZCFIWIBFSA-N 251.616 2.009 10 10 CECE Cc1ccc(C)n1-c1ccc(C(=O)N2CC=C[C@@H]2CO)cc1 922256488 FHHYQBBSCJNJAX-QGZVFWFLSA-N 296.370 2.467 10 10 CECE COc1cc([C@@H](O)Cc2ccc(N)cc2)c(F)cn1 696495929 OVARKDLAYRQWBC-ZDUSSCGKSA-N 262.284 2.088 10 10 CECE O=C(NC[C@H]1CCN1C1CCCC1)c1cc(O)cs1 863032079 LFOMXJOXLWCQNS-LLVKDONJSA-N 280.393 2.200 10 10 CECE CCOc1cccc(CN(C)[C@@H]2CCN(C3CC3)C2)c1O 769327255 UUXJAAJEWCFGMZ-OAHLLOKOSA-N 290.407 2.459 10 10 CECE C[C@H]1CCN(c2ccc([C@@H](C)O)cc2F)C[C@]1(C)O 1876948247 RULAISMEFSXFCV-RWSFTLGLSA-N 267.344 2.476 10 10 CECE Nc1ccc(OCCNc2ccc(N)cc2F)cc1 1876230163 GWJPLQMUDDAJOY-UHFFFAOYSA-N 261.300 2.481 10 10 CECE C[C@@H](NC(=O)[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32)c1ccccc1O 1877584491 FLAQOYRPBCUTPF-FOFBYOGTSA-N 257.333 2.471 10 10 CECE Cc1ncn(CCNCc2c(O)cccc2F)c1C 1878851232 UVGUDCFOBHXGLP-UHFFFAOYSA-N 263.316 2.134 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC(=O)NCc1ccccc1 1882185559 KDKUBNNQWWKYSD-CYBMUJFWSA-N 273.340 2.078 10 10 CECE CCCNC(=O)CN(C)[C@H](C)c1ccc(F)cc1O 132972982 JPJXACILMHCNOR-SNVBAGLBSA-N 268.332 2.050 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CCN1C(=O)c2ccccc2C1=O 1880797678 RWBGCOWHRJQQND-LLVKDONJSA-N 299.334 2.057 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H]3C[C@H]2CO3)c(F)c1 1880960263 IHSAOUBJYFUHRT-MIMYLULJSA-N 268.307 2.352 10 10 CECE Cc1cc2nccc(NC(=O)c3ccc(C)c(O)c3O)n2n1 1148956457 KXCNIDLQPFOLRL-UHFFFAOYSA-N 298.302 2.010 10 10 CECE CCS[C@@H]1CCC[C@H]1NC(=O)Cc1ccc(O)c(O)c1 1149336899 QEGPNZIPEFPQQX-BXUZGUMPSA-N 295.404 2.431 10 10 CECE CCCNCc1ccc(N2[C@@H]3COC[C@H]2C3)c(F)c1 1899653422 DUIPNIQYBCWLAK-BETUJISGSA-N 264.344 2.303 10 10 CECE COc1cccc(CNC[C@H]2CC[C@H]3C[C@H]2CO3)c1O 897498293 NLTYBRLLOVVTMC-XBFCOCLRSA-N 277.364 2.306 10 10 CECE COC[C@@H]1C[C@H]1Nc1c(N)cccc1Br 1962225499 PGOGERWZJFDSLV-OIBJUYFYSA-N 271.158 2.478 10 10 CECE Oc1cc(Cl)ccc1CNCCOC[C@@H]1CCCO1 1964039686 YCZAWCWZAZYTKH-ZDUSSCGKSA-N 285.771 2.331 10 10 CECE CCNCc1c(Br)ccc(OC)c1O 1964019051 HQMASAYXLOIRGU-UHFFFAOYSA-N 260.131 2.273 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)N1CCCC[C@H]1C 249707587 KBAXFMHOEXPOQG-GFCCVEGCSA-N 297.424 2.214 10 10 CECE O=C(O)C[C@@H]1CCCN1Cc1cc(Cl)ccc1O 86790603 RUJGUJSBCYKZRC-NSHDSACASA-N 269.728 2.485 10 10 CECE Cn1cncc1CCNCc1ccc(Cl)cc1O 1964032055 FQIADHMFJDVLPS-UHFFFAOYSA-N 265.744 2.111 10 10 CECE COc1cc(C(=O)N(C)[C@H](C)c2ccccc2O)on1 704815951 XZHYGMBZOHCFQP-SECBINFHSA-N 276.292 2.222 10 10 CECE CN(Cc1ccccc1)[C@@H](CN)c1ccc(O)c(O)c1 59108473 FEJWSXANDRPEHG-AWEZNQCLSA-N 272.348 2.230 10 10 CECE NC[C@@H]1CCCN1Cc1c(O)cccc1Br 706851984 DWUHGXSOAVCCQO-VIFPVBQESA-N 285.185 2.078 10 10 CECE Oc1cccc(Cl)c1CN1C[C@H]2CC[C@H]1[C@@H]1CNC[C@H]21 709965162 RYLOJNCAJBHWSZ-BLTAXRJOSA-N 292.810 2.475 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2Cc1nccn1C 689359215 GSYNLXVVASXYBZ-GFCCVEGCSA-N 270.380 2.393 10 10 CECE C[C@@H]1[C@H](N)CCN(c2ccc3c(c2)CN(C)C3)[C@@H]1C 689491095 JOCAAAYBJWAGTF-HWWQOWPSSA-N 259.397 2.194 10 10 CECE CNc1nc(CSc2nccs2)nc2c1cnn2C 63083983 UKCHAJFURNEFAR-UHFFFAOYSA-N 292.393 2.154 10 10 CECE COC(=O)[C@](C)(Cc1ccsc1)NCCN=[N+]=[N-] 689917320 SVBGGUGEMUMXNW-NSHDSACASA-N 268.342 2.122 10 10 CECE C[C@H](NCC[C@H](O)C(F)(F)F)c1ccc(O)cc1O 717351970 UZLNXPQJWPFBKS-CPCISQLKSA-N 279.258 2.062 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21 693168018 SIWFXFDNWNPNQT-IMJJTQAJSA-N 274.408 2.439 10 10 CECE COc1ccc([C@H](C)NCc2ncc(C)[nH]2)c(O)c1 693479839 UUJVZWAXHWSWBQ-JTQLQIEISA-N 261.325 2.283 10 10 CECE CNCc1cc(F)c(N2CC[C@H](C(C)(C)O)C2)c(F)c1 721834028 REOPJPHDNBLCTQ-NSHDSACASA-N 284.350 2.281 10 10 CECE CO[C@H](COC(=O)c1cccc(O)c1O)C1CCC1 1330196466 WZZLXQDJHFLKBF-GFCCVEGCSA-N 266.293 2.070 10 10 CECE CN1CCCc2cc(CN[C@H](C(=O)O)C3CC3)ccc21 86758254 STCKKEQLWXHYGC-HNNXBMFYSA-N 274.364 2.022 10 10 CECE Cc1cc(C(=O)N(C)[C@@H](C)c2ccccc2O)n(C)n1 90121620 KLRUNRMCGWFOAS-NSHDSACASA-N 273.336 2.267 10 10 CECE C[C@H](NC(=O)[C@H]1Cc2cccnc2C1)c1ccccc1O 1348992331 ABCVYPGLAGGMON-AAEUAGOBSA-N 282.343 2.379 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@](C)(N)CC(F)(F)F)cc1 2118480897 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HTULRHGQLNQZGP-LSDHHAIUSA-N 276.380 2.227 10 10 CECE C[C@H]1CC[C@@H](CO)CN1c1ccc([C@@H](C)N)cc1F 688707319 ZELVOHDYEMASNQ-QJPTWQEYSA-N 266.360 2.443 10 10 CECE C[C@H](O)c1ccc(N2CCC(=O)N(C)CC2)c(Cl)c1 688914985 LDUWVSAPAOCPTB-JTQLQIEISA-N 282.771 2.062 10 10 CECE Nc1ccc(OCCCN2C[C@@H]3[C@@H](C2)C3(F)F)cc1 715407374 CZQLYIIZFGPRRX-CHWSQXEVSA-N 268.307 2.235 10 10 CECE COC[C@@H](C)Oc1ccc(N2CCC[C@H](N)C2)c(F)c1 87439546 BBEYUFREFXUJOJ-NEPJUHHUSA-N 282.359 2.167 10 10 CECE Cc1cc(CO)ccc1N(C)Cc1nccnc1C 699537320 NNHZRIGNRPCMOJ-UHFFFAOYSA-N 257.337 2.222 10 10 CECE CCNCc1cc(F)c(N2CC3(CCO3)C2)c(F)c1 2115163075 RSERGFUMOQBQLK-UHFFFAOYSA-N 268.307 2.053 10 10 CECE CCNCc1ccc(N2C[C@@H]3CCO[C@H]3C2)cc1C 2115406812 MHQPMNCMJQWZTG-HOCLYGCPSA-N 260.381 2.330 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2C=C[C@@H](OC)C2)c1O 2119393502 KNJFITOXAXADCW-VXGBXAGGSA-N 283.755 2.487 10 10 CECE COc1ccc(N(CCO)CC(F)F)cc1Cl 2214338328 QWBWDUIRCRDQQP-UHFFFAOYSA-N 265.687 2.412 10 10 CECE C[C@@]1(C(F)F)C[C@H]1CNC(=O)c1ccc(O)c(O)c1 2120899580 OTWVGRNRMIZKNE-ISVAXAHUSA-N 271.263 2.119 10 10 CECE CC[C@@H]1CN(c2ccc(CNC)c(C)c2)CCN1C 104129738 CYUQTUGNIJMRRB-OAHLLOKOSA-N 261.413 2.245 10 10 CECE CN[C@]1(C)CCCN(c2ccc(OC)c(OC)c2)C1 217108407 QZPJAUSJASBLOT-OAHLLOKOSA-N 264.369 2.282 10 10 CECE CCc1cc(N2CCCNCC2)ccc1OCCF 1890650922 MLSAGAKCLROIQZ-UHFFFAOYSA-N 266.360 2.397 10 10 CECE C[C@@H]1CCCC[C@@]12CC(=O)NN2C(=O)c1cc(O)cs1 1557486323 FRTVAEBYAHGIRK-YMTOWFKASA-N 294.376 2.280 10 10 CECE CCc1ncc(C(=O)NCc2cc(O)ccc2O)s1 1633595098 IFRACVBYCAHEJQ-UHFFFAOYSA-N 278.333 2.047 10 10 CECE COC(=O)[C@@](C)(NCCN=[N+]=[N-])c1cccs1 1912192696 JEEURPNANGLVPB-JTQLQIEISA-N 254.315 2.036 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])C1(OC(C)C)CC1 1912206345 JHJUHAMSTZEUSJ-LLVKDONJSA-N 284.360 2.166 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@H]2CF)c(F)c1 2126208023 RGXHRFKIFVHDBU-ZYHUDNBSSA-N 270.323 2.281 10 10 CECE COc1ccc(CC(=O)N2CC[C@@H](CN=[N+]=[N-])C2)cc1 1912198041 BNMSAAILIIKANA-LBPRGKRZSA-N 274.324 2.397 10 10 CECE [N-]=[N+]=NCC1CCN(C[C@@H]2[C@@H]3CCOC[C@@H]32)CC1 1912187108 FKZXQNBWPJDHBB-XQQFMLRXSA-N 250.346 2.291 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@@H]2C[C@H]3COC[C@H]3O2)C1 1912149144 BRHLQJRTINQGPU-XDQVBPFNSA-N 280.372 2.203 10 10 CECE CC(C)(C)S(=O)(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1912188310 NSVFPCFQYHPTSL-SECBINFHSA-N 260.363 2.137 10 10 CECE OCC[C@H]1CCN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128271734 DLYCILGCBJJZPV-WBMJQRKESA-N 261.365 2.265 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H]2CCO[C@H]2C1 2128438166 UILGQTWUZANTIV-SUNKGSAMSA-N 263.337 2.270 10 10 CECE O=C(O)[C@@H](NCc1cccs1)c1ccccc1O 166129974 UUEPTAFHXJGQRG-LBPRGKRZSA-N 263.318 2.369 10 10 CECE CN[C@H](c1ccccc1O)c1ccncc1COC 2129379033 UQHUFKHZBDUOBC-HNNXBMFYSA-N 258.321 2.242 10 10 CECE CN(C)c1ccc2nc(CCc3ccc(N)cc3)[nH]c2n1 157871508 CGMRFSQYJWEPSX-UHFFFAOYSA-N 281.363 2.391 10 10 CECE CCCOc1ccc(N2CC[C@@H](CNC[C@H](C)O)C2)cc1 250220931 VYRKVTZRIPHMRE-GJZGRUSLSA-N 292.423 2.272 10 10 CECE Nc1ccc(CN2CC[C@@]3(C(=O)O)CCC[C@@H]23)cc1 1891967174 YQPRCYBAKQQBRA-HIFRSBDPSA-N 260.337 2.098 10 10 CECE C[C@H](NC(=O)C[C@H](N)C(C)(C)C)c1ccccc1O 1122114473 KCBYXADTFDEYQN-GWCFXTLKSA-N 264.369 2.333 10 10 CECE CNCc1ccc(N2CC[C@H]3[C@@H](CCCN3C)C2)cc1 220942239 FBIBQIVCRQZKES-RDJZCZTQSA-N 273.424 2.327 10 10 CECE CCN[C@@H](C)c1ccc(N2CCO[C@@H](CO)C2)c(Cl)c1 221134431 PGLFBBJPTVDRMC-WCQYABFASA-N 298.814 2.208 10 10 CECE CN[C@@H](C)c1ccc(N2CCC3(COC3)C2)c(F)c1 1915840785 YINPGFYBBOYKLA-NSHDSACASA-N 264.344 2.333 10 10 CECE CN[C@@H](C)c1ccc(N2CC(COC)C2)c(F)c1 1916895523 ZMOGLGANBAUQFJ-JTQLQIEISA-N 252.333 2.189 10 10 CECE Cc1cc(N2[C@H]3CCC[C@H]2CC(O)C3)ccc1CO 1922769913 SFXWMBZJVXMJAS-KBPBESRZSA-N 261.365 2.370 10 10 CECE Nc1ccc(CC(=O)NCC2CC3(C2)CC3(F)F)cc1 1967263177 FOHUPFDZUHXTES-UHFFFAOYSA-N 280.318 2.363 10 10 CECE CC[C@H](CCN)CCC(=O)NCc1ccccc1O 228421723 CJJNTECLXJWNOE-LBPRGKRZSA-N 264.369 2.164 10 10 CECE CC(C)[C@@H](C(=O)O)[C@](C)(N)c1ccc(N(C)C)cc1 1927639512 JIPBITAABRYXSW-DZGCQCFKSA-N 264.369 2.283 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@]12CCC[C@@H](CC1)N2 1968865508 MZHQKECKSGIZMV-XJKSGUPXSA-N 274.364 2.025 10 10 CECE CCN(CCCc1ccc(N)cc1)CC(=O)NC(C)C 122650713 SQGPOPSYMARNKU-UHFFFAOYSA-N 277.412 2.048 10 10 CECE Cc1cc(N2CC[C@](C)(O)C2)ccc1CNC(C)C 232726199 QJNMNZKGISWWIT-INIZCTEOSA-N 262.397 2.454 10 10 CECE Nc1ccc(OCc2cn(CC3CC(F)C3)nn2)cc1 1968188845 YLWNLAGCHQVIFM-UHFFFAOYSA-N 276.315 2.187 10 10 CECE C[C@]1(N)CCCN(Cc2c(O)cccc2Br)C1 1940607199 ZGBZCEYLBHQCJH-ZDUSSCGKSA-N 299.212 2.468 10 10 CECE C[C@H](O)c1ccc(N2[C@H](CO)C[C@H]3OCC[C@H]32)cc1Cl 2146695815 VIYUODTXTJEAND-YZENIEGJSA-N 297.782 2.122 10 10 CECE OCc1ccc(N2C[C@H]3CO[C@@H](C3)C2)c(Cl)c1 1946910873 UVWSBZFMMRRGMW-QWRGUYRKSA-N 253.729 2.057 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)C2CCC2)CC1 1949759245 ZHKWDMNTEUUCSH-SECBINFHSA-N 258.347 2.034 10 10 CECE COc1ccc(N2C[C@H](C)[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])c1 2149522749 HBZCEMYHLTUYDJ-BHDSKKPTSA-N 280.324 2.199 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N(C)[C@H](CN)C1CC1 253170978 IBIFUDKQGCSWCX-MLGOLLRUSA-N 261.413 2.483 10 10 CECE C[C@H]1C[C@@H]2C(=O)N(c3ccc(N)c(Cl)c3)C(=O)[C@@H]2C1 253149294 CFOLVJCCPWLBFH-SLGCYQGISA-N 278.739 2.458 10 10 CECE COc1ccc(CNC2C[C@H](C)N(C)[C@@H](C)C2)c(O)c1 1972441602 JXWLOQXGGFBFKU-RYUDHWBXSA-N 278.396 2.362 10 10 CECE Oc1ccc(CN[C@@H]([C@@H]2CCOC2)C(F)(F)F)cc1O 2143637146 BRRYIKNJLHCUIQ-SKDRFNHKSA-N 291.269 2.155 10 10 CECE C[C@H](NCc1cc2c(cc1O)OCO2)[C@@H]1CC1(F)F 1972720719 RYEAYECHYCCELA-CBAPKCEASA-N 271.263 2.254 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@](CN)(C2CC2)C1 2149602281 PKYIUNKCPAPXKU-BDJLRTHQSA-N 276.380 2.220 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@@H](C(=O)N(C)C)C2)cc1 2143703831 UHEYNUFRDQUDBB-UKRRQHHQSA-N 275.396 2.011 10 10 CECE C[C@H]1C[C@@H](CNCc2ccc3c(c2)CCCO3)CN1C 2143831887 RJOZGZGANOMSNA-ZFWWWQNUSA-N 274.408 2.441 10 10 CECE CN=c1nc(Sc2nccs2)c(C)c(C)[nH]1 1975879251 LGEHBFXRGCLYLK-UHFFFAOYSA-N 252.368 2.165 10 10 CECE Oc1cccc2c1[C@H](NC[C@@H]1C[C@H]3O[C@H]1[C@@H]1C[C@@H]31)CC2 2144067358 BZXKIOQOJPFZRM-QECLRCNSSA-N 271.360 2.393 10 10 CECE Cc1ccnc(Sc2ncc([C@H](C)O)s2)n1 1976520939 JWQRXRFKFIDNBE-ZETCQYMHSA-N 253.352 2.446 10 10 CECE CC(C)(C)n1nccc1[C@H](O)[C@H](N)c1ccccc1O 2149842146 JWXWFNMYEFUOTJ-KGLIPLIRSA-N 275.352 2.077 10 10 CECE O=C(O)c1ccc(CNCCc2ccc(O)c(O)c2)s1 2148004967 RWLAMWKHDXHNRV-UHFFFAOYSA-N 293.344 2.190 10 10 CECE C[C@H](N[C@H]1CCO[C@@]12CCOC2)c1cc(F)ccc1O 2144690785 DJQKUEAYXZXVOB-NZVBXONLSA-N 281.327 2.130 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@](O)(C(C)C)C2)cc1O 2150763402 IFJPLUQXMOCCMZ-LRDDRELGSA-N 278.396 2.270 10 10 CECE Cc1nc(C(=O)NCCOc2ccc(N)cc2)c(C)s1 2144802092 AGHYWYZYSBPVEH-UHFFFAOYSA-N 291.376 2.151 10 10 CECE CN(c1ccc(CN)c(C(F)(F)F)c1)[C@@H]1CCOC1 158092550 IVVFYTKRQIKBSV-LLVKDONJSA-N 274.286 2.389 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)[C@H](C)C1CC1 36782984 AMYZCONXULEYLJ-MNOVXSKESA-N 261.369 2.326 10 10 CECE CCc1nnc(N2CCN(c3ccc(N)cc3)CC2)s1 2145872127 KMCPSHDGTAJVGR-UHFFFAOYSA-N 289.408 2.009 10 10 CECE Cc1nccn1CCN1CCc2cc([C@@H](C)N)ccc21 162089388 RIGGXLLEICHXRB-GFCCVEGCSA-N 270.380 2.274 10 10 CECE Nc1ccc(NC(=O)NCCc2cccnc2)cc1 37718624 BMOZZMALCJVNMJ-UHFFFAOYSA-N 256.309 2.028 10 10 CECE Cc1cc(N2C[C@@H]3C[C@@H](O)[C@H]3C2)ccc1CNC(C)C 2151395379 CUBUHTKQUDBQFU-BHYGNILZSA-N 274.408 2.310 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCC[C@@](C)(F)C3)cc21 2152232178 QZYIFQRSHLMLBP-UKRRQHHQSA-N 278.327 2.025 10 10 CECE COc1cc2c(cc1OC)N(C[C@H]1OCC[C@@H]1C)CC2 2152448887 BILXZYRFKFIDOQ-MEDUHNTESA-N 277.364 2.491 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@@H]2CCCCS2)CC1 2006020017 CZEVRTOKQMCKEK-VIFPVBQESA-N 254.359 2.479 10 10 CECE CP(C)(=O)CCCNCc1cccc(O)c1O 2008073510 JSLXSSMYOHAQRS-UHFFFAOYSA-N 257.270 2.200 10 10 CECE CC[C@]1(C)CC[C@H](CNC(=O)c2ccc(O)c(O)c2)O1 2153961932 OHCSHNQXWSJYNZ-IAQYHMDHSA-N 279.336 2.175 10 10 CECE CCN(C)[C@H]1CCN(c2c(F)cc(CNC)cc2F)C1 2154002104 ARDRJRGKGAHGGT-LBPRGKRZSA-N 283.366 2.215 10 10 CECE Oc1c(F)cc(F)cc1CN1CCN2CCCC[C@H]1C2 2154251190 JPTYHIHKOXJKML-ZDUSSCGKSA-N 282.334 2.341 10 10 CECE CN(C)c1ccc([C@H](N)c2ccc(C(=O)O)cc2)cc1 2154665571 SUXXLTUOQRJYNY-OAHLLOKOSA-N 270.332 2.499 10 10 CECE CCN(C[C@@H](O)c1ccccn1)c1ccc(CN)cc1 2155633630 JHKBDOLZOYTWJC-MRXNPFEDSA-N 271.364 2.100 10 10 CECE CN(Cc1ccc(N(C)C)cc1)Cc1cnsn1 2026950823 BTZHTCJDHCXUPE-UHFFFAOYSA-N 262.382 2.236 10 10 CECE CN[C@H](c1ccccc1O)[C@](C)(O)[C@@H]1CCSC1 2031155428 WVTAFNHTZTVGAY-LERXQTSPSA-N 267.394 2.157 10 10 CECE OCc1ccc(N2CC[C@H]3[C@@H](C2)C3(F)F)c(F)c1 2034638932 WJQOOSHCUCJSQW-VHSXEESVSA-N 257.255 2.409 10 10 CECE C[C@H]1CCN(CCOc2ccc(N)cc2)C[C@@H]1F 2034813204 FEPQRTBPAHGOLF-FZMZJTMJSA-N 252.333 2.328 10 10 CECE COc1csc([C@H](O)c2ccc(N(C)C)cc2)n1 2036346819 HMJLIUJIFUXMGJ-GFCCVEGCSA-N 264.350 2.299 10 10 CECE OCc1ccc(N2CC(F)(F)C[C@@H]2CO)c(Cl)c1 2041126094 AKKAGPMSKRCHFI-SECBINFHSA-N 277.698 2.039 10 10 CECE COCC[C@@H](COC)N[C@H](C)c1ccc(OC)cc1O 312783662 IASYTNCAESFSRB-NEPJUHHUSA-N 283.368 2.103 10 10 CECE CC[C@@H](N)c1ccc(N2CCC[C@H](S(C)(=O)=O)C2)cc1 312849453 QECWIZOAVWJGFV-LSDHHAIUSA-N 296.436 2.110 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1C[C@@H]2NCCc1ccc(O)c(O)c1 2158624940 QOUVSEJSSVTUQO-DVZHBHJUSA-N 277.364 2.043 10 10 CECE CCN(CCOc1ccc(N)cc1)C1CCN(C)CC1 2158714406 VOOGQGGVKAFNHL-UHFFFAOYSA-N 277.412 2.064 10 10 CECE CCCN1CC[C@@H](N(C)c2ccc([C@@H](C)N)c(O)c2)C1 2160078271 HGPIFDURZAFYHX-TZMCWYRMSA-N 277.412 2.332 10 10 CECE CC[C@H](NC(=O)CCOc1ccc(N)cc1)C1CC1 323795225 FDNFGYCJLMXAKS-AWEZNQCLSA-N 262.353 2.343 10 10 CECE COc1nsc(OC)c1CNCc1c(O)cccc1F 2160777229 YUCUWCPBQUPWAN-UHFFFAOYSA-N 298.339 2.295 10 10 CECE COc1cccc(O)c1CN1CCCC[C@H]1CN(C)C 2160728478 MHRBMONKHIJCRR-ZDUSSCGKSA-N 278.396 2.317 10 10 CECE CN(C[C@@H]1C[C@H]2C[C@@H]2CO1)c1ccc(CN)c(F)c1F 2179417799 GLRUQRNYSCCNEE-UTUOFQBUSA-N 282.334 2.285 10 10 CECE COc1ccc(N2CCCN[C@H](C3CC3)C2)cc1F 86287061 FZTVRHCSTXACFY-AWEZNQCLSA-N 264.344 2.413 10 10 CECE Nc1ccc(CN(C(=O)NCC2CC2)C2CC2)cc1 700991014 DRHRYHPWNUHBSX-UHFFFAOYSA-N 259.353 2.353 10 10 CECE CNCc1ccc(N2CCC[C@H]2[C@@H]2CCCN2C)cc1 2171531208 KAMPKNIRGPWGAW-IRXDYDNUSA-N 273.424 2.469 10 10 CECE Nc1ccc(CCN2CCOC[C@H]2c2ccco2)cc1 2171689316 XRPNNKHXOHZCHC-HNNXBMFYSA-N 272.348 2.478 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H](C4CC4)C3)ccc21 2171643827 BFCCYCUTHJWCNQ-NHYWBVRUSA-N 271.364 2.265 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@@H]4CC=CC[C@H]43)c(Cl)cc21 2177145819 DYYAXSLOBWOZGJ-PELMWDNLSA-N 289.766 2.447 10 10 CECE Cc1oc(CN(C)c2ccc(CN)cc2)cc1C(=O)O 2162690061 OKUMAZCAHNTQNF-UHFFFAOYSA-N 274.320 2.381 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@@H]1C[C@@H]2C[C@@H]2C1 2172202456 SQEQXYGTSPWDKD-NJNCZSALSA-N 274.408 2.420 10 10 CECE Cc1cc(O[C@H]2CCCO2)ccc1N1CCC[C@H](N)C1 686715946 FBMCATXTTWXZAB-BBRMVZONSA-N 276.380 2.438 10 10 CECE C[C@H](N)[C@@H]1CCCCN1Cc1cc(F)cc(F)c1O 708494630 NBAAYWCUVPMOLI-ZANVPECISA-N 270.323 2.372 10 10 CECE CC[C@H](N[C@@H]1CCN(C2CC2)C1=O)c1ccccc1O 708696039 NFQMEKSOHRACOX-UONOGXRCSA-N 274.364 2.196 10 10 CECE CCNCc1ccc(N2C[C@@H](C)C(O)[C@H](C)C2)c(F)c1 688058997 FUOVEXIRXLOLJZ-VXGBXAGGSA-N 280.387 2.388 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H]3CNCC3(C)C)ccc21 2163063598 RMSOKJCMVBLNJI-GDBMZVCRSA-N 274.408 2.348 10 10 CECE COc1ccc(O)c(CNC[C@H]2CCN2C(C)(C)C)c1 690393824 QPKKQVNYLDTKJO-CYBMUJFWSA-N 278.396 2.363 10 10 CECE C[C@@H]1CSCCN(c2ccc([N+](=O)[O-])c(CO)c2)C1 379498824 UMNPXUQLZQTXFO-JTQLQIEISA-N 282.365 2.276 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC4(CCCC4)C3)ccc21 380055446 DJZLXDFQDMDPIX-CQSZACIVSA-N 271.364 2.409 10 10 CECE Nc1ccc(CCN=c2c(Cl)c[nH]cc2[N+](=O)[O-])cc1 380188619 PASYTXSZZQBBHP-UHFFFAOYSA-N 292.726 2.302 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@](C)(CO)C1 381331052 BLCWENQWLZKJML-KRWDZBQOSA-N 274.408 2.456 10 10 CECE CCC1(CC)CN(c2cc3c(cc2N)OCC(=O)N3)C1 383790134 VKGJEEIJXGORFC-UHFFFAOYSA-N 275.352 2.226 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H](CO)C2CCC2)c1 717603077 GFPXSALDKRKEBI-IINYFYTJSA-N 265.353 2.212 10 10 CECE CNCc1ccc(N2CC[C@H](CO)[C@H]2C)cc1Cl 385684471 OGZGJNJJXWSIRS-ZYHUDNBSSA-N 268.788 2.267 10 10 CECE Cc1cc(CO)ccc1N(C)Cc1cnc2n1CCC2 719350476 AWTTZPDSABZYQM-UHFFFAOYSA-N 271.364 2.266 10 10 CECE Nc1ccc(NC(=O)N2CCOCC23CCCC3)cc1 388540670 VHVXJVPXBVZJCH-UHFFFAOYSA-N 275.352 2.446 10 10 CECE CC1(C)C[C@@H](O)CCN(c2ccc(CN)c(F)c2)C1 395474316 YVFDCBMXQWWNAL-ZDUSSCGKSA-N 266.360 2.272 10 10 CECE COC[C@@H]1CN(c2ccc([C@@H](C)O)cc2)CC(C)(C)O1 2177795124 ZSQZWIXPHPHHQQ-DOMZBBRYSA-N 279.380 2.370 10 10 CECE CC[C@@H](COc1ccc(N2CCNCC2)c(F)c1)OC 397052269 RQGVLZNKPLNQSS-LBPRGKRZSA-N 282.359 2.039 10 10 CECE C[C@H](NC[C@]1(C)CCOC1)c1cc(O)ccc1O 397314322 SXTCFUQYOJJNBB-HZMBPMFUSA-N 251.326 2.175 10 10 CECE CN(CCC(C)(C)C)c1cc2c(cc1N)OCC(=O)N2 399703285 JJSYEVHAUPZVSU-UHFFFAOYSA-N 277.368 2.472 10 10 CECE CCN1CC[C@H](N(CC)Cc2cc(OC)ccc2O)C1 822250123 MMSFPSMNYCXFTA-AWEZNQCLSA-N 278.396 2.317 10 10 CECE COC[C@]12C[C@@H]1CN(CCCOc1ccc(N)cc1)C2 2165477013 UKOMBHADRZLALC-CZUORRHYSA-N 276.380 2.006 10 10 CECE COc1cccc(O)c1[C@H](C)N[C@H]1CCn2ccnc2C1 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JMENLPKNUQKITC-SECBINFHSA-N 262.309 2.015 10 10 CECE CN1CCc2cc([C@@H](O)CC(F)(F)CCN)ccc21 2122020611 GZZRNSNUMATCDY-ZDUSSCGKSA-N 270.323 2.087 10 10 CECE CC[C@H]1CN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](CC)CO1 1639936595 IOVRYAAUFLJHKP-STQMWFEESA-N 293.363 2.056 10 10 CECE CCN(CC1(O)CCC1)c1c(F)cc(CN)cc1F 2124793941 XNJGCHASVCJDJS-UHFFFAOYSA-N 270.323 2.165 10 10 CECE CCCn1ncnc1CNCc1cccc(CC)c1O 1875422629 XVWSIBCLPSCESM-UHFFFAOYSA-N 274.368 2.246 10 10 CECE O=C(NCc1cc(O)ccc1O)c1csc(Cl)n1 1651225519 NBHLOPLESKWBKP-UHFFFAOYSA-N 284.724 2.138 10 10 CECE COc1ccccc1NC(=O)CCN(C)CCN=[N+]=[N-] 1912146214 QLLGWMIGAZYHGQ-UHFFFAOYSA-N 277.328 2.266 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cnccc1C(F)(F)F 1912161476 KBHXIUWPSGEQLU-UHFFFAOYSA-N 273.218 2.483 10 10 CECE CN1CCC[C@H]1C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 1912165576 MLMZLKUDAOAZBY-RYUDHWBXSA-N 265.361 2.020 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1S(=O)(=O)C1CC(C(F)F)C1 1912207100 JNSLPNLINQFYFK-QJAFJHJLSA-N 294.327 2.135 10 10 CECE CC[C@H](NCc1ccc(OC)cc1O)c1ncc[nH]1 138757359 CADQQUIMJQTNFO-LBPRGKRZSA-N 261.325 2.365 10 10 CECE CN1C[C@H]2C[C@H](NCc3c(O)cccc3F)CC[C@H]2C1 1966017244 QZDKMMIROOBYHF-YNEHKIRRSA-N 278.371 2.351 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCN2CCC[C@H]12 161075776 WGTDSLMIPGHVFU-UONOGXRCSA-N 289.379 2.094 10 10 CECE Nc1ccc(COc2nc(Cl)ncc2[N+](=O)[O-])cc1 2128245277 POZHKGZKNCTFDZ-UHFFFAOYSA-N 280.671 2.199 10 10 CECE CCN[C@@H]1CCc2cc(N3CC4(CCO4)C3)ccc21 2128293113 CIMOJLGAGOTJEU-OAHLLOKOSA-N 258.365 2.263 10 10 CECE CCN[C@H]1CCc2cc(N3CC(C)(CO)C3)ccc21 2128315784 WIWZEMYICXMAJX-HNNXBMFYSA-N 260.381 2.102 10 10 CECE Nc1ccc(CC(=O)[C@H]2CCOC3(CCOCC3)C2)cc1 166809334 FNJDMCYQQHUUGY-AWEZNQCLSA-N 289.375 2.356 10 10 CECE C[C@H](Oc1ccc(N)cc1)C(=O)N1CCCC[C@H]1C 1860082935 YHKJSBITVBHTPL-NEPJUHHUSA-N 262.353 2.437 10 10 CECE CCOc1ccc(-c2cc(O)nc(O)c2C#N)cc1 259158026 GDUUAFGDDUNLHV-UHFFFAOYSA-N 256.261 2.430 10 10 CECE O=C(CN1CC[C@@H]2CC[C@H]2C1)c1ccc(O)c(O)c1 2131874356 LEXJRAYJWHYNON-JQWIXIFHSA-N 261.321 2.012 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](OC)[C@H]2C)c(F)c1 1914271731 JXGXXWYKLHBPKL-NOZJJQNGSA-N 270.323 2.298 10 10 CECE CCOc1cccc(CN2CC[C@H](OC)[C@@H]2C)c1O 1914345301 DQBHDXIRBCXHCM-AAEUAGOBSA-N 265.353 2.400 10 10 CECE COCCN(c1ccc([C@H](C)N)cc1F)[C@@H](C)COC 109570181 GHLTWXVIPJHKOB-RYUDHWBXSA-N 284.375 2.333 10 10 CECE Cc1c(N(C)c2cccnc2)ccnc1C[C@H](C)N 2140750102 BKKXDBVYAYPLIY-NSHDSACASA-N 256.353 2.443 10 10 CECE CN(CC(=O)N(C)c1ccc(N)cc1)C[C@@H]1CC1(C)C 1915578867 DBXSIXKDHFEIJB-LBPRGKRZSA-N 275.396 2.210 10 10 CECE CCCN(CCCOc1ccc(N)cc1)C1COC1 1915732697 ZXAGJQAHMZTTKU-UHFFFAOYSA-N 264.369 2.149 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@](F)(CO)C2)cc1 1917057752 BMBFGGCIMHDQGZ-UONOGXRCSA-N 252.333 2.007 10 10 CECE CCN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1917661101 MALQCTIFJAOEJR-GANXNMSLSA-N 273.376 2.450 10 10 CECE CN(C)[C@H]1CCC[C@@H]1NCc1cccc(F)c1O 1922033438 LJBOISCJNLFYLO-STQMWFEESA-N 252.333 2.104 10 10 CECE O=C(O)[C@@H]1[C@H](C2CC2)CCN1Cc1ccccc1O 1968212984 ZSHDHIUOAGIJTH-JSGCOSHPSA-N 261.321 2.077 10 10 CECE CN(C)c1ccc([C@H](CN)N2CC[C@@H]3CC[C@H]32)cc1 1923959248 BSZXNLGIOSWARS-IMJJTQAJSA-N 259.397 2.237 10 10 CECE CC[C@@]1(C)COCCN1c1ccc(CN)c(OC)c1 2139684849 BRBXPNBGEBLUHR-HNNXBMFYSA-N 264.369 2.159 10 10 CECE CC(C)CCN(C)C(=O)[C@H]1CNc2ccccc2N1 229878413 NERHTLCWNCBGAP-CQSZACIVSA-N 261.369 2.397 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@H]1OCC[C@H]1C 122222733 NAFWSKVUMNSSGQ-DOMZBBRYSA-N 276.380 2.432 10 10 CECE C[C@H](N)c1ccc(N(CCO)CC(F)(F)F)c(F)c1 231323552 HGPQSHWGNHJMCF-QMMMGPOBSA-N 280.265 2.206 10 10 CECE Oc1cc(F)ccc1CNCCO[C@@H]1CC1(F)F 1967794143 PSQMUHKPWZCBMS-LLVKDONJSA-N 261.243 2.045 10 10 CECE OC[C@H]1CC[C@H](NCc2cc(Cl)ccc2O)C1 1942375591 QNPXPFPMCAIPRO-CABZTGNLSA-N 255.745 2.296 10 10 CECE C[C@H](NCc1cnc(N(C)C)s1)c1c(O)cccc1O 2149554178 KWWTWKDVDGOPKD-VIFPVBQESA-N 293.392 2.471 10 10 CECE C[C@@H]1CC[C@@H](C(=O)NCc2ccccc2O)S1 1946368235 MAJIMDIKKMEBEX-SKDRFNHKSA-N 251.351 2.293 10 10 CECE Oc1cc(Br)ccc1CN1CCCC12CNC2 1946766671 HSAMLTPQXJLSBF-UHFFFAOYSA-N 297.196 2.093 10 10 CECE CSCC[C@@H](C)NC(=O)CCOc1ccc(N)cc1 128981306 ULVHEIUVBKORNW-LLVKDONJSA-N 282.409 2.296 10 10 CECE NCc1ccc(N2CC[C@@]3(CCO3)C2)cc1Cl 1947807289 QBCRXRYGDFIKSI-CYBMUJFWSA-N 252.745 2.168 10 10 CECE CCc1nc(CN2CCc3cc(N(C)C)ccc32)no1 2143420228 VFIHTEWMJFQJJN-UHFFFAOYSA-N 272.352 2.261 10 10 CECE CN(C)c1ccc([C@H]2NCCCC[C@H]2O)cc1F 1952044847 RDIZQDJMCUMGDT-ZIAGYGMSSA-N 252.333 2.067 10 10 CECE CCN1CCC(N(C)C(=O)Nc2ccc(N)cc2)CC1 42689682 XVIDXNMFLGAKLX-UHFFFAOYSA-N 276.384 2.217 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cnn(-c2ccccc2)c1 42013103 IGBBFSRUJXNQGS-UHFFFAOYSA-N 270.296 2.303 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CCN(C)[C@H]3C[C@H]32)c1O 1972898306 YHKKZGWQDGVHSB-UONOGXRCSA-N 294.782 2.137 10 10 CECE Cc1cc([C@@H](N)CC(=O)O)c(O)c(C(C)(C)C)c1 258674462 PGBNKIYUJZYQFV-NSHDSACASA-N 251.326 2.473 10 10 CECE C[C@H]1CCC[C@H](NC(=O)NCc2cc(N)ccc2O)C1 2144838818 RWDJTLWTMHHUHG-GWCFXTLKSA-N 277.368 2.352 10 10 CECE Nc1ccc(OCCNC(=O)c2ccc(F)cc2)cc1 32120872 QTHJJTBSEUHUJS-UHFFFAOYSA-N 274.295 2.217 10 10 CECE CCOC(=O)CCC1=N[C@@H](c2ccccc2O)CO1 260840818 OLMZZWPFFITRKQ-LLVKDONJSA-N 263.293 2.205 10 10 CECE C[C@H]1CN2CCC[C@@H]2CN1Cc1cccc(F)c1O 160247539 QRWBOWLVPZGMEJ-WCQYABFASA-N 264.344 2.200 10 10 CECE C[C@@H](Cn1cccn1)N[C@@H](C)c1cc(O)ccc1O 37155278 CZFKMYZPBRCENG-QWRGUYRKSA-N 261.325 2.034 10 10 CECE Oc1ccccc1CN[C@H]1CCC[C@@H]1n1ccnc1 37106752 XFZOTBAJUHIGRQ-KBPBESRZSA-N 257.337 2.472 10 10 CECE COCCn1c(C)cnc1N(C)Cc1ccc(N)cc1 2148891736 HJKVFNDCOIPDLS-UHFFFAOYSA-N 274.368 2.057 10 10 CECE CC[C@@](CO)(CSc1nccs1)NC1CC1 1995396370 CHSWDYQOAXCQOR-LLVKDONJSA-N 258.412 2.128 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC2(CC(O)C2)C1 2146327270 VPIIRJDVPMZFCL-UHFFFAOYSA-N 274.408 2.454 10 10 CECE COC(=O)C(C)(C)CSc1ncc([C@@H](C)O)s1 1997406824 GXPJQTMNWKRJCE-SSDOTTSWSA-N 275.395 2.488 10 10 CECE Cc1cc(CO)ccc1N1CCP(C)(=O)CC1 2004544694 NNURZDZDEQTJCB-UHFFFAOYSA-N 253.282 2.300 10 10 CECE CCn1cncc1CN(C)c1ccc(CCN)c(C)c1 2153085387 VUDPRAMYOVJBHU-UHFFFAOYSA-N 272.396 2.349 10 10 CECE O=C(O)CO[C@@H]1CCCN(Cc2ccc(Cl)cc2O)C1 2153155024 FFBSLTYNNBFHLT-GFCCVEGCSA-N 299.754 2.111 10 10 CECE CCN(C)[C@@H]1CCN(c2ccc([C@H](C)NC)c(O)c2)C1 2154002247 CASNLCIPWGXGBD-GXTWGEPZSA-N 277.412 2.203 10 10 CECE COc1ccc(O)c(CN[C@H](CN(C)C)C(C)C)c1 49197332 ZGGLREFAKNNSGY-CQSZACIVSA-N 266.385 2.077 10 10 CECE COc1ccc(CNC2CC2)cc1Cn1ccnc1 50125488 CEQPIAYRYWWQCK-UHFFFAOYSA-N 257.337 2.192 10 10 CECE NC(=O)c1cc(Cl)ccc1NCc1cc(N)ccc1O 52858842 XZABMKCMLQZYSJ-UHFFFAOYSA-N 291.738 2.339 10 10 CECE COc1ccc(N2CCN[C@H]3CC[C@@H]32)cc1Cl 2024009496 XPWSOCRFQJIWGD-RYUDHWBXSA-N 252.745 2.289 10 10 CECE CN1[C@H]2CC[C@H]1CC(NCc1cccc(F)c1O)C2 295108778 VWGGOVROMLAZID-STQMWFEESA-N 264.344 2.246 10 10 CECE C[C@@](O)(CCC(F)(F)F)[C@@H](N)c1ccccc1O 2031155321 WBFBSJKRCHQVFR-WDEREUQCSA-N 263.259 2.486 10 10 CECE CNCc1cc(F)c(N(C)C[C@H]2CCCO2)c(F)c1 62712256 KUZCQNNWJTUJLJ-LLVKDONJSA-N 270.323 2.299 10 10 CECE CCc1nnc(CN2CCC[C@H](N=[N+]=[N-])CC2)o1 2038005529 UVXSZMKIRQHVMT-VIFPVBQESA-N 250.306 2.297 10 10 CECE NN[C@@H](c1ccccc1O)c1ncsc1C1CC1 2038764514 ATTZIPSQZFJTFD-NSHDSACASA-N 261.350 2.279 10 10 CECE CC(C)SC[C@H](N)C(=O)N(C)[C@@H](C)c1ccccc1O 2157828883 BOFZPIUKUUDZLS-AAEUAGOBSA-N 296.436 2.381 10 10 CECE CC[C@H](C)C[C@@H]1NC(=O)N(c2ccc(N)cc2)C1=O 400473677 YIINASOWUAFNFI-CABZTGNLSA-N 261.325 2.130 10 10 CECE CN1C[C@H]2CC[C@H]1[C@H](NCc1cc(F)ccc1O)C2 401609204 IFGVTNMNZQALLW-GDLCADMTSA-N 264.344 2.104 10 10 CECE CCCN(CC(N)=O)c1ccc(CNCC)cc1Cl 311855487 TZRVHOGDKBKIRB-UHFFFAOYSA-N 283.803 2.151 10 10 CECE Nc1ccc(CCC(=O)OCCn2cc(Cl)cn2)cc1 312901888 OYWKVUSFKZOKGL-UHFFFAOYSA-N 293.754 2.295 10 10 CECE CC[C@@H]1CC[C@H]1N(C)C[C@H](O)COc1ccc(N)cc1 2161967369 AFAOGROAQHXZSR-IVMMDQJWSA-N 278.396 2.129 10 10 CECE CCCNCc1ccc(N2CC[C@H]3C[C@]3(O)C2)c(F)c1 2171003436 AEFOJRYFMYMKOW-BBRMVZONSA-N 278.371 2.286 10 10 CECE CS[C@@H]1CC[C@H]1NC(=O)CCOc1ccc(N)cc1 702025786 JOQZZZMOLYZUQC-CHWSQXEVSA-N 280.393 2.048 10 10 CECE CS(=O)(=O)c1ccccc1OCCc1ccc(N)cc1 2176329839 CCZYPAQWYFPTPG-UHFFFAOYSA-N 291.372 2.294 10 10 CECE Cc1cc(CO)ccc1N1C[C@]2(C)CN(C)C[C@@]2(C)C1 705639751 UWMFHSCSNYZCEH-IRXDYDNUSA-N 274.408 2.265 10 10 CECE CCC(O)(CC)CN(C)c1ccc([C@H](C)O)c(O)c1 706403349 HHUPACWEILRIFG-NSHDSACASA-N 267.369 2.433 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@@H]2CN1c1ccc2c(c1)CCCO2 2162633362 XSIGQTKEUDCYSJ-FVQBIDKESA-N 272.392 2.446 10 10 CECE COc1ccc(N2CC[C@@H]3NCCC[C@@H]3C2)cc1OC 2162656937 FSBNWODECURIPK-OCCSQVGLSA-N 276.380 2.282 10 10 CECE COc1cc(C)c(N2C[C@@H](N)C[C@@]23CCOC3)cc1C 2162633681 AODQCGYYCBXEQN-XJKSGUPXSA-N 276.380 2.009 10 10 CECE CC(C)Oc1ccc(N2CC[C@@H]3OCCN[C@@H]3C2)cc1 2162655457 KLIGTEQYNYUARG-CVEARBPZSA-N 276.380 2.041 10 10 CECE Cc1nnc(CNCc2cc(Cl)ccc2O)s1 391852593 SKKIKLYUWOWDRZ-UHFFFAOYSA-N 269.757 2.495 10 10 CECE CC[C@@H]1[C@@H](C(=O)O)CCN1Cc1ccc(OC)cc1O 690679214 OAFOGBMHSSKFIJ-QWHCGFSZSA-N 279.336 2.086 10 10 CECE COc1ccc(N2CC[C@@H](c3cnn(C)c3)C2)c(N)c1 2171787896 RQGVKFVVZRHKLV-LLVKDONJSA-N 272.352 2.005 10 10 CECE CN(C)c1ccc([C@@]2(C)C(=O)CCN2C2CC2)cc1 712092083 PEESHAUIDGUEHB-INIZCTEOSA-N 258.365 2.405 10 10 CECE OCc1ccc(N2CCO[C@@H](CCF)C2)c(Cl)c1 691892848 ZEUZRJZRQGRIMT-NSHDSACASA-N 273.735 2.397 10 10 CECE CCNCc1ccc(N2C[C@H]3CCN(C)C[C@@H]3C2)cc1 380736742 LJJJCLIVTZXRGD-HZPDHXFCSA-N 273.424 2.184 10 10 CECE COc1nscc1[C@@H](N)c1ccc(N(C)C)cc1 712934953 ZGTWQACSYOMONL-LBPRGKRZSA-N 263.366 2.266 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3C[C@@H]4[C@H](N)C[C@H]4C3)ccc21 2163068079 DHZOTFYNRRMLMY-GAGVYUBLSA-N 272.392 2.086 10 10 CECE Cc1cc([C@H](N)c2ccc3c(c2)CCCN3C)nn1C 2163109748 BURZLTVKAXCJGJ-MRXNPFEDSA-N 270.380 2.159 10 10 CECE CS[C@@H]1CCCN(CCOc2ccc(N)cc2)C1 382928564 FCAAHALNJGXPEE-CQSZACIVSA-N 266.410 2.475 10 10 CECE CCS[C@H]1CCN(C(=O)CCOc2ccc(N)cc2)C1 383203320 NXQOHWHENXRALP-AWEZNQCLSA-N 294.420 2.392 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@@H]2CCC[C@]2(CN)C1 383275545 HDKNDANDYVZRHF-WQGACYEGSA-N 276.380 2.220 10 10 CECE CCN[C@H](C)c1ccc(N2CC(O)(C3CC3)C2)cc1O 384056727 OSMUXZRIMWERRZ-LLVKDONJSA-N 276.380 2.024 10 10 CECE Cc1[nH]nc(CNCc2cc(F)cc(F)c2O)c1C 716491699 QTSZYKVANRCHNJ-UHFFFAOYSA-N 267.279 2.300 10 10 CECE CCNCc1cc(F)c(N2C[C@@H]3CCO[C@H]3C2)c(F)c1 2172045085 OOMJEEBBTAQBHG-FZMZJTMJSA-N 282.334 2.299 10 10 CECE NCc1ccc(N2CCO[C@H](CF)C2)cc1C(F)(F)F 2172051277 SSIXDSNGTMXLRM-LLVKDONJSA-N 292.276 2.339 10 10 CECE C[C@@H]1CC(F)(F)CN1CCC(=O)Nc1ccc(N)cc1 2172037493 CIPGRWGLEKXLJT-SNVBAGLBSA-N 283.322 2.327 10 10 CECE COC(=O)C[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 388602702 DPLORNXRFHQFOS-ZJUUUORDSA-N 267.325 2.003 10 10 CECE Cc1cc(N2CC[C@H]3[C@@H]2CCCN3C)ccc1CN 720502908 GAQJASQYSVQFOW-HOTGVXAUSA-N 259.397 2.127 10 10 CECE Cc1nnc([C@@H](C)NCCc2ccc(N)cc2)s1 392137476 NXLSSMSDSKBDGV-SECBINFHSA-N 262.382 2.322 10 10 CECE Cc1nc([C@H](C)N[C@H]2CCc3cccc(O)c32)n[nH]1 392413887 FZOHOWDQMWAYNX-KWQFWETISA-N 258.325 2.157 10 10 CECE C[C@H](NC[C@@]1(C)CCOC1)c1c(O)cccc1O 397273473 FBCJCTWRAHSKDP-IINYFYTJSA-N 251.326 2.175 10 10 CECE CC1(C2(NC(=O)COc3ccc(N)cc3)CC2)CC1 398274547 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CCNCc1ccc(N2CC[C@@H](O)C[C@H]2C)cc1OC 2204558887 IUPPPEYXADRWKC-IUODEOHRSA-N 278.396 2.154 10 10 CECE Cc1cccc(CNC(=O)[C@@H](N)C2CC(C)(C)C2)c1O 2204627386 YAOLAIVVTVSWRM-ZDUSSCGKSA-N 276.380 2.080 10 10 CECE CSc1ncc(CNC(=O)C[C@@H]2N[C@H]3CC[C@H]2C3)s1 2269092507 HYGCMSAAUITSAM-QXEWZRGKSA-N 297.449 2.012 10 10 CECE C[C@@H]1C[C@H](CC(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])CO1 2218742463 GRMSEQHJRGUFSW-GWOFURMSSA-N 252.318 2.149 10 10 CECE CN(C)c1ccc(OCc2cc[nH]c(=N)c2F)cc1 2271437079 JXAKRJMDNIJCDB-UHFFFAOYSA-N 261.300 2.278 10 10 CECE COc1ccc(N2CCC(CCO)CC2)cc1F 2219604304 BVYWHTYVPMWGAN-UHFFFAOYSA-N 253.317 2.433 10 10 CECE C[C@@H]1C[C@H](O)CN1c1ccc(CNC2CCC2)cc1 2231460750 ZSLONSMPSPNLFK-WBMJQRKESA-N 260.381 2.288 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCn2nccc2C1 2232021433 CANBSKBTIOTVDY-GFCCVEGCSA-N 256.353 2.231 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC[C@@H](C2(O)CC2)C1 2232090961 AJPZPQXNEJVJRM-GXTWGEPZSA-N 261.365 2.400 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](C)[C@H](O)C2)c(C)c1 2232028138 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COC[C@H](C)[C@H](C)NCc1cc(OC)ccc1O 310933406 VEJGNBLBCUGNHC-QWRGUYRKSA-N 253.342 2.161 10 10 CECE Cc1cc(C(=O)NCc2ccccc2O)nc(Cl)n1 302415639 SGPRAYVTJGAIOR-UHFFFAOYSA-N 277.711 2.074 10 10 CECE C[C@@H](CN1CCCC1)NCc1cccc(F)c1O 158735515 CDZBILKRUPBNQN-NSHDSACASA-N 252.333 2.105 10 10 CECE NCc1ccc(N2C[C@H]3C[C@@H]3C2)cc1Br 379515783 WCIBGEJULWLMIJ-NXEZZACHSA-N 267.170 2.364 10 10 CECE C[C@@H](NC[C@H](O)C(F)F)c1ccc(N(C)C)cc1 224449067 TZJKTZSXXDQCMA-SKDRFNHKSA-N 258.312 2.029 10 10 CECE Fc1cc(OCC[C@H]2CCCO2)ccc1N1CCNCC1 87439228 OXUHPDWMPJYTDM-CYBMUJFWSA-N 294.370 2.183 10 10 CECE C[C@H](NCc1cccc(Br)c1O)c1nnc[nH]1 226746678 CDTDQHLAEJWMIJ-ZETCQYMHSA-N 297.156 2.124 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CCO[C@@H](C)C1 234610920 AULHLJZWZBYNDY-UWVGGRQHSA-N 264.325 2.035 10 10 CECE Cc1ccc(F)cc1[C@H](NCCN=[N+]=[N-])C(=O)O 235802650 ZWMFWQYWARUBRK-JTQLQIEISA-N 252.249 2.160 10 10 CECE CCCN1CCCN(Cc2ccc(OC)cc2O)CC1 92659758 SYZPCHGFIFOCPX-UHFFFAOYSA-N 278.396 2.319 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1ccc(C)cc1C 90257026 JLQMTCZYLLVBFK-LBPRGKRZSA-N 262.313 2.417 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1ccc(F)c(C)c1 90256816 GWINOQOBJARCOL-LLVKDONJSA-N 266.276 2.248 10 10 CECE COC(=O)c1cc(NCc2ccc(N)cc2)ccn1 90739453 BDMKDUXERHGCMB-UHFFFAOYSA-N 257.293 2.063 10 10 CECE Cc1cc(Br)cc([C@H](N)C(F)(F)CO)c1O 95717006 DPHILHIWRSENLV-VIFPVBQESA-N 296.111 2.091 10 10 CECE CN(C)C[C@H]1CCCN1c1ccc(CN)cc1Cl 62793170 LWRQOYGAIQJPKT-GFCCVEGCSA-N 267.804 2.329 10 10 CECE CCCOC1(CNCc2cc3c(cc2O)OCO3)CC1 2166593614 ZBUWXPTWORHCIH-UHFFFAOYSA-N 279.336 2.170 10 10 CECE CN(C(=O)/C=C/c1cccnc1)c1ccc(N)cc1 702049792 RQRIKRKIMOMTLP-RUDMXATFSA-N 253.305 2.340 10 10 CECE NCc1ccc(N2CC[C@H](C(N)=O)CC23CC3)cc1Cl 2167494760 VOTFAHJQYVNDPN-JTQLQIEISA-N 293.798 2.033 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](OCCO)C2)cc1Cl 2170217507 BPKKVLFRZWNCPJ-DGCLKSJQSA-N 298.814 2.337 10 10 CECE CCOCC1CN(Cc2cc(F)cc(C(C)=O)c2O)C1 2165847431 HDNPYIKZXOLLIB-UHFFFAOYSA-N 281.327 2.202 10 10 CECE N[C@@H](c1cc(F)cc(Br)c1O)[C@@H](O)C1CC1 713724404 CMQOEWMKIIBSAX-UWVGGRQHSA-N 290.132 2.065 10 10 CECE Oc1cccc(F)c1[C@@H]1CC(c2cccnc2)=NN1 725388872 QCAFJVWTUBPBTD-LBPRGKRZSA-N 257.268 2.365 10 10 CECE C[C@@H]1CC(CNC(=O)c2ccc(O)c(O)c2)C[C@@H](C)O1 724475537 DYZLIEYBOBLWEB-NXEZZACHSA-N 279.336 2.031 10 10 CECE CC[C@]1(C)C[C@@H](NCc2cccc(OC)c2O)CO1 2132920392 GFBCTUWBNLXELP-IUODEOHRSA-N 265.353 2.448 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]([C@H](O)C(F)(F)F)C2)c1 825124824 ZCNKOGIDLOYJRL-GWCFXTLKSA-N 289.297 2.446 10 10 CECE CC[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCS1 588406838 VDVWGSFCWCKYBL-RNZFLTOJSA-N 293.388 2.465 10 10 CECE CC(=O)C(=O)COC(=O)C[C@@H](C)CCC=C(C)C 830090794 JKKXBIXYYYOUFH-NSHDSACASA-N 254.326 2.460 10 10 CECE NC1C[C@@H]2CCC[C@H](C1)N2c1ccc2c(c1)OCO2 54601834 QNPIRUJPRXNIED-YOGCLGLASA-N 260.337 2.264 10 10 CECE CC(=O)c1cc(F)cc(CN2C[C@@H]3C[C@H]2CS3)c1O 839201641 NGMNKBPCBINFGC-RYUDHWBXSA-N 281.352 2.424 10 10 CECE CON1CC[C@@H](Sc2ncc(Cl)s2)C1=O 918089164 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CCCOc1cc(N2CC[C@@H](CNC)C2)ccc1N 1876306435 LEJGIQPZMRIZGT-LBPRGKRZSA-N 263.385 2.103 10 10 CECE Nc1ccc(NCc2ccccc2O)cc1C(=O)O 1876467162 OYBJJPNZBCOQEW-UHFFFAOYSA-N 258.277 2.285 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])CC[C@H]1C1CCC1 1876606997 BWEJNYMNHISRNK-WCQYABFASA-N 266.345 2.398 10 10 CECE CCc1cnc(/C=C2\SC(=S)NC2=O)s1 783697044 MADNLJFJRRVFLR-UTCJRWHESA-N 256.377 2.194 10 10 CECE C[C@@]1(CN2CCc3cc(CN)ccc32)CCCOC1 1877695658 AJANBLULNLUNTL-INIZCTEOSA-N 260.381 2.325 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)N1CC2(CCC2)C1 1137428962 DFWGLHLHZZKJNN-HYXAFXHYSA-N 259.305 2.124 10 10 CECE CC(C)(C)OC(=O)N1CCC12CN(c1ccc(N)cc1)C2 1955945196 QWRPTIMWQXKMTN-UHFFFAOYSA-N 289.379 2.468 10 10 CECE CC[C@H](C)C[C@@H](N)C(=O)N[C@@H](C)c1ccccc1O 1340796293 MNWIWLFCWVVVHB-GMXVVIOVSA-N 264.369 2.333 10 10 CECE CSc1ncc(CN2CCN[C@@H](C(C)C)C2)s1 2248688617 KIYSYUOZULUFIJ-LLVKDONJSA-N 271.455 2.295 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1ccc(Cl)c(O)c1 1150377425 IQDXBTNDDDTMQR-UHFFFAOYSA-N 293.706 2.387 10 10 CECE 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10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CNCC[C@@H]3C)ccc21 2354608491 AFVYQJZCQNFHIZ-XGWLTEMNSA-N 274.408 2.348 10 10 CECE NC(=O)[C@H]1CCCCN1Cc1c(O)ccc2ccccc12 7982895 SQPUHTQLXZGKCV-OAHLLOKOSA-N 284.359 2.385 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H]2CCCC[C@@H]2O)c1 51991914 LDEBEVOUTOHZAM-YVLXSGLVSA-N 265.353 2.355 10 10 CECE CN(C)c1ccc(CN2CCC[C@H](n3cncn3)C2)cc1 179464068 ZKPKSOLIFBMLOS-INIZCTEOSA-N 285.395 2.181 10 10 CECE CNCc1ccc(N2C[C@@H]3CCC[C@@](CO)(C3)C2)cc1 2357620491 VNGSYAZMTZIEBA-NVXWUHKLSA-N 274.408 2.395 10 10 CECE O=C(N[C@H]1CCCC(F)(F)C1)c1cc(O)c(O)c(O)c1 1148589599 DIDILNXDYNUKGR-QMMMGPOBSA-N 287.262 2.111 10 10 CECE CCN1C(=O)/C(=C/c2ccn(CC)n2)SC1=S 35678564 VRZGMNFCCUAQDW-CLFYSBASSA-N 267.379 2.124 10 10 CECE CC1CCN([C@H](CN)c2ccc(N(C)C)cc2)CC1 38827588 SVBHLBNYXOAYLS-MRXNPFEDSA-N 261.413 2.484 10 10 CECE CCSC[C@H](C)NCc1cc2c(cc1O)OCO2 135298874 GBODITKGARSABG-VIFPVBQESA-N 269.366 2.352 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H](N(C)C)C1 134175862 QEOVOCWGNDKNKV-PWSUYJOCSA-N 252.333 2.228 10 10 CECE CN[C@@H](C)c1ccc(N2CC(OC)C2)cc1Cl 384053119 WZZHQPSZBVOULW-VIFPVBQESA-N 254.761 2.455 10 10 CECE CN1CCCc2cc(CNC[C@H]3CCOC3)ccc21 50286701 LIENTWQEHZMWBJ-CQSZACIVSA-N 260.381 2.195 10 10 CECE COC(=O)C1(NCCCN=[N+]=[N-])CC(C(C)C)C1 234541579 WXVKHOWSRFJURW-UHFFFAOYSA-N 254.334 2.254 10 10 CECE COc1cccc(CN(CC(=O)O)C(C)(C)C)c1O 92450901 GGRVKSMCEAHLBC-UHFFFAOYSA-N 267.325 2.086 10 10 CECE O=[N+]([O-])c1ccc(O)c(CN2CCO[C@H]3CCCC[C@H]32)c1 245445601 KLZIQLVWGASSQT-HIFRSBDPSA-N 292.335 2.444 10 10 CECE Cn1c(-c2oncc2CCN)cc2ccc(O)cc21 606593314 GCWIZGGFZMDMFX-UHFFFAOYSA-N 257.293 2.040 10 10 CECE O=[N+]([O-])c1ccc(O)c(CNc2cc3n(n2)CCCC3)c1 285561933 SNUKBWKDGBQRDP-UHFFFAOYSA-N 288.307 2.445 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)/C=C\c2cccnc2)C1 701306784 QZRYGNPZTOKWDF-FJOGCWAESA-N 257.297 2.396 10 10 CECE COc1ccc(N2CC[C@H]3CC[C@H](O)[C@H]2C3)c(N)c1 722200390 RQZCYMBFRYCAPN-KMUNFCNLSA-N 262.353 2.017 10 10 CECE C[C@@H](N)c1ccc(N2CC(C(=O)NC3CC3)C2)cc1Cl 2168047043 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Nc1ccc(CC(=O)N(CC(F)F)CC(F)(F)F)cc1 720133330 HBJMRMZWMKMRKZ-UHFFFAOYSA-N 296.239 2.467 10 10 CECE Cc1ccc(O)c(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1 827681001 SBQPZBLCENUGIV-CQSZACIVSA-N 290.407 2.437 10 10 CECE Cc1ccc(O)c([C@@H](C)NC[C@@H]2CN(C3CC3)C(=O)O2)c1 848571555 QKBSZFSIALVIMX-DGCLKSJQSA-N 290.363 2.334 10 10 CECE COCC1(CCNCc2cc(F)ccc2O)CC1 843419019 OTSCULJYMSEBPY-UHFFFAOYSA-N 253.317 2.438 10 10 CECE Oc1cc2c(cc1CN1CC[C@H]3COC[C@@H]3C1)CCC2 853586895 ZAFLHQLTIPQVJY-HOCLYGCPSA-N 273.376 2.349 10 10 CECE COC[C@@H](CCN[C@H](C)c1cc(F)cc(F)c1O)OC 850485171 CAYHKRJGDKFMHK-MWLCHTKSSA-N 289.322 2.373 10 10 CECE C[C@@H](CO)[C@@H]1CCCCN1C(=O)Nc1ccc(N)cc1 696734248 OVDOIDMLTJSKNV-FZMZJTMJSA-N 277.368 2.284 10 10 CECE C[C@H](NC(=O)NCCOCC1CC1)c1ccccc1O 868227372 AQYRYBJPZGTEFP-NSHDSACASA-N 278.352 2.179 10 10 CECE CC(=O)C(=O)COC(=O)c1ccc(C)c(C(F)(F)F)c1 860167791 NUDBBFOQZGPAGS-UHFFFAOYSA-N 288.221 2.329 10 10 CECE C[C@H]1CC[C@@H](NCc2cccc(Cl)c2O)CN1 863483988 GECSVRRHAJEBPY-GXSJLCMTSA-N 254.761 2.276 10 10 CECE O=C(CSC(F)(F)F)N1Cc2cccc(O)c2C1 871198803 OZBSTAVBVKZALR-UHFFFAOYSA-N 277.267 2.487 10 10 CECE CCN(CC(=O)N(C)C)Cc1cc(Cl)cc(C)c1O 775651918 CFCBQSYWWHCJOT-UHFFFAOYSA-N 284.787 2.264 10 10 CECE Oc1c(F)cc(Cl)cc1CNC[C@H](O)C(F)(F)F 789599850 OLKDQTBBMMLONX-QMMMGPOBSA-N 287.640 2.198 10 10 CECE C[C@H](NC[C@@H](C(=O)O)C(F)(F)F)c1ccccc1O 1877554132 KMCBYGNREOJKGA-CBAPKCEASA-N 277.242 2.306 10 10 CECE CNc1cc(=N[C@@H](C)c2ccccc2O)[nH]c(C)n1 1877589198 LHVYZRQFMZDENK-VIFPVBQESA-N 258.325 2.127 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)C23CC(CO2)C3)C1 1878392595 NGKWWJXYUYOZNE-ZBOXLXRLSA-N 264.329 2.104 10 10 CECE Nc1ccc(NC(=O)CCN2[C@H]3CCC[C@H]2C3)cc1 1899612843 DXMXSKSSLJGUQA-KBPBESRZSA-N 259.353 2.224 10 10 CECE Cc1ccc(C(=O)NCc2c(O)cccc2O)s1 1156881046 MYIGYLOYNSFRQC-UHFFFAOYSA-N 263.318 2.398 10 10 CECE COc1cccc(CNCC(C)(C)CN(C)C)c1O 19905783 IHBIYOGWZVNWKN-UHFFFAOYSA-N 266.385 2.078 10 10 CECE CNCc1ccc(N2CCC[C@H](O)C2(C)C)c(C)c1 1887816227 SAXMBRUHKVQTKB-HNNXBMFYSA-N 262.397 2.454 10 10 CECE COCC[C@@H]1CN(Cc2ccc(Cl)cc2O)CCO1 1963475133 IJBPEDVDDYSCSM-CYBMUJFWSA-N 285.771 2.283 10 10 CECE CNCc1ccc(N2CC[C@@H](N3CCC3)C2)c(Cl)c1 702260099 XSRQCSDKSDTWIV-CYBMUJFWSA-N 279.815 2.344 10 10 CECE Cc1nc(C)c([C@H]2NCCc3ccc(O)c(O)c32)s1 83724079 CPFMPDUKAGXVOV-LBPRGKRZSA-N 276.361 2.406 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC(C)(CC(=O)O)C1 1892443029 FEWGABFKTQBCJS-SECBINFHSA-N 267.300 2.389 10 10 CECE COc1ccc(N2CC[C@]3(CCNC3)C2)c(F)c1 98169871 UPJGQFMOFGCSTB-AWEZNQCLSA-N 250.317 2.024 10 10 CECE C[C@H]1CN(c2ccc(CO)cc2C(F)(F)F)C[C@H]1CO 708581595 XLQGZVLLCPTKAC-ONGXEEELSA-N 289.297 2.262 10 10 CECE Cc1cc(CNCC(C)C)ccc1N(C)[C@@H](C)C(N)=O 711091221 XDFHPLXIGAUOIS-ZDUSSCGKSA-N 277.412 2.051 10 10 CECE CNCc1ccc(N2CC[C@H](CN(C)C)C2)cc1Cl 688499052 GGKNKEANSUQMPV-GFCCVEGCSA-N 281.831 2.447 10 10 CECE CN1CCCc2cc([C@@H](CN)NC3CCC3)ccc21 712274612 HPXPPEVMSXESNE-OAHLLOKOSA-N 259.397 2.211 10 10 CECE COc1cccc(O)c1C(=O)N1CCC[C@H]1CN=[N+]=[N-] 692870170 AYMFFMPLZDMRLN-VIFPVBQESA-N 276.296 2.316 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@H]1CCCS1 718265325 TVAMUSPVBHWBKJ-SMDDNHRTSA-N 293.436 2.423 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@@H](C)CO1 718403360 KFJZOPZPCMKEEF-BXUZGUMPSA-N 262.353 2.042 10 10 CECE Oc1cccc2c1[C@H](N1CC[C@@H]3COC[C@@H]3C1)CC2 690792830 YFLPHRWRDLIARF-HZSPNIEDSA-N 259.349 2.348 10 10 CECE Cc1cc(CN)ccc1N1CCO[C@](C)(C2CC2)C1 694849173 CRSNFDPISYPSSU-INIZCTEOSA-N 260.381 2.459 10 10 CECE COc1ccc(CN[C@@H]2CCC[C@H](C(=O)O)C2)c(O)c1 86785984 MZGONLGUTPHUTF-CMPLNLGQSA-N 279.336 2.134 10 10 CECE CCC[C@@H]1COC[C@H]1NCc1cc(OC)ccc1O 699437245 DOLCJIVZUWOBDG-BXUZGUMPSA-N 265.353 2.306 10 10 CECE c1cc2c(cc1N1CCCN3CCC[C@@H]3C1)OCO2 94447993 KHCSVWLGPKLIAL-CYBMUJFWSA-N 260.337 2.090 10 10 CECE CN[C@@H]1CCc2nc(-c3ccc(O)c(O)c3)sc21 1916468055 KDKITZPRQSCAKO-MRVPVSSYSA-N 262.334 2.428 10 10 CECE CC(C)CCCNC(=O)Cc1ccc(O)c(O)c1 1441181668 YKBFFQZVNNHRQA-UHFFFAOYSA-N 251.326 2.193 10 10 CECE C[C@H]1C[C@H](CO)CCN1CCCc1ccc(N)cc1 2115826308 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COc1cccc(CNC[C@@]2(C)CCC[C@@H]2O)c1O 2271301864 PUYVKUXICKPCLK-DZGCQCFKSA-N 265.353 2.042 10 10 CECE CSc1ncc(CNC(=O)C[C@@H]2CCC[C@@H](N)C2)s1 2269091549 YJDBVMWVEBWCCW-NXEZZACHSA-N 299.465 2.389 10 10 CECE CSc1ncc(CNC(=O)C(C)(C)[C@@H]2CCCN2)s1 2269096054 PXQKCMXJAGGLTQ-JTQLQIEISA-N 299.465 2.259 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)ccc1[C@@H](C)O 2269693503 XZXBIEOOOILFGR-DSPQJCBJSA-N 261.365 2.398 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](C)[C@H](O)C2)cc1C 2269658675 SEICFKAHOGJNKS-NORZTCDRSA-N 262.397 2.483 10 10 CECE Cc1cc(N2C[C@H]3C[C@@H](C2)N(C)C3)ccc1[C@H](C)O 2269671165 GSYQLPMNINJKNV-YDHLFZDLSA-N 260.381 2.189 10 10 CECE Cc1cc(N2C[C@@H](CO)OC(C)(C)C2)ccc1[C@H](C)O 2285165186 FJAUBZMPMDTGAZ-JSGCOSHPSA-N 279.380 2.024 10 10 CECE Cc1cc(N(C)C[C@@H]2CCCS2(=O)=O)ccc1[C@H](C)O 2285161381 QHLGRZFZWCHQNS-JSGCOSHPSA-N 297.420 2.062 10 10 CECE Cc1cccc(O)c1CNC[C@@H](C)Cc1cnn(C)c1 2295505631 DQNRVYSJWMKRPC-LBPRGKRZSA-N 273.380 2.403 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N(C)[C@H]1CNCC12CC2 2287006042 OJENHEOZBXDKRQ-CJNGLKHVSA-N 273.424 2.497 10 10 CECE COc1cc(OC)c(N2C[C@H](N)CC2(C)C)c(OC)c1 2287138209 LUPUTNKEDMGVLH-SNVBAGLBSA-N 280.368 2.028 10 10 CECE COc1cccc(CNC(=O)C=Cc2cncc(C)c2)c1O 2302473418 WVNUWHGIPDPYGP-UHFFFAOYSA-N 298.342 2.434 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@H]1[C@@H]2CCC(F)(F)[C@@H]21 2309465833 CZWGXNDPAJGUTP-CIUDSAMLSA-N 258.272 2.437 10 10 CECE Cc1ccc([C@@H](C)N2CCOC[C@@H](F)C2)c(O)c1 2315078143 GIWWJNSRVRJDLV-NEPJUHHUSA-N 253.317 2.432 10 10 CECE NCC12CC(CCN1c1ccc(OCF)cc1)C2 2318072743 XNOYVXNEKHRXCQ-UHFFFAOYSA-N 250.317 2.310 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H]3C[C@H]2[C@H]2C[C@H]23)c1 2329258328 ZQZOJIYENDGXRK-MXAVVETBSA-N 257.333 2.435 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2[C@@H](N)[C@@H]3CCC[C@@H]32)cc1 2330386269 IKVRFIWTJMVBDW-OTJKEOIZSA-N 260.381 2.159 10 10 CECE COc1cccc(O)c1CN[C@H]1CC[C@@H]2C[C@H]1CO2 2334115835 SQKNZIZQSRDBCW-LOWVWBTDSA-N 263.337 2.058 10 10 CECE CCOCCNCc1cc(OC(F)(F)F)ccc1O 2335919884 ZMFJGXXGHAMYBQ-UHFFFAOYSA-N 279.258 2.417 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@H](F)C2)c(C)c1 2336672525 ZQZBBRGXMGASKD-TZMCWYRMSA-N 266.360 2.450 10 10 CECE CC=CC[C@H](NC)[C@H](O)c1ccc2c(c1)CCN2C 2338517658 GZJPCESQVUVWDV-GOEBONIOSA-N 260.381 2.267 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC[C@H](N(C)C)C2)c1C 2341069042 FONNXCYNNIQUFZ-KGLIPLIRSA-N 262.397 2.497 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3CC[C@H](O)[C@H]2C3)cc1O 2355747002 YDEICEDMCSLANO-BVIHXZOGSA-N 276.380 2.152 10 10 CECE C[C@H]1C(C[C@@H](N)[C@@H](O)c2ccc3c(c2)CCN3C)[C@@H]1C 2355814190 FHUPINMMYKPFOP-PDVJJKOASA-N 274.408 2.332 10 10 CECE Cc1ccc(NC=C2C(=O)OC(C)(C)OC2=O)c(C)c1 10121467 ZFJFOQJXQLWABM-UHFFFAOYSA-N 275.304 2.435 10 10 CECE Cc1nn(C)c(Sc2nccs2)c1C[C@@H](C)N 111588076 SAEHPXLFFGZKMA-SSDOTTSWSA-N 268.411 2.226 10 10 CECE CC[C@H](C)[C@@H](N)CN1CCN(c2ccc(OC)cc2)CC1 20072759 WGBFPQMJDHBEPM-YOEHRIQHSA-N 291.439 2.191 10 10 CECE Nc1ccc(OC[C@H](O)CN2CC[C@@H]3CCCC[C@H]32)cc1 227954408 WHPBSWGJZGSVCS-YSVLISHTSA-N 290.407 2.273 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H](O)C2)c(F)c1 61710639 FVJCHYFJJUZUHM-PWSUYJOCSA-N 252.333 2.067 10 10 CECE COc1cc(Cl)cc(CN[C@H]2CC[C@@H]3C[C@]23CO)c1O 2356908036 WPABVEISOWWJIA-RIEGTJTDSA-N 297.782 2.305 10 10 CECE O=[N+]([O-])c1ccc(O)c(CN(CCCCO)C2CC2)c1 173412648 FXIITQLHTOUING-UHFFFAOYSA-N 280.324 2.037 10 10 CECE CN(C)C1CCN(Cc2cc(F)ccc2O)CC1 179937905 VORXWQGAUZPJSV-UHFFFAOYSA-N 252.333 2.057 10 10 CECE CC(C)NCc1ccc(N2CCC[C@H](C(N)=O)C2)c(F)c1 34822943 AEUFYPPYRIEBJN-ZDUSSCGKSA-N 293.386 2.025 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H]3C[C@@H]4C[C@@H](N)[C@@H]4C3)ccc21 2358000059 DHZOTFYNRRMLMY-DRXUAVOGSA-N 272.392 2.086 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C1CCSCC1 403620578 AZYNHQUXGMUZRM-UHFFFAOYSA-N 281.377 2.108 10 10 CECE C[C@@H](N)c1cc(Br)c(F)c(O)c1O 213216843 LMJLAGJAPZFQPN-GSVOUGTGSA-N 250.067 2.019 10 10 CECE CN(Cc1ccccc1O)C(=O)c1cnccc1N(C)C 183607721 YANAKYRXIQKCHY-UHFFFAOYSA-N 285.347 2.125 10 10 CECE Cc1cccc(CN2CCC[C@@H](n3cncn3)C2)c1O 180066663 MNXBLGJKWUHEEN-CQSZACIVSA-N 272.352 2.129 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC[C@@H](N3CCOCC3)C2)c1 217861677 JVKILQCONBCKDE-HUUCEWRRSA-N 290.407 2.168 10 10 CECE [N-]=[N+]=N[C@@H]1C[C@@H](C(=O)O)N(C(=O)OCc2ccccc2)C1 210155725 MCMIVURICADVMC-MNOVXSKESA-N 290.279 2.161 10 10 CECE CC[C@H]1CO[C@H](C)CN1c1ccc(CN)c(F)c1 135221476 SONPRNIPEBOZSJ-PWSUYJOCSA-N 252.333 2.288 10 10 CECE COc1ccc(N(CCCN)Cc2cc(C)nn2C)cc1 89181631 ITGJHMABHUDEBT-UHFFFAOYSA-N 288.395 2.093 10 10 CECE Nc1ccc(N2C(=O)c3cc(F)c(F)cc3C2=O)cc1F 148929347 NUUYPBSLJVDOOX-UHFFFAOYSA-N 292.216 2.487 10 10 CECE C[C@H]1OCCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 191140506 YPUUPMYWEODJDG-IUODEOHRSA-N 276.380 2.184 10 10 CECE CNCc1ccc(N2CCC[C@H]2CO)cc1Br 234445590 OUWXZGSVIQYAKJ-LBPRGKRZSA-N 299.212 2.130 10 10 CECE CCOc1ccc(O)c(CN2CCC[C@@](C)(CO)C2)c1 93341185 HTZLWHXLWCUQJM-MRXNPFEDSA-N 279.380 2.385 10 10 CECE C[C@@H]1C[C@@H]1CNCc1ccc(N2CCOCC2)cc1 132100850 QHRPATLVMCVIOE-UKRRQHHQSA-N 260.381 2.269 10 10 CECE C[C@H]1C[C@H](O)C[C@@H](C)N1Cc1ccc(N(C)C)cc1 248655621 BZCXGRFCWDDKLE-YWVIFJGQSA-N 262.397 2.486 10 10 CECE O=C1Nc2cc(O)c(O)cc2N[C@@H]1c1ccccc1 606595712 URMZDHQRUSOPNE-CYBMUJFWSA-N 256.261 2.203 10 10 CECE C[C@@H](Cn1cncn1)N[C@@H](C)c1cc(Cl)ccc1O 273595940 QPNKBXPWGRBQPE-UWVGGRQHSA-N 280.759 2.376 10 10 CECE CN1CCCc2cc([C@@]3(N)COCCC3(F)F)ccc21 2168243665 VSDZKKXMCBKHNT-AWEZNQCLSA-N 282.334 2.279 10 10 CECE COc1noc(C)c1CNCc1ccc(N(C)C)cc1 2163564401 NLFYCURGMYRQHZ-UHFFFAOYSA-N 275.352 2.347 10 10 CECE CN1CCc2cc(CNC[C@@H]3CC4(CC4)CO3)ccc21 2166409507 STLJCEWXSWQQQU-HNNXBMFYSA-N 272.392 2.338 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CC2CC(F)(C2)C1 2163730341 FIXTZQHREXUHGX-NLTNOIMHSA-N 277.343 2.030 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CCc2ccc(F)cc21 2163762341 QGUCWDVNHCWBKR-CYBMUJFWSA-N 278.287 2.342 10 10 CECE O=Cc1cc(C(F)(F)F)nc(-c2ccc(O)c(O)c2)n1 2167093857 RXPMAGOLVRDLCE-UHFFFAOYSA-N 284.193 2.386 10 10 CECE CSc1ncc(CN[C@@H](C)[C@@H](C)C(=O)O)s1 2243768261 JDYACNWWBZLFRE-RQJHMYQMSA-N 260.384 2.064 10 10 CECE COc1cccc(CNCc2nn(C)c(C)c2Cl)c1O 817410374 YFGRLXQTFJFYDD-UHFFFAOYSA-N 295.770 2.386 10 10 CECE CN1CC[C@H](NCCc2ccc(N)cc2)[C@@H]2CCC[C@@H]21 817957714 OMYBXRIVUXEZSS-ULQDDVLXSA-N 273.424 2.274 10 10 CECE Cc1cc(CN2CC(F)(F)C[C@@H]2CO)ccc1N(C)C 815098733 NBLKMVUDFPFCKK-CYBMUJFWSA-N 284.350 2.263 10 10 CECE C[C@@H](C(=O)N(C)Cc1ccc(N)cc1)[C@@H]1CCCO1 720558016 AONDGGMWUIMCBH-RISCZKNCSA-N 262.353 2.042 10 10 CECE CCNCc1ccc(N(C)Cc2ccn(C)n2)c(C)c1 723530759 XPQJAAPSRUOSFR-UHFFFAOYSA-N 272.396 2.474 10 10 CECE CN(Cc1cc(Cl)cc(F)c1O)CC1CN(C)C1 827125046 GXVAYMYEDSKONW-UHFFFAOYSA-N 272.751 2.178 10 10 CECE COCC1=CCN(c2c(F)cc(CN)cc2F)CC1 723156860 LEQZTGLDKPDTIQ-UHFFFAOYSA-N 268.307 2.206 10 10 CECE Oc1ccc(Cl)cc1CN1CCc2nccnc2C1 827693126 YJNBQMXKUWQPTB-UHFFFAOYSA-N 275.739 2.394 10 10 CECE CNCc1ccc(N2CC[C@@H]3OCC[C@H]3C2)cc1C 724840229 FIRLBBZUWBSHKJ-HOCLYGCPSA-N 260.381 2.330 10 10 CECE CCN(C(=O)/C=C\c1ccc(O)c(O)c1)[C@H]1CCCOC1 846447290 UESLCZAPIYDGBV-WOLRVDTOSA-N 291.347 2.139 10 10 CECE Oc1cc2c(cc1CN[C@@H]1CNc3ccccc3C1)OCO2 844904916 FDKIEYRPPKJADB-ZDUSSCGKSA-N 298.342 2.247 10 10 CECE Cc1cc(O)c(CNCCN2CCCC2=O)c(Cl)c1 846076052 DIWGABRPMKJFKB-UHFFFAOYSA-N 282.771 2.066 10 10 CECE CCOCc1cc(CNCCCN2CCC2)ccc1OC 848545899 MZTZCLMYXOPQHC-UHFFFAOYSA-N 292.423 2.417 10 10 CECE CO[C@H]1CCC[C@H]1N(C)CCOc1ccc(N)cc1 687438568 RWEZRWVSWXSPQA-CABCVRRESA-N 264.369 2.147 10 10 CECE Cc1cc(C)c(O)c(CN2C[C@@H]3COC[C@@]3(C)C2)c1 853565700 IWQSYCMXAAUSSE-GDBMZVCRSA-N 261.365 2.477 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)CC(C)(F)F)C2)cc1 855226844 SYBWUDHSKYLFKH-NSHDSACASA-N 298.333 2.435 10 10 CECE CSc1ncc(CNCCCC2(C)CNC2)s1 2248736311 GHSDGULKIFDMID-UHFFFAOYSA-N 271.455 2.344 10 10 CECE CCOc1ccc(CN2CC3(CCCO3)C2)c(O)c1 862484592 WCOMQQZQGKKWAX-UHFFFAOYSA-N 263.337 2.156 10 10 CECE CN1CCCC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 862027040 HNLWDPDSLJFGNY-CQSZACIVSA-N 299.374 2.041 10 10 CECE CC(C)SCC(=O)N1Cc2cccc(O)c2C1 871198355 IEVSWVDYQBMPOU-UHFFFAOYSA-N 251.351 2.376 10 10 CECE Cc1conc1CN1CCOc2cc(N(C)C)ccc21 878319281 OCLUOGYGRDFADK-UHFFFAOYSA-N 273.336 2.448 10 10 CECE C[C@@H](N[C@H](C)c1cc(O)ccc1O)c1ccn(C)n1 1876947306 KQSAROBDJPXYBT-NXEZZACHSA-N 261.325 2.243 10 10 CECE COC[C@@H](NCc1ccc(C)cc1O)[C@H]1CCCOC1 895857387 BLYPNKYOGBYRLK-LSDHHAIUSA-N 279.380 2.232 10 10 CECE CC(C)OCCNC(=O)c1cc2cc(O)c(O)cc2s1 897382437 HHCHRIZQACSREN-UHFFFAOYSA-N 295.360 2.467 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)C[C@H](O)C2CC2)c(F)c1 1880480584 XRPWJJDCTBXWCR-OQPBUACISA-N 271.307 2.225 10 10 CECE C[C@@H](O)c1cc(F)c(N(C2CC2)C2COC2)c(F)c1 1880478168 CJVNRAUZDOMZNU-MRVPVSSYSA-N 269.291 2.386 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H](O)CC[C@@H]2C)c(F)c1 1880926783 JIHLWQKCTHAGLO-ATZCPNFKSA-N 270.323 2.334 10 10 CECE COc1cccc(CN[C@@H]2C[C@@]23CCCOC3)c1O 1896322568 AOAVFHNDZXADTB-UKRRQHHQSA-N 263.337 2.060 10 10 CECE Cc1cc(N2[C@@H]3COC[C@H]2C3)ccc1CNC1CC1 1899668259 HHXZFSWMMSVPRL-IYBDPMFKSA-N 258.365 2.225 10 10 CECE C[C@H](NC(=O)c1ccc2nc(O)[nH]c2c1)c1ccccc1O 1302538418 QDLTWCLAYFYEJR-VIFPVBQESA-N 297.314 2.465 10 10 CECE COc1cccc2c1CN(C(=O)c1cccc(O)c1O)C2 1302494218 VAFXUZXVONUHHE-UHFFFAOYSA-N 285.299 2.262 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)CCCC(=O)O 37836134 DHZSOAGQKUTEHB-JTQLQIEISA-N 265.309 2.167 10 10 CECE CCN(C(=O)c1ccncc1OC)c1ccc(N)cc1 134550219 OPOBWJMCYAGATH-UHFFFAOYSA-N 271.320 2.339 10 10 CECE OC1CN(c2ccc(OCc3ccccc3)cc2)C1 1886859935 ZQCXMKCLVFYCMW-UHFFFAOYSA-N 255.317 2.447 10 10 CECE CCCOC(=O)CN1C[C@H](C)Nc2cc(OC)ccc21 76927944 GSRWLVYYMDDWRY-NSHDSACASA-N 278.352 2.269 10 10 CECE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1cnccn1 1164181576 YPOJPTKILRJDQP-SECBINFHSA-N 298.306 2.130 10 10 CECE CN(C)CCCn1ccnc1Cc1ccc(N)cc1 82734769 PJMWOCNPHSWYBH-UHFFFAOYSA-N 258.369 2.008 10 10 CECE COC1(OC)CC(CN[C@H]2CCc3cccc(O)c32)C1 1963414197 FKRVQCJTRPGYOJ-ZDUSSCGKSA-N 277.364 2.368 10 10 CECE Nc1ccc(CN2CC3(CCC3)C[C@@H]2C(=O)O)cc1 1891471208 CJMWSZGMHGWITP-CYBMUJFWSA-N 260.337 2.098 10 10 CECE O=C(Cc1cnccc1Cl)NCc1c(O)cccc1O 1178910671 GSXZCHKIRFAXPU-UHFFFAOYSA-N 292.722 2.005 10 10 CECE COC(=O)[C@](C)(NCCN=[N+]=[N-])c1cccc(F)c1 90257158 DXQVBVPKAWBLAW-GFCCVEGCSA-N 266.276 2.114 10 10 CECE C[C@@H]1CN(c2ccc([C@@H](C)N)c(O)c2)[C@H](C)CO1 93670447 NUTSNZVZHARODE-GMTAPVOTSA-N 250.342 2.026 10 10 CECE COc1ccc(N2C[C@@]3(F)CCC[C@@]3(N)C2)cc1F 1893617991 GDHBDAQVPNKJDV-UONOGXRCSA-N 268.307 2.244 10 10 CECE O=C(NC[C@@H]1CCCC12CC2)c1cccc(O)c1O 706288004 FZWPLRGCAFOEIG-JTQLQIEISA-N 261.321 2.408 10 10 CECE Oc1c(F)cc(F)cc1CNCc1ccsn1 708421121 PDXUUKZPCFVRBC-UHFFFAOYSA-N 256.277 2.417 10 10 CECE C[C@@H](c1cn(C)cn1)N(C)c1ccc(CN)c(F)c1 710491692 KFTDEOIOZQGSRA-JTQLQIEISA-N 262.332 2.215 10 10 CECE C[C@H](O)CN(c1ccc(CO)cc1Cl)C1CC1 691470472 DWYVNDZNMCFULR-VIFPVBQESA-N 255.745 2.182 10 10 CECE O=C(O)[C@@H]1CN(Cc2c(O)cccc2Cl)CCS1 699256160 BIXXYZKSLJCEBE-NSHDSACASA-N 287.768 2.048 10 10 CECE Cc1ccc(O)c([C@@H](C)NCC[C@@H]2CCCS2(=O)=O)c1 714352754 UZIQUGDHTZXEKY-OLZOCXBDSA-N 297.420 2.319 10 10 CECE CCCOc1cc(N2C[C@@H]3COC[C@H]3C2)ccc1N 718181387 CLUIFJGPFQSPNC-VXGBXAGGSA-N 262.353 2.140 10 10 CECE CC(C)[C@H]1CNCCN1c1ccc2c(c1)OCCCO2 86176903 TXYKYZZZIBVFLP-CQSZACIVSA-N 276.380 2.282 10 10 CECE COc1cccc([C@@](C)(NCCCN=[N+]=[N-])C(=O)O)c1 90258780 POZOTZMWLHWCQT-CYBMUJFWSA-N 278.312 2.285 10 10 CECE CO[C@]1(C(=O)O)CCCN(Cc2cc(Cl)ccc2O)C1 697311198 NGEQWEVWMVMTNG-CQSZACIVSA-N 299.754 2.111 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CC(C)(C)OC1(C)C 94425602 MFSJWNOMNFBABX-ZDUSSCGKSA-N 284.360 2.166 10 10 CECE CC[C@H](C)N1CCN(c2ccc([C@H](C)N)c(O)c2)CC1 93671434 XOOFBPQQCAQUEH-STQMWFEESA-N 277.412 2.332 10 10 CECE COc1ccc(O)c([C@H](C)Nc2cn(C)nc2OC)c1 788983640 DSJMWJPUVNLLCX-VIFPVBQESA-N 277.324 2.316 10 10 CECE CSc1cccc(C(=O)NCc2ccc(O)c(O)c2)n1 1445899940 HTTWFOVYJLYDJG-UHFFFAOYSA-N 290.344 2.145 10 10 CECE OCc1ccc(N2CCO[C@@H](c3ccco3)C2)cc1 2115099036 DPQOKSRPZDVBJI-OAHLLOKOSA-N 259.305 2.350 10 10 CECE CCN(CC)c1ccc([C@H](NC2CC2)C(=O)O)cc1 211451198 OBWAJVGEXSRKLK-AWEZNQCLSA-N 262.353 2.411 10 10 CECE COc1cc(OC)c2c(c1)[C@@H](CC(=O)O)CCN2C 212065672 QKZHADJUCROZCY-SECBINFHSA-N 265.309 2.102 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(N)=O)c1cccc(F)c1Cl 2119569356 TYUWSFVKCWBSNM-JTQLQIEISA-N 285.710 2.296 10 10 CECE CNCc1ccc(N2CCC3(CC2)COC3)c(C)c1 2121072317 GNYKKDZVCMAVMF-UHFFFAOYSA-N 260.381 2.331 10 10 CECE C[C@H](CC(=O)NCCOc1ccc(N)cc1)C1CC1 2121000717 MRANIBGGOIMXKH-LLVKDONJSA-N 262.353 2.200 10 10 CECE Cc1cccc2nc(C(=O)NCc3c(O)cccc3F)cn12 1558455501 VMNIXYNQGRNIMT-UHFFFAOYSA-N 299.305 2.417 10 10 CECE Cc1ncncc1CN[C@H](C)c1ccc(F)cc1O 2122299610 NHSQMEHKFKJJLZ-SNVBAGLBSA-N 261.300 2.481 10 10 CECE O=C(CC[C@@H]1CCCCO1)NCc1cc(O)ccc1O 1643882136 ONGMNELCWBPAMT-ZDUSSCGKSA-N 279.336 2.063 10 10 CECE C[C@H](NC(=O)c1cccc2nc(O)[nH]c12)c1ccccc1O 1643745035 GJFOQEOKMGCEJT-VIFPVBQESA-N 297.314 2.465 10 10 CECE C[C@H]1CC=C(C(=O)NCc2cc(O)ccc2O)CC1 1593881361 IOIAXYYAEWRXPK-JTQLQIEISA-N 261.321 2.460 10 10 CECE COc1cccc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)n1 2125335776 FLPORKFAWFOLQI-VIFPVBQESA-N 261.285 2.005 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264.369 2.205 10 10 CECE Cc1[nH]nc(CN2CCOc3cc(N(C)C)ccc32)c1C 894468899 AHRAFPAJLACFFS-UHFFFAOYSA-N 286.379 2.492 10 10 CECE C[C@H](O)CCCN(C)Cc1ccc(N2CCOCC2)cc1 789304879 GKIUNMMJPAVGAX-HNNXBMFYSA-N 292.423 2.116 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NO[C@H]2CCCCO2)cc1 1136460142 SUKKCBZYVADIHP-NSHDSACASA-N 292.295 2.037 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3COCC[C@@H]32)c(F)c1 1878798506 KARYQSSASQWJNY-QKCSRTOESA-N 264.344 2.331 10 10 CECE C[C@@H](O)c1cc(F)c(N(CCO)CC(F)F)c(F)c1 1880478408 FGBWTBOYYBHFDS-SSDOTTSWSA-N 281.249 2.082 10 10 CECE C[C@@H]1COCCN(c2c(F)cc([C@H](C)O)cc2F)C1 1880482463 PDLLUCRDULWSHG-UWVGGRQHSA-N 271.307 2.491 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H]([C@@H](C)O)C2)c(F)c1 1880928560 RLWICEROIGCEEC-AEJSXWLSSA-N 270.323 2.192 10 10 CECE C[C@@H]1C[C@@H](C)N1CC(=O)N(C)Cc1ccc(N(C)C)cc1 791566673 CJQVPGKCNXBHNX-ZIAGYGMSSA-N 289.423 2.194 10 10 CECE COc1cccc(CNC(=O)C2(C)CCC(=O)CC2)c1O 1150543297 KFWCAQRZLDUTBE-UHFFFAOYSA-N 291.347 2.166 10 10 CECE 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CECE Cn1cc(CN2CCCc3cc(CN)ccc32)c(Cl)n1 2168229585 JUPHHJLBTMZLCJ-UHFFFAOYSA-N 290.798 2.485 10 10 CECE CC(=O)C(=O)COc1ccc(Cl)c2cccnc12 808016224 HTJDJBINJMOKSD-UHFFFAOYSA-N 263.680 2.425 10 10 CECE Cc1ccnc(CN2CCCc3cc(CN)ccc32)n1 700943534 JPWXCCZEGQNYCZ-UHFFFAOYSA-N 268.364 2.197 10 10 CECE CCCNCc1cc(F)c(N2CC=C[C@@H](O)C2)c(F)c1 2165071211 WZGACEWIWDNFTJ-GFCCVEGCSA-N 282.334 2.202 10 10 CECE COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@H]2OC)c1 815835611 ZDYSLIKRNBLSAD-DZGCQCFKSA-N 293.363 2.222 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@]12C[C@@H](N)C[C@@H]1C2 713205040 JIMXVUKFMJYTAN-YMEQNVIZSA-N 274.364 2.039 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@H]2CNCC[C@@H]21 715022597 RHUASXHDGFNUHL-XUJVJEKNSA-N 276.380 2.233 10 10 CECE CCN1C[C@@H](NCc2ccc(OC)cc2O)C(C)(C)C1 722260827 CCAJDFCCBOCHJO-OAHLLOKOSA-N 278.396 2.221 10 10 CECE Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2C)cc1N 722231265 DYZOVRVACBPRQT-UHFFFAOYSA-N 292.360 2.392 10 10 CECE Oc1cc2c(cc1CN[C@H]1CC[C@H]3C[C@@H]1C3)OCO2 2133093079 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CCN(C[C@H]1CCCO1)c1ccc(CN)cc1F 42467293 YKZJUPFKGFHRHR-GFCCVEGCSA-N 252.333 2.290 10 10 CECE CC(C)(C)[C@@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 704055712 DRYYZTUNXAGCKL-SMDDNHRTSA-N 276.380 2.446 10 10 CECE CCc1cccc(CN2C[C@H]3CCN(C)C[C@@H]3C2)c1O 692090315 IZFZCHZOWMVNQG-GDBMZVCRSA-N 274.408 2.338 10 10 CECE CC(=O)c1cc(F)cc(CN2[C@H](C)COC[C@H]2C)c1O 79443713 FXYZEINEVOYYTR-NXEZZACHSA-N 281.327 2.343 10 10 CECE CCN1CC(CN(C)c2ccc([C@H](C)O)cc2F)C1 692260919 MOYZIJAXAMIQII-NSHDSACASA-N 266.360 2.267 10 10 CECE C[C@@H](N)c1ccc(N2CC(OCC(F)F)C2)c(F)c1 707661267 VTYOKSQDOOOCDB-MRVPVSSYSA-N 274.286 2.316 10 10 CECE CN(c1ccc(CN)cc1Cl)[C@H]1CCC[C@H]1O 709397208 DJWQDPQWIQNYGZ-QWHCGFSZSA-N 254.761 2.148 10 10 CECE C[C@@H](CNC(=O)Cc1ccc(N)cc1)c1ccccn1 709614427 ZIYXCENHJBWZEX-LBPRGKRZSA-N 269.348 2.126 10 10 CECE COc1ccc([C@@H](C)NCC[C@H](O)C(F)F)c(O)c1 716700200 XFUDUDIZGXTYBI-KCJUWKMLSA-N 275.295 2.068 10 10 CECE CCCOc1ccc(CN2C[C@@H]3COC[C@H]3C2)c(O)c1 718143335 BGXUSSDWBTYHBT-ZIAGYGMSSA-N 277.364 2.259 10 10 CECE CCN[C@H](C)c1ccc(N2CC3(COC3)C2)c(F)c1 697098056 MWBNXEIHUWSRTP-LLVKDONJSA-N 264.344 2.333 10 10 CECE CCCC[C@@H](O)CCC(=O)NCc1cccc(OC)c1O 1294938081 VFLNGQZVOPKYQA-CYBMUJFWSA-N 295.379 2.348 10 10 CECE O=C(NCc1c(O)cccc1O)c1ncc(Cl)s1 1456323459 SBXVJCSKKNPLPB-UHFFFAOYSA-N 284.724 2.138 10 10 CECE COC(=O)C1(NCCCN=[N+]=[N-])CCC(C)(F)CC1 2117527665 YUGZKFJJRLTWTJ-UHFFFAOYSA-N 272.324 2.490 10 10 CECE CCNCc1ccc(N(C)CC2[C@@H]3COC[C@@H]23)cc1 2118015043 GFBXLZKIBYWBER-HOTGVXAUSA-N 260.381 2.125 10 10 CECE COc1ccc([N+](=O)[O-])cc1/N=N/N1CCC(=O)CC1 1860483783 JHCJIQOXHJEGBX-BUHFOSPRSA-N 278.268 2.267 10 10 CECE C[C@H](F)COc1ccc(N2CCC(N)CC2)c(F)c1 2120349950 LKCAXEUFGWLWMS-JTQLQIEISA-N 270.323 2.490 10 10 CECE NCC1(CNCc2ccc(C(F)(F)F)cc2O)CC1 2121093200 MTMQYJPECFJUSS-UHFFFAOYSA-N 274.286 2.240 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@@H](O)[C@H]2C3)cc1Cl 2120644437 DCUMUKPYTCAMBL-VCTAVGKDSA-N 280.799 2.409 10 10 CECE COc1cc(N)c(N(C)Cc2cccnc2)cc1OC 213400084 WJVSSNDRAXHVHC-UHFFFAOYSA-N 273.336 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10 CECE Cc1ccc(CN(C)c2ccc([C@H](C)O)c(O)c2)nn1 2145791764 NISVHYQMDMUUKI-NSHDSACASA-N 273.336 2.180 10 10 CECE CO[C@@H]1CN(c2ccc(CN)cc2C(F)(F)F)C[C@H]1F 2146485629 XDPOAEILQOXKTD-ZYHUDNBSSA-N 292.276 2.337 10 10 CECE CC(C)OCCOc1ccc(N2CCC[C@H](N)C2)cc1 43471064 VBXXVISMMNBBRW-AWEZNQCLSA-N 278.396 2.418 10 10 CECE COCCC1CC(CN)(N(C)c2ccc(OC)cc2)C1 2152405936 ZEPJZGKEMOWPKL-UHFFFAOYSA-N 278.396 2.275 10 10 CECE CNCc1ccc(N2CC3(CC[C@H]2CO)CC3)cc1C 2154162279 SXLAJCRQBOEFLV-INIZCTEOSA-N 274.408 2.456 10 10 CECE CN1CCCc2cc([C@H](N)Cc3ccnn3C)ccc21 2154724052 UPYRFZGMWZRXLT-OAHLLOKOSA-N 270.380 2.045 10 10 CECE C[C@@H]1CC(CNC(=O)c2cccc(O)c2O)C[C@@H](C)O1 281586388 MKXDZIIFDKFGBB-NXEZZACHSA-N 279.336 2.031 10 10 CECE C[C@H]1CN(Cc2ccc3c(c2)CCN3C)C[C@@H](C)[C@@H]1N 2155545043 BVEAINFQVDLQGZ-LAQFHYBYSA-N 273.424 2.094 10 10 CECE COCCSCCNCc1ccc(C)cc1O 2024836044 MZQUGDQVVVGSIU-UHFFFAOYSA-N 255.383 2.170 10 10 CECE CC(C)SC[C@@H](C)NC(=O)c1ccc(O)c(O)c1 2028116915 CYZVDZAMKMXBCG-SECBINFHSA-N 269.366 2.358 10 10 CECE Nc1ccc(O)c(CN2C[C@H]3CSC[C@@H](C3)C2)c1 2028162604 SNSGYOQUPPIDHF-QWRGUYRKSA-N 264.394 2.159 10 10 CECE C[C@H]1CCO[C@H](C)CN1c1ccc(CN)c(F)c1 2031632018 GLHLHFLADFZXBL-WDEREUQCSA-N 252.333 2.288 10 10 CECE CCN(C[C@H]1CCCNC1)[C@H](C)c1cc(O)ccc1O 300209719 ZIBHWYZKXGXTGL-OLZOCXBDSA-N 278.396 2.480 10 10 CECE CCNC(=O)CSc1ncc(CNCC(C)C)s1 2037781054 KHGXVPUHBRKKQH-UHFFFAOYSA-N 287.454 2.117 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@H]3[C@@H]2C3(F)F)c(O)c1 2040562694 KWBCTFJTLCMHHU-UMNHJUIQSA-N 255.264 2.231 10 10 CECE N[C@@H]1CN(Cc2ccc(Cl)cc2O)C[C@@H]1C(F)F 2040867563 GDAGVIDAOVHMOH-VHSXEESVSA-N 276.714 2.070 10 10 CECE C[C@@H]1C[C@@H](CC[C@H](NN)c2ccc(N(C)C)cc2)CO1 2159338101 HGLCWWCVYOTEJZ-IOASZLSFSA-N 277.412 2.462 10 10 CECE C[C@@H](NCc1cnns1)c1cc(F)ccc1O 400254927 XTOTVZHMHLIVNE-SSDOTTSWSA-N 253.302 2.234 10 10 CECE N[C@H](CO)c1ccc(N2CCCCC2)c(Cl)c1 72199222 QGYAOBLCQKPEDP-GFCCVEGCSA-N 254.761 2.322 10 10 CECE COc1cccc(CN2CCC[C@H](CN(C)C)C2)c1O 405207369 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CECE COc1cc(C(=O)NCc2cccc(Cl)c2O)sn1 1640405116 MHNHWGDOHJGJME-UHFFFAOYSA-N 298.751 2.441 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)N2C[C@H]3CCC[C@H]3C2)C1 1912157487 TVXZNTCFFQCWND-UTUOFQBUSA-N 263.345 2.471 10 10 CECE CC(C)n1nccc1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1912153692 IPEQJUOMJRHHPQ-SNVBAGLBSA-N 262.317 2.379 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C[C@H](O)c2ccccn2)C1 1912154473 BZLUIVBRWPOQOG-AAEUAGOBSA-N 261.329 2.137 10 10 CECE CCOCCN(CCCCN=[N+]=[N-])CCOCC 1912145237 DVAFQVPLUIFUPP-UHFFFAOYSA-N 258.366 2.452 10 10 CECE [N-]=[N+]=NC1CCN(S(=O)(=O)C2CCCCC2)CC1 1912192817 KJFVRAJLFBGCJX-UHFFFAOYSA-N 272.374 2.424 10 10 CECE O=C1NC(=S)SC1=Cc1cc(F)cc(F)c1 2303968806 CTWNVHVBULQZGU-UHFFFAOYSA-N 257.286 2.454 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@@H]2CC(F)(F)CO2)c1 1966190125 CQVODFOEYDXKMD-KOLCDFICSA-N 287.306 2.476 10 10 CECE CCN[C@@H]1CCc2cc(N3CC=C[C@@H]3CO)ccc21 2128297007 JUGCLNINTWZDIX-GDBMZVCRSA-N 258.365 2.021 10 10 CECE COC[C@H]1C[C@H]1CN(C)c1ccc2c(c1)CC[C@H]2N 2133436682 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Cc1cccc(CNC[C@@H]2CC(F)(F)CO2)c1O 1967821913 GNUSDHHQOGUUMN-NSHDSACASA-N 257.280 2.214 10 10 CECE CC(C)N(CCc1cnn(C)c1)c1ccc(CN)cc1 230749279 PXNPWZZYDJBECI-UHFFFAOYSA-N 272.396 2.336 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccc2[nH]cnc2c1 231733028 ANEFFHHAQHOBSL-UHFFFAOYSA-N 258.285 2.383 10 10 CECE CCN1CCC[C@H]1CN(C)c1ccc(CN)c(F)c1F 233472973 ABBUGQNVCTXXDL-LBPRGKRZSA-N 283.366 2.344 10 10 CECE CCOC(=O)[C@H](NCC(F)(F)F)c1cc(F)ccc1O 233706245 KNSQDMGMZJIJFS-SNVBAGLBSA-N 295.232 2.287 10 10 CECE C[C@@H](Cn1ccnc1)N[C@H](C)c1c(O)cccc1O 235153575 HDFJQVXXVIBPJS-WDEREUQCSA-N 261.325 2.034 10 10 CECE C[C@H](N)c1ccc(N(C)C2CN(C)C2)cc1Br 1941731493 PGKJCQLDKHEZNA-VIFPVBQESA-N 298.228 2.219 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1CCCC2(C1)OCCO2 1944028318 ATRODGDAXGWDFG-OAHLLOKOSA-N 276.380 2.386 10 10 CECE Oc1ccc(CN(CC2CC2)C[C@H]2CCCN2)c(O)c1 236589138 TYPLELPOBOGOJK-CQSZACIVSA-N 276.380 2.062 10 10 CECE C[C@@H]1CCN(Cc2ccc(Br)cc2O)CCN1 1947751937 JDEIQXNUYCUPRO-SNVBAGLBSA-N 299.212 2.339 10 10 CECE CC(C)CN(CCO)c1ccc(CN)c(Cl)c1 1948647746 XYNGEJZRPPVCFA-UHFFFAOYSA-N 256.777 2.253 10 10 CECE COc1c(F)cc(Br)cc1C(=O)C(C)=O 1951588634 GNXUPVSXCBEXNY-UHFFFAOYSA-N 275.073 2.369 10 10 CECE CC(=O)C(=O)c1cccnc1NC(=O)OC(C)(C)C 1951930433 YBZIUHVVXWNASB-UHFFFAOYSA-N 264.281 2.200 10 10 CECE Oc1c(Br)cccc1[C@@H]1NCCCC[C@H]1O 1952073861 ZQGZLVJOOYFHLL-MNOVXSKESA-N 286.169 2.330 10 10 CECE CCN(CC)c1ccc([C@@H]2C[C@@H](O)CCN2)c(O)c1 1952135030 IGZBHQWANDPZLZ-JSGCOSHPSA-N 264.369 2.024 10 10 CECE O=C1CCCN[C@@H]1c1ccc(C(F)(F)F)cc1O 1952457000 HXNMUJUUSYJGBF-LLVKDONJSA-N 259.227 2.405 10 10 CECE CCN[C@@H](c1ccccc1O)[C@H](O)c1c(C)n[nH]c1C 2148155663 MHDODCADVVFABH-LSDHHAIUSA-N 275.352 2.116 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)c1cnc(OC)s1 2148146918 GTBBLDPHVMOWOJ-CHWSQXEVSA-N 294.376 2.242 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@]1(O)C[C@H](C)O[C@H](C)C1 2148155650 WEBPPEDKFIOHDB-SHUKQUCYSA-N 279.380 2.361 10 10 CECE Nc1ccc(OCC(=O)NC[C@H]2CCCCS2)cc1 157885103 ZYXOTNKBLFIPDT-CYBMUJFWSA-N 280.393 2.050 10 10 CECE CCCCCNC(=O)[C@H](C)N(C)c1ccc(CN)cc1 34653868 BBIYFIUIRZWHDU-ZDUSSCGKSA-N 277.412 2.276 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@H]2C(N)=O)c(Cl)c1 2145612886 HLZVKIUNWPMUFJ-HZMBPMFUSA-N 295.814 2.465 10 10 CECE COC(=O)c1occc1CN(C)Cc1ccc(N)cc1 2148890896 NSUWQROCLYFHHA-UHFFFAOYSA-N 274.320 2.280 10 10 CECE Cc1c(NCc2ccc(O)c(O)c2)cccc1C(N)=O 36996054 YNGNRWCVAZBVOZ-UHFFFAOYSA-N 272.304 2.117 10 10 CECE C[C@H](Cn1cccn1)N[C@H](C)c1cc(O)ccc1O 37155284 CZFKMYZPBRCENG-GHMZBOCLSA-N 261.325 2.034 10 10 CECE C[C@@H](O)c1ccc(N2CCCCC2(CO)CO)c(Cl)c1 2146070808 BILWRGPEVUKJHN-LLVKDONJSA-N 299.798 2.107 10 10 CECE CC[C@@H](N)c1ccc(N2CC[C@@H](C)[C@@H]2C(=O)NC)cc1 2146447689 PMMODBCHJILJER-KCPJHIHWSA-N 275.396 2.057 10 10 CECE C[C@@H](CO)[C@@H](C)NCc1ccc2c(c1)CCCN2C 166935775 XGQORUFUXBWPHG-QWHCGFSZSA-N 262.397 2.176 10 10 CECE CNCc1ccc(N(C)Cc2cnn(C)c2C)c(C)c1 2152900917 BKKKWORBPVWREY-UHFFFAOYSA-N 272.396 2.393 10 10 CECE C[C@H]1[C@H](CC(=O)O)CCN1[C@H](C)c1cc(O)ccc1O 2153489596 DPTXGODHZYWJNY-AXFHLTTASA-N 279.336 2.344 10 10 CECE CP(C)(=O)CCCNCc1ccc(O)cc1O 2008073530 KJKROGBORPUMTD-UHFFFAOYSA-N 257.270 2.200 10 10 CECE Nc1ccc(OC[C@@H](O)CSC2CCC2)cc1 2008681803 RENQYFJEFHPVJO-LLVKDONJSA-N 253.367 2.294 10 10 CECE CN1CCc2cc(CNC[C@@H]3C[C@@H](O)C3(C)C)ccc21 2154212514 ATSLNXDWMMAEAQ-GOEBONIOSA-N 274.408 2.176 10 10 CECE NCc1ccc(N2CCC=C[C@H]2CO)cc1Br 2011253687 KYFBKGNGEKJFGR-LBPRGKRZSA-N 297.196 2.035 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H]2C)c(Cl)c1 2011373292 OAKMAUMUEFJHTH-VYUIOLGVSA-N 254.761 2.190 10 10 CECE C[C@@H](N)c1ccc(N(C)C2(CO)CC2)cc1Cl 2012609753 HOVRUIHHYCCQPI-SECBINFHSA-N 254.761 2.321 10 10 CECE COc1ccc(N(C)[C@@H]2CNC3(CCOCC3)C2)cc1 2155303071 UMBZMQSBYITQQL-AWEZNQCLSA-N 276.380 2.043 10 10 CECE COc1cnccc1C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2155556906 SWAXBFGVRDGUJC-SNVBAGLBSA-N 275.312 2.395 10 10 CECE CCN(C[C@H]1CCCO1)c1cc2c(cc1N)OCCO2 48953645 NIWGWFOBUFDXQC-LLVKDONJSA-N 278.352 2.045 10 10 CECE COc1cc(N(C)CP(C)(C)=O)ccc1CO 2024762424 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C[C@H](N)c1ccc(N(C)[C@@H]2CC[C@@H](C)OC2)cc1O 401386931 AVRPGCYTMFSXSR-NTZNESFSSA-N 264.369 2.416 10 10 CECE CC(C)(CN1CCOCC1)NCc1c(O)cccc1Cl 308639410 KGOJBWFMZJACSO-UHFFFAOYSA-N 298.814 2.246 10 10 CECE COc1ccc([C@H](NCCCN=[N+]=[N-])C(=O)O)c(F)c1 404607017 CWTQHGFRXNDIGI-NSHDSACASA-N 282.275 2.250 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)cc1 312508767 DENMEQZHFOVRTM-DQEXQMHNSA-N 272.392 2.302 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@](C)(CC)OC 319259426 BDNQYSQLWBKTIG-JQWIXIFHSA-N 272.349 2.023 10 10 CECE C[C@@H](NC1C[C@@H]2CC[C@H](C1)N2C)c1c(O)cccc1O 322852287 PWHJAUSQLHEVNM-ODWCKFRGSA-N 276.380 2.374 10 10 CECE C[C@H](C1CCC1)N(C)C[C@H](O)COc1ccc(N)cc1 325637579 WRAWVMPROMSSCY-DOMZBBRYSA-N 278.396 2.129 10 10 CECE COc1ccc(N(C)C[C@]2(CO)CCO[C@H](C)C2)cc1 2161526455 LUPALHLIOONFEJ-CJNGLKHVSA-N 279.380 2.309 10 10 CECE CO[C@H]1C[C@@H](N(C)Cc2cc(F)ccc2O)C[C@H]1OC 2172569294 LLDPMMUCXUCDFE-YOWGUQMCSA-N 283.343 2.156 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H]3[C@H](O)C[C@H]32)c(F)c1 2178168392 JQKQHGWFPAKVRY-APHBMKBZSA-N 278.371 2.283 10 10 CECE COC1CC2(C1)CN(CCCOc1ccc(N)cc1)C2 2162261925 CUZVMQXYOJLQMR-UHFFFAOYSA-N 276.380 2.149 10 10 CECE CN1CCCc2cc([C@@]3(O)C[C@@H]4CC[C@H](C3)N4)ccc21 2163103712 XBXMCBMUFBFRPQ-QLPKVWCKSA-N 272.392 2.171 10 10 CECE CCSC[C@@H](C)N(C)c1ccc2c(c1)NC(=O)[C@H]2N 707114359 FTACYNXEHRFFRJ-RNCFNFMXSA-N 279.409 2.216 10 10 CECE C[C@H]1CN(C)CCN(Cc2cccc(Cl)c2O)C1 707517476 MALRIKPWVZCCNR-NSHDSACASA-N 268.788 2.429 10 10 CECE Cc1cnc(CCNCc2ccc(O)c(O)c2)c(C)c1 689484167 KHRBXMKNMKNFFI-UHFFFAOYSA-N 272.348 2.442 10 10 CECE Nc1ccc(CCN2CCO[C@H](C(F)(F)F)CC2)cc1 687571903 IBMLFPTWJUCIES-ZDUSSCGKSA-N 288.313 2.465 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1cnnn1CC 379672924 OKCXHUMVSMULQC-OAHLLOKOSA-N 273.384 2.063 10 10 CECE Nc1ccc(CCN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 713139919 HDKFPJNWWYCNCP-XHSDSOJGSA-N 272.392 2.359 10 10 CECE Cc1ccc(O)c(CN(CCN)CC(F)(F)F)c1 713373612 QWJKXCQAFKRCKL-UHFFFAOYSA-N 262.275 2.024 10 10 CECE CCCN(C(=O)N1CCC[C@@H]1CO)c1ccc(N)cc1 2164689100 VQDKVZJFIKCNLW-CQSZACIVSA-N 277.368 2.062 10 10 CECE CC[C@H](N[C@H](C)c1ccc(OC)cc1O)[C@@H](C)O 387410169 MDMIUNGZFBPNMF-BREBYQMCSA-N 253.342 2.211 10 10 CECE CCCN1CC[C@@H](NCc2ccc3c(c2)CCN3C)C1 389131060 FEPBVTVQHPDKBP-MRXNPFEDSA-N 273.424 2.253 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@H]2CN(C)CC3)cc1C 394353405 PWVTZFGJWGNBPH-RDJZCZTQSA-N 273.424 2.387 10 10 CECE COC[C@H]1CCCCN1c1ccc([C@H](C)N)c(O)c1 395938451 DEQQEPAOLXNUSS-WCQYABFASA-N 264.369 2.417 10 10 CECE C[C@H](N[C@H]1CO[C@]2(CCOC2)C1)c1cc(F)ccc1O 2178983537 SZAOOBRZNRHOSI-JVLSTEMRSA-N 281.327 2.130 10 10 CECE CN[C@H](C)c1ccc(N(C)CC2[C@H]3COC[C@H]23)c(F)c1 2174643380 LVADWCYZJMWTLY-LERXQTSPSA-N 278.371 2.435 10 10 CECE COc1ccc(CN(C)C[C@H]2C[C@H]3CC[C@H]2O3)c(O)c1 2168089747 CJDVGGSHCCAVEU-XNRPHZJLSA-N 277.364 2.400 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H]2C[C@H]3C[C@@H]3CO2)c1 2179410824 FACSDXZITGMHEP-SFTQSGBHSA-N 277.364 2.476 10 10 CECE CCc1cc(C(=O)OC)n(Cc2cc(C)ccc2O)n1 2069943007 QMPGKBOKSMZICW-UHFFFAOYSA-N 274.320 2.294 10 10 CECE CCNC(=O)[C@@H]1CCCN1c1ccc([C@@H](C)O)cc1Cl 2169608156 YPQUYXVHTDPINB-YGRLFVJLSA-N 296.798 2.498 10 10 CECE CCN[C@@H](C)c1ccc(N2CC3(CC[C@H]3O)C2)cc1O 2179702129 AHHCSGFNODNHSR-XHDPSFHLSA-N 276.380 2.024 10 10 CECE CNCc1cc(F)c(N2CC[C@H](O)CC2(C)C)c(F)c1 2169889643 TVYAMPPWCOCTIM-NSHDSACASA-N 284.350 2.424 10 10 CECE CNCc1ccc(N2C[C@@]3(F)CCC[C@]3(CO)C2)cc1 2176643035 ZLVUXGFNOGQDBX-CVEARBPZSA-N 278.371 2.097 10 10 CECE C[C@]12CC[C@]1(C)CN(c1ccc3c(c1)NC(=O)[C@@H]3O)C2 2181189947 CZWCARGATINTGM-FVQBIDKESA-N 272.348 2.299 10 10 CECE Cc1nn(Cc2cc(Cl)ccc2O)c(N)c1C 2080106596 AMXYMNFGMNKXDB-UHFFFAOYSA-N 251.717 2.489 10 10 CECE Cn1nccc1[C@H]1CCN(c2ccc(CN)cc2F)C1 2171776802 XPJDOBDBCXYMSE-LBPRGKRZSA-N 274.343 2.012 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC=C[C@H]2CO)cc1O 2182333261 SATLYSAHFOUTQK-JSGCOSHPSA-N 276.380 2.190 10 10 CECE CNCc1ccc(OC)c(CN2C[C@@H](F)C[C@H](F)C2)c1 2182596417 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CCN[C@H](C)c1ccc(N2C[C@H](C(N)=O)CC[C@H]2C)cc1 250254955 CHOBRAQAHORADK-UMVBOHGHSA-N 289.423 2.447 10 10 CECE NC(=O)c1cccc([C@H]2CNc3ccccc3N2)c1 616681243 UEOTYMBQYMACQA-CQSZACIVSA-N 253.305 2.364 10 10 CECE CN(C)c1ccc(CN2CCO[C@@H](C(F)F)C2)cc1 801560055 NQHVFNYBASFHOV-CYBMUJFWSA-N 270.323 2.219 10 10 CECE C[C@@H]1CO[C@@H](COC(=O)CCOc2ccc(N)cc2)C1 2166392698 XTUBOXHRCWFCRR-SMDDNHRTSA-N 279.336 2.006 10 10 CECE CCOc1cccc(CN2CCN[C@H](C)C[C@H]2C)c1O 2164466852 NJCLQWUPRHEBJH-CHWSQXEVSA-N 278.396 2.363 10 10 CECE COC1(CN(C)c2cc3c(cc2N)OCCO3)CCC1 2167878874 FNDWCGZOJAHQQZ-UHFFFAOYSA-N 278.352 2.045 10 10 CECE CC(=O)C(=O)COC(=O)CC/C=C/c1ccccc1 808518857 IVTHXLLZJWDTAU-WEVVVXLNSA-N 260.289 2.181 10 10 CECE CCN1CCc2cc([C@@]3(N)C[C@@H]4COC[C@@H]4C3)ccc21 2163067611 YNOJLTPUKBUPIE-XOIINTDNSA-N 272.392 2.279 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)c1nc(C)c(C)[nH]1 2163068977 NYKKORYJNBQPGB-HNNXBMFYSA-N 270.380 2.328 10 10 CECE CCN1CCc2cc([C@H](NC)[C@H](O)[C@@H]3C[C@@H]3C)ccc21 2163123951 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COC1(C(F)(F)F)CN(c2ccc([C@@H](C)N)c(O)c2)C1 724171632 ULCWRUWPOSTWDP-MRVPVSSYSA-N 290.285 2.179 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cccc(OCCF)c1 2132975747 OMDVHZMXBPZMOA-UHFFFAOYSA-N 266.276 2.417 10 10 CECE CCn1nnc(C)c1CN1CCc2cc(OC)ccc21 823375515 XQWFLHJRQQJGBQ-UHFFFAOYSA-N 272.352 2.178 10 10 CECE CN(C)c1ccc(CN2C[C@@H](N)C(C)(C)C2)cc1F 903984705 TWJXXXANAYEZBG-CQSZACIVSA-N 265.376 2.061 10 10 CECE C[C@@H]1C[C@H](N(C)C(=O)c2cc(O)cs2)CCN1C 743536491 KYBVIOOJAJVIST-NXEZZACHSA-N 268.382 2.008 10 10 CECE CCOC(=O)c1coc(Sc2nccs2)n1 165933229 KUYOAYAAGYVVPU-UHFFFAOYSA-N 256.308 2.459 10 10 CECE CCC(C)(C)N[C@@H](C)C(=O)NCc1c(O)cccc1F 928708329 JXBFFTFQPYQWSN-JTQLQIEISA-N 282.359 2.314 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@H](O)C23CCC3)cc1F 850389459 XLYLINCOEYVARD-GJZGRUSLSA-N 278.371 2.285 10 10 CECE COC(=O)C1=CC[C@H](N[C@H](C)c2cc(OC)ccc2O)C1 858471140 BLCSYDFCTUXCDC-PWSUYJOCSA-N 291.347 2.313 10 10 CECE Cc1cc(C)c([C@H](C)N[C@H](CO)c2ccnn2C)c(O)c1 858435367 GRIYFCXEQNROFE-QWHCGFSZSA-N 289.379 2.127 10 10 CECE O=C(O)C1C[C@@H]2CC[C@H](C1)N2Cc1cc(F)ccc1O 698178026 FKSRCICOIOQIFB-MVCUKOFQSA-N 279.311 2.359 10 10 CECE CN(C)c1ccc(CN2CCCc3n[nH]cc3C2)cc1 854053994 HELJDLVYTIBORP-UHFFFAOYSA-N 270.380 2.424 10 10 CECE CCOC1CC2(C1)C[C@H]2C(=O)NCCc1ccc(N)cc1 867964245 WHCKDGGTTCQVRI-CKDBGZEDSA-N 288.391 2.133 10 10 CECE CC1(C)C[C@H](C(=O)O)CN(Cc2ccccc2O)C1 1875461503 VIUAKKKKQTWVDK-LBPRGKRZSA-N 263.337 2.325 10 10 CECE CCc1nc(C)c(C(=O)N2Cc3cccc(O)c3C2)o1 871205659 WRIQBOGMYASPSB-UHFFFAOYSA-N 272.304 2.407 10 10 CECE C[C@@H]1CNC[C@H]1CNCc1ccc(N2CCCC2)cc1 1119610779 GQSOZWLHIZVFBN-ZBFHGGJFSA-N 273.424 2.232 10 10 CECE CN(C)Cc1ccc(C(=O)N(C)Cc2ccccc2O)cn1 774043623 LADJXUYLYDXSCQ-UHFFFAOYSA-N 299.374 2.121 10 10 CECE CN(C)c1ccc([C@@H](N)C(F)(F)F)c(F)c1C#N 72195553 DTGJYMIQFDFSTJ-SNVBAGLBSA-N 261.222 2.325 10 10 CECE CN(Cc1ccccc1O)[C@@H]1CCC12CCNCC2 1877546806 WLTGRBJASHJXKA-OAHLLOKOSA-N 260.381 2.356 10 10 CECE COc1cnc(N(C)[C@@H](C)c2ccccc2O)nc1 1877537925 KEBQHQXDHYLLHB-JTQLQIEISA-N 259.309 2.388 10 10 CECE C[C@H](N[C@H]1CCN2CC[C@H]1C2)c1cc(F)ccc1O 1877905237 RNRVPOLKHPJUBQ-MJVIPROJSA-N 264.344 2.276 10 10 CECE C[C@@H]1OC2(CNCc3cc(F)cc(F)c3O)CC1C2 1878442028 VBUZRJAHFBBDFB-BQDOLQKVSA-N 269.291 2.328 10 10 CECE Nc1ccc(CNCC2(Br)CC2)cc1 1956578747 VTFDYARWVBQCTL-UHFFFAOYSA-N 255.159 2.286 10 10 CECE Cc1ccc(=O)n(CCCOc2ccc(N)cc2)c1 57878871 ODXZXWIIGHPHIB-UHFFFAOYSA-N 258.321 2.208 10 10 CECE C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N1CC(N=[N+]=[N-])C1 1885562797 KURKYKSHOMDCIT-IUCAKERBSA-N 297.359 2.057 10 10 CECE CCc1ccccc1S(=O)(=O)NCCCN=[N+]=[N-] 1963988534 UZBOHZRXMPFTHX-UHFFFAOYSA-N 268.342 2.228 10 10 CECE Cn1ccnc1CNCc1ccc2c(c1)CCCO2 1964048241 LFFSFZKTZCCGAI-UHFFFAOYSA-N 257.337 2.035 10 10 CECE COCc1cc(CN[C@H]2CCc3cccc(O)c32)on1 1964510043 YGHSXUYLAPXAQW-ZDUSSCGKSA-N 274.320 2.304 10 10 CECE Oc1cc(F)ccc1CN1CCCN2CCC[C@@H]2C1 1964561349 PIKAVCWMTMKVGC-CQSZACIVSA-N 264.344 2.201 10 10 CECE Cc1cccc([C@H]2NCCc3c2cc(O)c(O)c3O)c1 83658267 FBPVMKWFGHSROU-CQSZACIVSA-N 271.316 2.347 10 10 CECE Oc1ccc(O)c([C@@H]2NCCc3c(F)cc(O)cc32)c1 83627756 UQKIICNAVKAMEZ-OAHLLOKOSA-N 275.279 2.178 10 10 CECE CCC(=O)C(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 84628639 WOLDTSINHMOPKS-ZETCQYMHSA-N 263.318 2.281 10 10 CECE O=C(O)/C=C1\CCCN(c2ccc3c(c2)OCO3)C1 84624095 XBMHHRKEAFNAHB-UXBLZVDNSA-N 261.277 2.027 10 10 CECE C[C@@]1(C(=O)NCc2c(O)cccc2O)CC=CCC1 1178910197 AZSDTLUIIMIMAV-OAHLLOKOSA-N 261.321 2.460 10 10 CECE CN(CCOc1ccc(N)cc1)[C@@H]1CO[C@H](C2CC2)C1 691773160 HHFLKBQEICQZMG-HOCLYGCPSA-N 276.380 2.147 10 10 CECE CC1(OCC(=O)NCc2ccc(N)cc2)CCCC1 1964665817 DPNQRVZRIAWNFY-UHFFFAOYSA-N 262.353 2.234 10 10 CECE CC(C)(CNCc1ccc2c(c1)CCO2)n1cccn1 704895738 GNQKDKOWIPKQEO-UHFFFAOYSA-N 271.364 2.343 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1CCCCC12OCCO2 708421386 ROXXZKCYYYXPJK-ZDUSSCGKSA-N 299.317 2.446 10 10 CECE C[C@H](NCc1cc(F)cc(F)c1O)c1cn[nH]c1 708534570 AQSSKMIRPXWAMC-ZETCQYMHSA-N 253.252 2.244 10 10 CECE C[C@H](O)c1ccc(N2CC(OCC(F)F)C2)cc1 687931320 FEBODCPOOHCQFO-VIFPVBQESA-N 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267.300 2.105 10 10 CECE OCc1ccc(N2C[C@@H](CO)C3(CCCC3)C2)cc1 2118597091 KHMGTIDJDOCLDA-AWEZNQCLSA-N 261.365 2.168 10 10 CECE C[C@@H](NC(=O)c1cccc(O)c1O)c1ccccc1O 1454808757 XBQUFNDULGEPET-SECBINFHSA-N 273.288 2.294 10 10 CECE CN(O)Cc1cc(Br)cc(F)c1O 1536072227 VEBNTCFTBZMMMO-UHFFFAOYSA-N 250.067 2.115 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@]3(O)C=CCC3)ccc21 2119179982 RLRCEKGYNQVQGW-HZPDHXFCSA-N 258.365 2.150 10 10 CECE C[C@@H]1OCC[C@H]1CN(C)c1c(F)cc(CO)cc1F 2121139608 GSVOCGPKSGJBTC-ONGXEEELSA-N 271.307 2.318 10 10 CECE CN(CCCCN=[N+]=[N-])[C@@H]1COC2(CCOCC2)C1 2122448784 NSNOPKXMJNUOLL-LBPRGKRZSA-N 268.361 2.347 10 10 CECE O=C(/C=C\c1nccs1)NCc1c(O)cccc1F 1558457116 IPWVIZNTSHZFGL-PLNGDYQASA-N 278.308 2.317 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H](CO)[C@H]3CC[C@@H]2C3)cc1 2122171172 COZSRZQXPKKWMB-DDUYRFODSA-N 260.381 2.317 10 10 CECE O=C(NCc1c(O)cccc1O)[C@@H]1Cc2ccccc21 1639289508 RVBKSBSPCUWUQW-GFCCVEGCSA-N 269.300 2.054 10 10 CECE Cc1cnc2c(C(=O)N[C@@H](C)c3ccccc3O)cnn2c1 1635803215 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CC(C)c1noc(CN2CC[C@H](CN=[N+]=[N-])C2)n1 1912204845 YQMRGOJVWAIBDB-SECBINFHSA-N 250.306 2.325 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2cncs2)C1 1912200585 JIQIZMUGXLYZSX-QMMMGPOBSA-N 251.315 2.306 10 10 CECE CN1CC[C@@H]2[C@@H]1CCCN2Cc1cccc(F)c1O 2127344169 QCUXCSZFAGSWIX-UONOGXRCSA-N 264.344 2.200 10 10 CECE Oc1cc2c(cc1O)C[C@@H](Cc1ccccc1)NC2 13896117 FBQLLJKFEIWIRB-CQSZACIVSA-N 255.317 2.355 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](CO)CC2(C)C)c(F)c1 2127841531 DSOMUSUZHIHDKY-MNOVXSKESA-N 267.344 2.476 10 10 CECE CC(C)(C)OC(=O)N[C@H](CCCN=[N+]=[N-])C(=O)O 169722827 SZKWPJYNWXEPRJ-SSDOTTSWSA-N 258.278 2.055 10 10 CECE CCN[C@H]1CCCc2cc(N(C)[C@@H](C)CO)ccc21 2128271730 DKGZKVOUKUDNLL-LRDDRELGSA-N 262.397 2.491 10 10 CECE C[C@H]1CN(C)CCCN1c1ccc2c(c1)CC[C@@H]2N 2128316991 LUHCUCBFQGWYDP-LRDDRELGSA-N 259.397 2.163 10 10 CECE Cc1cc(CNC(C)(C)C)ccc1N1CCO[C@H](CO)C1 167286782 BVSQPRFNHSFQPK-HNNXBMFYSA-N 292.423 2.081 10 10 CECE CO[C@@]1(CN(C)c2ccc(CN)c(F)c2)CCSC1 2129725816 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CCN[C@H]1C(=O)Nc2cc(N3CC(C)(F)C3)c(Cl)cc21 2149824267 JCQKZSPHHFLCRW-GFCCVEGCSA-N 297.761 2.491 10 10 CECE Cc1ncsc1[C@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2147795641 FEYQTEZANBOIJU-ZIAGYGMSSA-N 289.404 2.177 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@@H]2COCCO2)cc1Cl 2143687580 PNJWBXGPYCKOFF-WCQYABFASA-N 298.814 2.472 10 10 CECE CNCc1ccc(N(C)C[C@H]2OCCO[C@@H]2C)c(Cl)c1 2143695020 OLTYJMFXVDJNRF-IAQYHMDHSA-N 298.814 2.300 10 10 CECE O=C(O)[C@H]1CCN[C@@H](c2ccc(Cl)cc2O)C1 1952452924 RGZRTSWVAIZGKD-OIBJUYFYSA-N 255.701 2.171 10 10 CECE CCC1CCN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)CC1 131356047 GVLJONFAGNSJRM-OAHLLOKOSA-N 273.380 2.289 10 10 CECE COc1cc(Cl)cc(CN2CCNCC(C)(C)C2)c1O 1972715179 NFQBHUMEKMLPLM-UHFFFAOYSA-N 298.814 2.486 10 10 CECE O=C(O)[C@@H]1CCCCN(Cc2cc(F)cc(F)c2O)C1 1972908956 MHRMIAXOYBMKRL-SECBINFHSA-N 285.290 2.357 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1CC[C@@]12CCCO2 1974348637 YVJSKGKSDYLOMA-JSGCOSHPSA-N 269.291 2.472 10 10 CECE COc1ccc(O)c(CN2CC[C@@H](CCN)C[C@H]2C)c1 2148104687 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CCN[C@@H](C)c1ccc(N2CC(C(C)(C)O)C2)cc1O 2152282677 HPRDFUYWGIRBEI-NSHDSACASA-N 278.396 2.270 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]([C@@H]3CCCO3)C2)cc1O 2153044118 YKZFGPKLTLPGNR-MKBNYLNASA-N 276.380 2.417 10 10 CECE Cc1cc(N(C)C[C@]2(C)CCCN2C)ccc1CCN 2154953559 SUWIOSBTBHJJOI-KRWDZBQOSA-N 275.440 2.417 10 10 CECE CCOC(=O)c1cnc(S[C@@H](CC)C(=O)O)s1 2011473975 KLYYKZPQKNJFSC-LURJTMIESA-N 275.351 2.275 10 10 CECE CN1C[C@@H]2CCC[C@@H](NCc3c(O)cccc3F)[C@H]2C1 2160778416 PMQCUPFRJRTVMN-CORIIIEPSA-N 278.371 2.351 10 10 CECE CC(C)[C@H](CN(C)C)N[C@@H](C)c1cc(O)ccc1O 49196033 IFUVDKMTMLDFCX-FZMZJTMJSA-N 266.385 2.335 10 10 CECE NCc1ccc(N2C[C@H]3COCC[C@H]32)c(Cl)c1 2017877796 NANKICWHEBESGP-CMPLNLGQSA-N 252.745 2.024 10 10 CECE OCc1ccc(N2CC[C@H]3COC[C@H]32)cc1Cl 2021413207 SOTHVKCVKGDXHP-GXFFZTMASA-N 253.729 2.057 10 10 CECE Cn1cc2c(n1)C[C@@H](NCc1cc(Cl)ccc1O)CC2 2159961001 PUFNDIYDLYSRQJ-ZDUSSCGKSA-N 291.782 2.426 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(F)c2)[C@H](C)CCO1 2031632015 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CCN1CCc2cc([C@H](O)[C@@H]3CCCCN3)ccc21 2106806250 VHZOFSIZBLVREJ-HOCLYGCPSA-N 260.381 2.245 10 10 CECE Nc1ccc(NC(=O)Nc2ccnn2C2CC2)cc1 2087264810 ZWKPTUXEGVNRBX-UHFFFAOYSA-N 257.297 2.444 10 10 CECE NN[C@@H](c1ccccc1O)c1ccc(F)c(F)c1F 2090037914 RSYSTMLVFSAECJ-ZDUSSCGKSA-N 268.238 2.362 10 10 CECE CSCC[C@@H](O)CCNCc1cc(F)cc(F)c1O 2090379517 LYQCBXKWGIZWAZ-NSHDSACASA-N 291.363 2.264 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)c1csc(C)n1 2092625835 YRZLVSLAENNCJN-UHFFFAOYSA-N 297.405 2.249 10 10 CECE C[C@@H]1CCC[C@@H](Cn2ccc3c(c2=O)CNCC3)C1 2094407141 NDMQTUJMCRCMDZ-CHWSQXEVSA-N 260.381 2.320 10 10 CECE CCN(C(=O)[C@@H]1C[C@H]2C[C@H]2CO1)c1ccc(N)cc1 2095373818 SUADQVLBFNEICQ-SUNKGSAMSA-N 260.337 2.047 10 10 CECE COc1ccc(CNC(C)(C)CCN(C)C)c(O)c1 2096084118 MZUYLNZCJJJESH-UHFFFAOYSA-N 266.385 2.221 10 10 CECE Nc1ccc(N2CCN(Cc3cnsc3)C2=O)cc1 2097790782 PWPLWLCWPLFZAZ-UHFFFAOYSA-N 274.349 2.168 10 10 CECE [N-]=[N+]=NCCCNC1(C(N)=O)C2CCCC1CCC2 2112823309 JIOQYPXABACVCG-UHFFFAOYSA-N 265.361 2.101 10 10 CECE 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278.396 2.418 10 10 CECE CNCc1cc(OC)ccc1N1CCOCC2(CC2)C1 2235954032 JLORWDQMMDBIAS-UHFFFAOYSA-N 276.380 2.031 10 10 CECE COc1ccc(N2CCOCC23CCC3)c(C(=O)O)c1 2235948137 ODVMXEVTWXYPMT-UHFFFAOYSA-N 277.320 2.153 10 10 CECE COc1ccc(N2CCO[C@@H](C(C)(C)C)C2)c(CO)c1 2236000639 WCSZNHOBGJXQGJ-OAHLLOKOSA-N 279.380 2.439 10 10 CECE CN1CCCc2cc(N3CCC[C@@H](O)CC3)ccc21 2226663812 VVNMXLCBLAREKH-OAHLLOKOSA-N 260.381 2.420 10 10 CECE CC1=CC[C@H](CNS(=O)(=O)Cc2ccc(N)cc2)CC1 2237354453 QVTHFVCTXXCTKW-ZDUSSCGKSA-N 294.420 2.435 10 10 CECE CCNC[C@H]1CC[C@H](COc2ccc(N(C)C)cc2)O1 2237695871 NHHPNMNFYHIMCA-HZPDHXFCSA-N 278.396 2.289 10 10 CECE COc1ccc(N2CC[C@H]3CCO[C@H]3C2)c(C=O)c1 2227697903 VRWHSIFHHIXDAF-NHYWBVRUSA-N 261.321 2.123 10 10 CECE COC[C@H](CNC1CCC1)Oc1ccc(N(C)C)cc1 2237705781 ZZGOAMYCUQZPLP-INIZCTEOSA-N 278.396 2.289 10 10 CECE Cc1cc(N(C)CC23COCC(C2)C3)ccc1CN 2228160882 ILPYAAWJLWQONX-UHFFFAOYSA-N 260.381 2.317 10 10 CECE CCc1nccnc1C(=O)CCc1ccc(N)cc1 2228392202 WGEMGBNAAARQFO-UHFFFAOYSA-N 255.321 2.437 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC=C[C@@]2(C)CO)c(F)c1 2228874609 FZVAXEALAUWAGZ-OTYXRUKQSA-N 268.307 2.112 10 10 CECE CCNCc1ccc(N2C[C@@H](C)N(C)C[C@@H]2C)cc1 2229731617 RMVBMBDLHWWRAO-KGLIPLIRSA-N 261.413 2.325 10 10 CECE CC[C@H](C)NCc1cc(F)c(N2C[C@@H](O)[C@H]2C)c(F)c1 2240030292 BVIXBFMERAWQOA-IMSIIYSGSA-N 284.350 2.422 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC[C@@H](CO)C(F)(F)C1 2240821068 BFINAGCCWUDSIY-AAEUAGOBSA-N 284.350 2.469 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@@H](C)O)cc2C)C1 2240842085 OPPBXDLNHAZRPC-SNPRPXQTSA-N 279.380 2.288 10 10 CECE CC(C)NCCNCc1cc(Br)ccc1O 2243477243 FJNBSMAVRLCPLP-UHFFFAOYSA-N 287.201 2.242 10 10 CECE COC1(CSc2ncc([C@@H](C)N)s2)CCOCC1 2254357989 VPAPWXBVAOIPSL-SECBINFHSA-N 288.438 2.451 10 10 CECE COc1cccc(C(=O)N2CC(N=[N+]=[N-])C2)c1Cl 2256326827 GDZQSCREMFMZEC-UHFFFAOYSA-N 266.688 2.483 10 10 CECE c1csc(CNCc2ccc(N3CCNCC3)cc2)c1 2286066856 ZLAAQRPKIFVKGL-UHFFFAOYSA-N 287.432 2.448 10 10 CECE CSc1ncc(CN[C@@H]2C[C@H]3CN[C@@H](C3)C2)s1 2248708748 SMDIRAGEHFOUNX-LPEHRKFASA-N 269.439 2.095 10 10 CECE CSc1ncc(CNC[C@@]23CC[C@H]2CCN3)s1 2248745156 ONPODUKEIQBLQL-CABZTGNLSA-N 269.439 2.097 10 10 CECE CSc1ncc(CN[C@@H]2C[C@H]3C[C@H]2C[C@H]3N)s1 2248706421 XHGJYRCRGDNVOO-JZSSXWJLSA-N 269.439 2.080 10 10 CECE CSc1ncc(CN[C@H]2CCN[C@H]2C2CC2)s1 2248700181 KHSXBHANBLKYRK-QWRGUYRKSA-N 269.439 2.095 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1ccc([C@@H](C)O)cc1F 2260374915 YHNVLKDUXMXMJJ-GAJTVXKRSA-N 253.317 2.229 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@H]3[C@@H]2CN)cc1Cl 2270410496 MLKOGTFXRUEYCB-SBMIAAHKSA-N 282.771 2.141 10 10 CECE CN1CCCc2cc([C@@]3(O)C[C@H]4CO[C@H]3C4)ccc21 2270738429 PADJWCQYDSAILD-UVBJJODRSA-N 259.349 2.065 10 10 CECE COc1cc(Cl)cc(CN[C@H]2C[C@H]3CO[C@H]2C3)c1O 2270756553 MVJYGRGDBUWMPR-ZHAHWJHGSA-N 283.755 2.321 10 10 CECE CO[C@H](CSc1ncc([C@H](C)O)s1)[C@H]1CCOC1 2261504297 UWXXGVMDYCBMGN-LPEHRKFASA-N 289.422 2.340 10 10 CECE CCO[C@@]1(CN2CCC(CN=[N+]=[N-])CC2)CCOC1 2271596129 GHDXKAOEUIBECD-CYBMUJFWSA-N 268.361 2.204 10 10 CECE CC[C@@H](CCO)S[C@@H](C)C(=O)Nc1ccc(N)cc1 2273753943 XRAIGGBZWDUBEP-GWCFXTLKSA-N 282.409 2.490 10 10 CECE OCc1ccc(N2C[C@H](O)C[C@@H]3CCCC[C@H]32)cc1 2264944479 IOZHSXYIQNKNLS-NUEKZKHPSA-N 261.365 2.309 10 10 CECE C[C@@H](C(F)F)n1cc(COc2ccc(N)cc2)nn1 2278399326 NKTOJHLOUAICMO-QMMMGPOBSA-N 268.267 2.265 10 10 CECE C[C@H]1COC(C)(C)CN1c1ccc(CN)c(F)c1F 2268779351 BVZKTDDFCFSXTB-VIFPVBQESA-N 270.323 2.427 10 10 CECE CN1CC[C@](C)(COC(=O)Nc2ccc(N)cc2)C1 2278904413 UTGDKTWVYWZZAK-AWEZNQCLSA-N 263.341 2.159 10 10 CECE COc1cc(C)c(N2C[C@@H](N)[C@H](C(F)F)C2)c(C)c1 2269581398 XHQJJKIVNWLDSW-VXGBXAGGSA-N 270.323 2.341 10 10 CECE Cc1cc(N2C[C@@H]3CC[C@H](O)[C@H]3C2)ccc1[C@@H](C)O 2269696787 YKBMROBSPSBKSV-KNPMLCFXSA-N 261.365 2.255 10 10 CECE COC[C@@H](CN(C)c1ccc([C@H](C)O)c(C)c1)OC 2269674960 SKWANSOKLMCTHI-GXTWGEPZSA-N 267.369 2.146 10 10 CECE CC[C@@H](O)c1ccc(N2CCOC(C)(C)[C@@H]2CO)cc1 2282893250 OOGFMLGUBPBITK-CABCVRRESA-N 279.380 2.106 10 10 CECE COc1ccc(N2CCO[C@@H](CO)C2)c2ccccc12 2294612271 XNYJGCSALPFLIZ-GFCCVEGCSA-N 273.332 2.046 10 10 CECE CC[C@]1(CO)COCCN1c1ccc([C@H](C)O)c(C)c1 2285167554 NKTCOEOTJFKDGX-BBRMVZONSA-N 279.380 2.026 10 10 CECE Cc1cc(N2CCN(CC(F)F)CC2)ccc1[C@H](C)N 2285123988 KPRBMOLHQRKMNC-LBPRGKRZSA-N 283.366 2.402 10 10 CECE COc1ccc(N2[C@H](CO)[C@H]3CC[C@@H]2C3)c(OC)c1C 2295379322 ZEFCMVGBCBYFIZ-OUCADQQQSA-N 277.364 2.362 10 10 CECE COc1ccc(N2CC[C@H]3[C@H](C2)[C@@H]3CO)c(OC)c1C 2295463294 MYTWWKXIHSWCQA-RWMBFGLXSA-N 277.364 2.077 10 10 CECE COc1ccc(N(C)[C@H]2CNCC[C@@H]2C)c(OC)c1C 2295435070 OKTJICZQNPNVQZ-FZMZJTMJSA-N 278.396 2.446 10 10 CECE COc1ccc(N2CC[C@H](N)C(F)(F)C2)c(OC)c1C 2295438173 UBAJNAZTBONWBB-LBPRGKRZSA-N 286.322 2.185 10 10 CECE CCCN[C@H]1C(=O)Nc2cc(N(C)[C@H](C)CF)ccc21 2285726709 MNKGUDDZJMTZSU-QMTHXVAHSA-N 279.359 2.474 10 10 CECE COC(=O)c1cc(C)nc(OCc2ccc(N)cc2)c1 2296082123 WYLNZRKLHMXGPR-UHFFFAOYSA-N 272.304 2.338 10 10 CECE CCCN(CCCO)c1c(OC)cc(OC)cc1OC 2287067386 GLSWVYAGIXHVSB-UHFFFAOYSA-N 283.368 2.311 10 10 CECE CC[C@@H](c1ccccc1O)N(C)[C@@H]1CCCCNC1=O 368022060 MPZOSYBBUWJYFH-UONOGXRCSA-N 276.380 2.444 10 10 CECE Cc1csc(CNC(=O)C=Cc2ccc(O)c(O)c2)n1 2307987501 LSQZNAQUYJVHKO-UHFFFAOYSA-N 290.344 2.192 10 10 CECE COc1ccc(N2CC[C@H](O)[C@H](C)[C@H]2C)c(F)c1 2321294711 RYDSWLQQTUBELV-RULNRJAQSA-N 253.317 2.430 10 10 CECE Nc1ccc(CCCN2C(=O)[C@H]3C[C@@H]2[C@@H]2C[C@@H]32)cc1 2329266179 WJQDMMMLOWXMGZ-APIJFGDWSA-N 256.349 2.068 10 10 CECE COc1ccc(O)c([C@@H](C)N(C)C[C@@H]2C[C@H]2OC)c1 2331737443 PGJJWBGXTHNFRE-JRPNMDOOSA-N 265.353 2.429 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@]3(O)C[C@H]3C2)cc1C 2334468864 OQSZBVZFLUGCQV-HEHGZKQESA-N 260.381 2.237 10 10 CECE C[C@@H](c1ccccc1O)N(C)[C@H]1CSC2(CNC2)C1 2339809620 UGXAFBNDLRTYIY-NWDGAFQWSA-N 278.421 2.233 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H]1CN2c1ccc2c(c1)CC[C@H]2N 2340740060 KRCIFZWYFIGVEQ-DDUYRFODSA-N 258.365 2.246 10 10 CECE Cc1c([C@H](C)N)ccc(N2CCN(C)[C@@H]3C[C@@H]32)c1C 2340848728 NTSKPNZNTUKWEK-MAZHCROVSA-N 259.397 2.216 10 10 CECE CSc1cc(N2CC[C@@H]3OCC[C@H]3C2)ccc1CN 2353858889 SQFRAXNOQKMGCZ-JSGCOSHPSA-N 278.421 2.482 10 10 CECE CN1CCc2cc([C@@H](CN)N3C[C@@H]4CCC[C@@H]43)ccc21 2356262456 VKXWUTAJKQTPLD-BHYGNILZSA-N 271.408 2.163 10 10 CECE Nc1ccc(NC(=O)CSC[C@@H]2CCCO2)cc1 226132035 ARQDMHDCVOSENP-LBPRGKRZSA-N 266.366 2.120 10 10 CECE CCCNCc1ccc(N(CC)CC(=O)NCC)cc1C 50584079 CAYKRVPCCONPHD-UHFFFAOYSA-N 291.439 2.457 10 10 CECE CCN[C@H](C)c1ccc(N2CC(OC)C2)c(F)c1 310926384 KTKJXPBLEWJPRQ-SNVBAGLBSA-N 252.333 2.331 10 10 CECE C[C@@H]1CCC[C@@H](CN)N1Cc1cc(F)ccc1O 235257935 HEXLGHJSFGLNLE-MFKMUULPSA-N 252.333 2.233 10 10 CECE C[C@H]1CN(CCCC(=O)Nc2ccc(N)cc2)CCCO1 61912858 DXWYPCGMSMREKD-ZDUSSCGKSA-N 291.395 2.098 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)C1CCOCC1 235497874 CWSISWOJMGWPNX-JTQLQIEISA-N 251.326 2.270 10 10 CECE COC(=O)/C=C1/SC(Nc2ccccc2C)=NC1=O 33328272 CRNNRPGFHLGDGV-JXMROGBWSA-N 276.317 2.093 10 10 CECE O=C(NCc1ccccc1O)c1cc(Cl)nnc1Cl 236562490 IHWPCVKGTPSELC-UHFFFAOYSA-N 298.129 2.419 10 10 CECE CCCC1(NC(=O)c2cc(O)c(O)c(O)c2)CCC1 2132402877 FZKDGMPNXQBLPH-UHFFFAOYSA-N 265.309 2.256 10 10 CECE CN1CC[C@@H](N(C)c2ccc(/C=C/C(=O)O)cc2F)C1 312684615 LQXWEUSXKOBIFH-FVOPLDGLSA-N 278.327 2.064 10 10 CECE O[C@H]1CCCc2cc(N3C[C@H](O)C34CCC4)ccc21 2136755307 PLHRMEHZGXFRAA-GJZGRUSLSA-N 259.349 2.160 10 10 CECE COc1ccc(N2CC[C@H](CCC(=O)O)C2)c([N+](=O)[O-])c1 134446835 XTSDAKYKLRIDJN-JTQLQIEISA-N 294.307 2.295 10 10 CECE C[C@@H]1SCCN(CC(=O)Nc2ccc(N)cc2)[C@H]1C 132179482 UKRWJRKHQNIUGG-QWRGUYRKSA-N 279.409 2.033 10 10 CECE COCCN(C(=O)CCc1ccc(N)cc1)[C@H](C)C1CC1 42271733 RAKQXOIPOZRKTI-CYBMUJFWSA-N 290.407 2.475 10 10 CECE COc1ccc(CNCc2cccc(O)c2O)cc1OC 41116522 QNJJMTLUMGKFHI-UHFFFAOYSA-N 289.331 2.405 10 10 CECE C=Cn1cc(/C=C2/SC(N3CCCCC3)=NC2=O)cn1 194522331 LYMQAIQZNRYYPD-XYOKQWHBSA-N 288.376 2.440 10 10 CECE CCCN[C@H](C)c1ccc(N2CCCNC(=O)C2)c(F)c1 87884427 JABCXIIDTSYWOF-GFCCVEGCSA-N 293.386 2.213 10 10 CECE CC(C)(C)CS(=O)(=O)Nc1ccc(O)c(F)c1 85200963 CXLDTYNCNYRICJ-UHFFFAOYSA-N 261.318 2.319 10 10 CECE CN[C@H](Cc1cc(C)nn1C)c1ccc(N(C)C)cc1 97273493 RHTJBRMEIBFTOP-MRXNPFEDSA-N 272.396 2.298 10 10 CECE CN(C)[C@H]1CCCN(c2ccc(/C=C/C(=O)O)cc2)C1 91392676 GHKCCUVEQJQPIV-VSGCLNPGSA-N 274.364 2.315 10 10 CECE COc1ccc(F)cc1[C@@H](NN)c1ccc(N(C)C)cc1 97777182 NMTIRUPCSAYQLM-INIZCTEOSA-N 289.354 2.453 10 10 CECE COc1ccc(CN(CC2CCNCC2)C2CC2)c(O)c1 94021445 BMMKHOJRNNYAEV-UHFFFAOYSA-N 290.407 2.365 10 10 CECE Cc1c(/C=C\C(=O)N(C)Cc2ccccc2O)cnn1C 255633362 ASYFGSCJNAHNSB-HJWRWDBZSA-N 285.347 2.106 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3NC(=O)CC[C@H]3C2)cc1 252514391 KRYVOCNLFUCKPE-IVMMDQJWSA-N 287.407 2.072 10 10 CECE CCc1cc(OC)c(O)c(CNOC)c1Br 258592194 QPKZBYADJKQPBU-UHFFFAOYSA-N 290.157 2.377 10 10 CECE FC1(F)Oc2ccc(N3CCC[C@@H]4CNC[C@@H]43)cc2O1 2162850032 LRNMWZHYPCFTDH-KOLCDFICSA-N 282.290 2.196 10 10 CECE Cn1c(C(=O)O)cnc1-c1ccc(N2CCCC2)cc1 2163100337 QDSUJAAFHHEQLL-UHFFFAOYSA-N 271.320 2.386 10 10 CECE CN1CCc2cc([C@H](N)c3csc4cncn34)ccc21 2163137913 IDLKNLYEFKNVTM-HNNXBMFYSA-N 284.388 2.436 10 10 CECE CN(C)c1ccc([C@H](N)[C@](C)(O)c2ccccn2)cc1 2163139993 DPPHBKREJGHAEC-JKSUJKDBSA-N 271.364 2.055 10 10 CECE C[C@H](NCc1cnn(C)n1)c1cc2c(cc1O)CCCC2 806167428 VRCHUVFCDJRCPJ-NSHDSACASA-N 286.379 2.250 10 10 CECE Nc1ccc(OCCC(=O)OC[C@@H]2CC23CC3)cc1 722625709 CGUWQQVFIQSGDP-NSHDSACASA-N 261.321 2.381 10 10 CECE COc1cccc(CNCc2cn(C3CCC3)nn2)c1O 825915807 ARHKXAGXSAPXGH-UHFFFAOYSA-N 288.351 2.007 10 10 CECE O=C(Nc1ccccc1F)c1cc(O)c(O)c(O)c1 586731325 SQRZKZLKUDZELI-UHFFFAOYSA-N 263.224 2.195 10 10 CECE CC1(C)CC[C@@H](CC(=O)NCc2ccc(O)c(O)c2)OC1 901131402 KMRSGDFXQWKJQW-LBPRGKRZSA-N 293.363 2.309 10 10 CECE CC/C=C(\C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832279247 HWRBPGXYAZHCIG-KXCGHJCSSA-N 275.396 2.225 10 10 CECE CN1[C@H]2CCC[C@H]1CC(NC(=O)c1cc(O)cs1)C2 743719984 FZEXIJAMOOWVMF-QWRGUYRKSA-N 280.393 2.199 10 10 CECE CCN1CC[C@@H](N(C)c2ccc(/C=C/C(=O)O)cc2)C1 688521895 YPIQLEBHZRBYRX-RZIFZGNASA-N 274.364 2.315 10 10 CECE CCCC[C@](C)(CO)NCc1cc(OC)ccc1O 843426347 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CCN(CC)c1ccc([C@H](NN)c2cc(C)[nH]n2)cc1 2163100548 SAFWARKQMMZLSM-HNNXBMFYSA-N 273.384 2.117 10 10 CECE C[C@@H]1CN(c2cc3c(cc2N)OCC(=O)N3)[C@H](C)[C@H]1C 399458920 BHARXXDVMPNQII-KXUCPTDWSA-N 275.352 2.080 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)[C@H](C)C[S@@](C)=O 399850618 HIAMVHVMKQJDSE-AUSHCKSDSA-N 273.373 2.291 10 10 CECE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCC2(C1)N=N2 2062203503 HUAHZUAPBRFQPG-MWLCHTKSSA-N 289.335 2.107 10 10 CECE CC(C)N(c1ccc(CN)cc1)[C@@H]1C[P@@](C)(=O)C[C@@H]1O 2172989549 XHFGQRGDJZSFMI-QEEYODRMSA-N 296.351 2.096 10 10 CECE CN(C)c1ccc(CNCc2cnsc2C(=O)O)cc1 2173325063 MDSVHEFMFRAIBX-UHFFFAOYSA-N 291.376 2.197 10 10 CECE Cc1ccc(O)c(Cn2ncc(CN)c2Br)c1 2070335010 FOTLUWODNCBVPG-UHFFFAOYSA-N 296.168 2.167 10 10 CECE C[C@@H]1CC[C@H](CNCc2cc3c(cc2O)OCO3)OC1 2174061995 ZQTIZQWQHBQWBJ-ZYHUDNBSSA-N 279.336 2.026 10 10 CECE CN(C)c1ccc(CN2CCC(F)(CN)CC2)cc1 1222533001 RCZZAXFVVGXRQT-UHFFFAOYSA-N 265.376 2.015 10 10 CECE CC[C@H](N)c1ccc(N2CCO[C@]3(CCOC3)C2)cc1 2168211763 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272.439 2.374 10 10 CECE C[C@H](NCCc1cncs1)c1ccc(O)cc1O 2029980942 UGYPXCXKDXCUIA-VIFPVBQESA-N 264.350 2.448 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](C)[C@H]2CO)cc1O 299947941 BWSMGIVJUBXIIK-LALPHHSUSA-N 278.396 2.270 10 10 CECE CCSC1CN(c2ccc(CO)cc2[N+](=O)[O-])C1 2036378174 YYAZEUSUAWZQIL-UHFFFAOYSA-N 268.338 2.029 10 10 CECE CC[C@@H]1CCN(Cc2cc(OC)ccc2O)[C@H](CN)C1 300172754 WHHQQMAQADIXLK-OCCSQVGLSA-N 278.396 2.350 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@H](CN)CC[C@H]1C 300438427 BUGFLUYBHRIBFG-WOPDTQHZSA-N 264.369 2.218 10 10 CECE CC[C@@H]1[C@@H]2CNC[C@H]2CN1[C@H](C)c1c(O)cccc1O 300443588 XRRDLVCHHMXCSW-YVECIDJPSA-N 276.380 2.089 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@](F)(CO)C2)cc1 2039796626 KJGBHQOOUWTJRY-FZMZJTMJSA-N 252.333 2.007 10 10 CECE C[C@@H](N)c1ccc(N2CCC(F)(F)[C@@H](CO)C2)cc1 403884646 OTQBKGCHPICYLG-ZYHUDNBSSA-N 270.323 2.160 10 10 CECE C[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1cc(O)ccc1O 311699496 HIVBPESBAVTRLR-KVQFHVITSA-N 263.337 2.316 10 10 CECE COc1ccc(O)c(CN2CCC[C@]23CCOC3)c1 311738965 AZEBJCQABNAVEP-OAHLLOKOSA-N 263.337 2.156 10 10 CECE CCCNc1nc(C)c(C)nc1-c1ccn(C)c(=O)c1 315291363 HMPACZHPFWINPF-UHFFFAOYSA-N 272.352 2.281 10 10 CECE CN(C)CC[C@@H]1CCN(c2c(F)cc(CO)cc2F)C1 700840526 KWOOWASEILTSCA-LLVKDONJSA-N 284.350 2.235 10 10 CECE CCc1cc(CNCc2ccc3c(c2)CCO3)n(C)n1 2160558941 FHCFUSJKIFILCZ-UHFFFAOYSA-N 271.364 2.207 10 10 CECE CP(C)(=O)[C@H]1CC[C@H](NC(=O)c2cccc(O)c2O)C1 2160829593 MISGSOKMVCRKGU-UWVGGRQHSA-N 297.291 2.371 10 10 CECE CCC[C@H](CC(=O)NCCN=[N+]=[N-])n1ccnc1 701269827 BDJCIKYFCBYBQZ-SNVBAGLBSA-N 250.306 2.041 10 10 CECE CCNCc1ccc(N2CCn3ncnc3C2)cc1Cl 2170408318 OLJGDLDVAWZEJV-UHFFFAOYSA-N 291.786 2.061 10 10 CECE CCO[C@H]1CCN(c2ccc(CN)c(F)c2F)C1 701667761 UBJVZTHRLDQSOZ-JTQLQIEISA-N 256.296 2.039 10 10 CECE CCCN([C@H]1CCNC1=O)[C@@H](C)c1cc(C)ccc1O 2171230337 BSNRWOCOKVVWRO-JSGCOSHPSA-N 276.380 2.362 10 10 CECE COc1cc(N)c(N2CC(OC(C)(C)C)C2)cc1OC 707227989 JUVVWVBTTADAJS-UHFFFAOYSA-N 280.368 2.290 10 10 CECE COc1ccc(N2CCCCC[C@@H](N)C2)c([N+](=O)[O-])c1 709055678 KTKLWUWXXPNXLP-LLVKDONJSA-N 279.340 2.311 10 10 CECE CC[C@@]1(C)COCCN1Cc1ccc(OC)cc1O 687973491 MAZFVWVHTBWPCX-HNNXBMFYSA-N 265.353 2.402 10 10 CECE O=C1N=C(N2CCOCC2)SC1=Cc1ccccc1F 2053493872 HHKPJHSJIVFVHW-UHFFFAOYSA-N 292.335 2.128 10 10 CECE Cc1cc(N(C)C[C@H](C)CO)ccc1CNC1CC1 688441122 YPDRHZGWVUVLNC-LBPRGKRZSA-N 262.397 2.312 10 10 CECE CO[C@@H]1CCN(c2ccc(OC(C)C)cc2)[C@@H](CN)C1 2162650086 NQHNZOCAEWXPKE-GDBMZVCRSA-N 278.396 2.416 10 10 CECE Nc1ccc(CS(=O)(=O)N2C[C@H]3CCC[C@@H](C3)C2)cc1 379912123 ULEAIEFFMPOCOM-KBPBESRZSA-N 294.420 2.221 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[S@@](=O)C[C@@H]1C 2171968024 FPKYBUPGZHHLBW-RNODOKPDSA-N 292.448 2.204 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H](CN)C3CCC3)ccc21 2163080510 UTOSZRMOYVEPBA-RDJZCZTQSA-N 274.408 2.477 10 10 CECE Oc1cc2c(cc1CNC[C@@]13CCC[C@H]1C3)OCO2 693633556 WQWCCFSRCBUOLE-NHYWBVRUSA-N 261.321 2.401 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@@H]2CNCC[C@H]21 715021250 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CC(C)(C)[C@@H]1NC[C@@H]1NCc1ccc2c(c1)CCCO2 2196888425 SLTKLVPXQVPUOR-GOEBONIOSA-N 274.408 2.488 10 10 CECE CC1(C)C[C@H](c2cncn2Cc2ccccc2O)CN1 2193383458 ZRQJTCBANIBRAI-ZDUSSCGKSA-N 271.364 2.493 10 10 CECE CN1CCCc2cc([C@H](N)C[C@H]3[C@@H]4COC[C@@H]43)ccc21 2188900149 WHNNDIAXJJOORH-LVQVYYBASA-N 272.392 2.351 10 10 CECE CN(C)c1ccc([C@H](CN)N2C[C@@H](F)C[C@H](F)C2)cc1 2182605451 MUEDGBCLOITLBO-YDHLFZDLSA-N 283.366 2.134 10 10 CECE Nc1ccc(CN2C[C@]3(C(=O)O)CCC[C@]3(F)C2)cc1 2197572848 BZUTVBBGQXQXNZ-GJZGRUSLSA-N 278.327 2.048 10 10 CECE OCC1(CO)CCC(NCc2cccc(Cl)c2O)CC1 2189838696 JDHXLLMOAPLNGW-UHFFFAOYSA-N 299.798 2.049 10 10 CECE COC[C@@](C)(CN(C)[C@H](C)c1c(O)cccc1O)OC 2198138173 CSQXQRAIYYCHPZ-IAQYHMDHSA-N 283.368 2.142 10 10 CECE COC[C@@H](CN(C)c1ccc2c(c1)CCC[C@H]2N)OC 2184687677 UHQMSYWJFVOYMZ-GDBMZVCRSA-N 278.396 2.120 10 10 CECE Cc1cnc(OCCc2ccc(N)cc2)c(C(=O)O)c1 2184607726 KEOSVADLUWIHSD-UHFFFAOYSA-N 272.304 2.292 10 10 CECE CN(c1ccc2c(c1)CCC[C@H]2O)[C@@H]1CN2CC[C@H]1C2 2184684031 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C[C@H](O)c1cc(F)c(N2C[C@@H](C)[C@@H](N(C)C)C2)c(F)c1 2194507299 BRBWAVZBXCLADS-BFVZDQMLSA-N 284.350 2.404 10 10 CECE CCNCc1ccc(N2C[C@H]3CC(O)C[C@@H]3C2)cc1C 2185187106 QTQIVTJBFRKVED-HUUCEWRRSA-N 274.408 2.312 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@@](F)(CO)C2)c(F)c1 2194696671 GRSKHHATMSVBCP-XPTSAGLGSA-N 288.313 2.285 10 10 CECE C[C@H]1CCN(c2c(F)cc([C@@H](C)N)cc2F)C[C@@H]1CO 2194705149 VHORIBSGMDWEPJ-HOSYDEDBSA-N 284.350 2.439 10 10 CECE CC[C@H](O)c1ccc(N2CCO[C@H](CF)C2)cc1 2051999215 VDKOKJRNQVYSQF-KGLIPLIRSA-N 253.317 2.305 10 10 CECE CNCc1ccc(N2CCO[C@H](CF)C2)c(Cl)c1 2052004001 UJCPQULTYOCDIF-LLVKDONJSA-N 272.751 2.234 10 10 CECE C[C@H](NC1CC2(COC2)C1)c1ccc(F)cc1O 2061757069 FDJUBAWQZKUPAZ-VIFPVBQESA-N 251.301 2.361 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H]2CC[C@H]1[C@@H]2N 2064140447 JFPCSYPMANYHDN-OPGJCSGMSA-N 250.317 2.014 10 10 CECE O[C@H]1CCc2cc(N3CC(OC(F)F)C3)ccc21 2065080663 MFIMBKKXSIHVTA-LBPRGKRZSA-N 255.264 2.094 10 10 CECE CC[C@H](COC(F)F)NCc1ccc(O)cc1O 2067263542 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2.491 10 10 CECE NC[C@H]1CCCCN1Cc1ccc(Cl)cc1O 1942497897 RLFRXJHFGLHSEN-GFCCVEGCSA-N 254.761 2.359 10 10 CECE Cc1ccc(O)c(CN2CCCC[C@@H]3[C@@H](C(=O)O)[C@@H]32)c1 2146669251 JFBLLRCWTJESPG-BPLDGKMQSA-N 275.348 2.386 10 10 CECE CCN[C@H]1CCN(Cc2c(O)cccc2Cl)C1 1942865262 DWJPIMBMFYTLEC-JTQLQIEISA-N 254.761 2.229 10 10 CECE Oc1c(Br)cccc1CNCCc1ccon1 1942818229 DMCPJYMQZAEPCD-UHFFFAOYSA-N 297.152 2.475 10 10 CECE COC(=O)CC1(CSc2ncc(CO)s2)CC1 1949564803 FGKRFBZHUXBBOM-UHFFFAOYSA-N 273.379 2.071 10 10 CECE Cc1ccc([C@@]2(NC(=O)OC(C)(C)C)CCNC2)c(O)c1 1952182251 CWYVHLVCRZJUPO-MRXNPFEDSA-N 292.379 2.414 10 10 CECE COc1cc(Cl)cc([C@H]2NCCCC2=O)c1O 1952803390 HATQUJUIHKVXAH-LLVKDONJSA-N 255.701 2.048 10 10 CECE CC[C@H]1CCCN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)C1 131349516 LIOWCJANHPDHIM-XHDPSFHLSA-N 273.380 2.289 10 10 CECE COc1cc2c(cc1OC)N(C[C@H](OC)C1CC1)CC2 1970281024 LSBJOZGMEFEMJM-INIZCTEOSA-N 277.364 2.491 10 10 CECE COCc1nn(C)cc1N[C@@H](C)c1ccccc1O 1970106264 SGDFUNFDSSYSMB-JTQLQIEISA-N 261.325 2.445 10 10 CECE COC1(OC)CC[C@@H]1CNCc1ccc(F)c(F)c1O 1972397245 VKFVSWHNMVSBOG-SNVBAGLBSA-N 287.306 2.159 10 10 CECE Oc1c(CN[C@H]2COCCC2(F)F)ccc(F)c1F 1972763969 YEEBVMHNYGITGP-VIFPVBQESA-N 279.233 2.184 10 10 CECE CNCc1ccc(N(C)CCCC(=O)N(C)C)cc1C 2143711494 DKUPPANABXSJMW-UHFFFAOYSA-N 277.412 2.019 10 10 CECE CCN=c1cc(NCCc2ccc(O)c(O)c2)cc[nH]1 2148007939 MTZDQHWEPPBRHF-UHFFFAOYSA-N 273.336 2.001 10 10 CECE CCCNCc1ccc(N2CC[C@@H](O)[C@@H](F)C2)c(C)c1 2144565688 BYAOJRKSCZTOBB-GOEBONIOSA-N 280.387 2.404 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CC[C@H]3CC[C@@H]32)cc1 2144552399 LPHCPUFUVZHGFQ-BYCMXARLSA-N 274.364 2.343 10 10 CECE C[C@@H]1C[C@H](CN)CCN1Cc1ccc2c(c1)CCN2C 2148108390 JYULMCNZGGPHRC-ZIAGYGMSSA-N 273.424 2.238 10 10 CECE COC(=O)c1cnc(Sc2nc(C)co2)s1 1985814026 LISDHPUSJJHKRQ-UHFFFAOYSA-N 256.308 2.377 10 10 CECE CCOc1cccc(CN2[C@H]3CC[C@@H]2C[C@@H](N)C3)c1O 2151258346 SMMJYPGGRXFGHK-ZSOGYDGISA-N 276.380 2.245 10 10 CECE COc1ccc([C@@H](C)NC[C@H]2CCCOC2)c(O)c1 38044353 UZGFYGODWZOFRY-VXGBXAGGSA-N 265.353 2.478 10 10 CECE Nc1ccc(OCCC(=O)NC23CCC(CC2)C3)cc1 2146181223 BMZWYFKWUOMWRN-UHFFFAOYSA-N 274.364 2.487 10 10 CECE Cc1cc(N2C[C@H]3C[C@@]3(CO)C2)ccc1CNC1CC1 2146312783 YVQCCEBOXWFWCX-PBHICJAKSA-N 272.392 2.066 10 10 CECE COc1cc2c(cc1OC)N1CC3(CC3)C[C@@H]1C(=O)N2 2152452921 IASJHTJLTOQJLD-LLVKDONJSA-N 274.320 2.015 10 10 CECE CC[C@H](N)c1ccc(N2CCCN(C)C(=O)CC2)cc1 2152582499 PKDJWVHDNBIKTG-HNNXBMFYSA-N 275.396 2.155 10 10 CECE COc1ccc([C@H](C)N[C@@H](C(=O)O)C(C)C)c(O)c1 43430297 UIHLQUDZVOKYDA-TVQRCGJNSA-N 267.325 2.161 10 10 CECE c1cc2c(cc1CNCc1cncn1C1CC1)CCO2 2153018904 QEXNOIOXCMDLKH-UHFFFAOYSA-N 269.348 2.443 10 10 CECE Oc1cccc(CNc2cnc(Cl)cn2)c1O 2008701373 MLGHZDJNWJGPNF-UHFFFAOYSA-N 251.673 2.153 10 10 CECE CC12CCC(CC1)N2c1cc2c(cc1N)OCC(=O)N2 2153613961 CMZLJAYAOBZOBE-UHFFFAOYSA-N 273.336 2.121 10 10 CECE C[C@@H]1CN(Cc2ccc(O)c(O)c2)[C@@H](C)C[C@@H]1C(=O)O 2153774823 YIWHJRLMSLLRGL-SCVCMEIPSA-N 279.336 2.029 10 10 CECE COC(=O)c1csc(Oc2ccc(N)cc2)n1 2011216543 SRNKGFYWIICXNE-UHFFFAOYSA-N 250.279 2.304 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@H]2C)cc1Br 2011373709 QEYKMQHYGGQZJL-JRKPZEMJSA-N 299.212 2.299 10 10 CECE COc1cc(N2CCC(=O)[C@H](C)C2)cc(OC)c1OC 49693422 KVEWMULEXWRHPH-SNVBAGLBSA-N 279.336 2.128 10 10 CECE C[C@H](O)[C@@H]1CCCN1c1ccc(CN)cc1Br 2018106471 FYMQMRJWAFXGQO-CABZTGNLSA-N 299.212 2.257 10 10 CECE CC(C)(C)[C@H]1OCCC[C@]1(NCCCN=[N+]=[N-])C(=O)O 2160265480 NZLBENPHUPFOKD-ZWNOBZJWSA-N 284.360 2.325 10 10 CECE CO[C@@H]1CN([C@H](C)c2ccc(C)cc2O)C[C@@H]1F 2029815253 SVSBZQABXYLJRK-SCDSUCTJSA-N 253.317 2.430 10 10 CECE CCCOc1cc(N2C[C@H](C)[C@H](N)C2)ccc1[N+](=O)[O-] 300168853 XBHNXSOIPIJTNQ-CMPLNLGQSA-N 279.340 2.167 10 10 CECE CNC[C@H]1CCCN([C@H](C)c2c(O)cccc2O)C1 300441209 KXXYJJKTOFCMSU-VXGBXAGGSA-N 264.369 2.090 10 10 CECE CC1(C)C[C@@H](CNCc2cc(F)ccc2O)CO1 2041453369 PMFAMGQMPUFGNQ-JTQLQIEISA-N 253.317 2.436 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC[C@H](C3CC3)C2)cc1 400178218 SQGHFZYXZSDHKU-DOTOQJQBSA-N 273.424 2.484 10 10 CECE CCN(c1ccc([C@H](C)N)c(O)c1)[C@@H]1CCCOC1 402651364 JSXBFWYFQIWQFR-WCQYABFASA-N 264.369 2.417 10 10 CECE CCN[C@@H](C)c1ccc(N(CCCO)C2CC2)cc1O 404226465 QNACNOIXKDGIEJ-LBPRGKRZSA-N 278.396 2.414 10 10 CECE COc1ccc(N2CCCC[C@H]2C[C@@H](C)O)c(N)c1 311319329 BIYZAOOWGGGLAO-NEPJUHHUSA-N 264.369 2.407 10 10 CECE CC[C@@H](C)N(CCO)c1ccc(OC)cc1[N+](=O)[O-] 311849930 OJRHEBJPJMFIPU-SNVBAGLBSA-N 268.313 2.201 10 10 CECE Cc1cc(C)c(S(=O)(=O)Nc2ccc(O)cc2N)s1 312062571 DBKWLRBYQYVTRH-UHFFFAOYSA-N 298.389 2.454 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H]2CCN(C)C[C@H]2C1 312755241 XQOVDJWZEVFTNL-UPJWGTAASA-N 278.371 2.476 10 10 CECE Nc1ccc(OCCC(=O)NC2[C@H]3CCCC[C@H]23)cc1 312842967 PHIKXSXKFJMNET-KBPBESRZSA-N 274.364 2.343 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCO[C@@H](CCF)C1 700591462 GHMCWZGMJQFLAK-MNOVXSKESA-N 269.316 2.219 10 10 CECE COc1cccc(O)c1CN(C)[C@H]1CN(C)C(C)(C)C1 2160729208 SDIZYLNXKOHEOT-GFCCVEGCSA-N 278.396 2.315 10 10 CECE CC[C@@H]1CN(C)CCCN1Cc1c(O)cccc1OC 2160714674 RMAIEKSDSLGRGP-CYBMUJFWSA-N 278.396 2.317 10 10 CECE CCCO[C@@H]1CCN(Cc2cc(OC)ccc2O)C1 701675050 ZUSBHBHPXUJZOD-CQSZACIVSA-N 265.353 2.402 10 10 CECE CCN1C(=O)C(=Cc2nc(C)c(C)[nH]2)SC1=S 2048509905 HNWMDYHXZVCZME-UHFFFAOYSA-N 267.379 2.248 10 10 CECE COc1ccc(N2CCO[C@@H](c3nccs3)C2)c(N)c1 2171852880 SJTCOIDKDQNVAA-CYBMUJFWSA-N 291.376 2.312 10 10 CECE COc1ccc([C@H](C)NCC2(O)CCSCC2)c(O)c1 702265685 CIKAWAHMQNKFHF-NSHDSACASA-N 297.420 2.310 10 10 CECE CN(C[C@H]1C[C@@H](O)C1)c1ccc(CN)cc1Br 703639212 LXPVRUPILAJAKR-PHIMTYICSA-N 299.212 2.115 10 10 CECE C[C@H](NC[C@H]1[C@@H]2COC[C@H]12)c1cc(F)ccc1O 367687696 LHGRVKPPMIBDMO-ZBPZKIAKSA-N 251.301 2.074 10 10 CECE CC(C)[C@@]1(O)CCCN(c2ccc(CO)cc2F)C1 710282108 SIXINBRSVSREOZ-OAHLLOKOSA-N 267.344 2.305 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@]2(O)CO[C@H](C)C2)cc1 2163150141 RCHRRAFHORWUFO-KCXAZCMYSA-N 278.396 2.073 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3CC[C@H]4C[C@H]3CO4)ccc21 2163132120 YHKSBKZVHIBMDZ-LJIGWXMPSA-N 272.392 2.494 10 10 CECE C[C@@H]1OCCN(c2ccc(CN)c(Cl)c2)[C@H]1C 380448990 NWXGXGDLIUSTSI-UWVGGRQHSA-N 254.761 2.412 10 10 CECE COc1ccc([C@H](C)NC2CN(C(C)C)C2)c(O)c1 381044223 OTDMKIOGOGXINO-NSHDSACASA-N 264.369 2.144 10 10 CECE C[C@H]1[C@@H](N)CCCN1[C@H](C)c1cc(F)ccc1O 381692942 FTFVEBCFYDNNMA-NRUUGDAUSA-N 252.333 2.404 10 10 CECE CC1(C)OCC[C@@H]1CNC(=O)CCc1ccc(N)cc1 693090371 VQUKJCVBNWKINB-CYBMUJFWSA-N 276.380 2.133 10 10 CECE CC(F)(F)CCC(=O)NCCOc1ccc(N)cc1 713999492 LIMRWJDNJUYOTH-UHFFFAOYSA-N 272.295 2.199 10 10 CECE Cn1cc(-c2csc(Cc3ccc(N)cc3)n2)nn1 714957530 SXWLUWNINOCPCM-UHFFFAOYSA-N 271.349 2.112 10 10 CECE CC[C@@H](c1ccccc1O)N(C)C1CC(S(C)(=O)=O)C1 716084396 URCFLUWMEOZWLU-YIZWMMSDSA-N 297.420 2.351 10 10 CECE CCCC1(O)CN(c2ccc([C@H](C)NC)cc2F)C1 384012778 WDVDSJFPRLZPHB-NSHDSACASA-N 266.360 2.457 10 10 CECE CCN(CC)C1[C@@H]2CN(c3ccc(CN)cc3C)C[C@@H]12 384297080 XOTZJAPUDKMPHN-HUUCEWRRSA-N 273.424 2.230 10 10 CECE C[C@H](NCC[C@H](O)C(F)F)c1ccc(N(C)C)cc1 716699069 OWGFWCJQSDVDIF-GWCFXTLKSA-N 272.339 2.419 10 10 CECE Nc1cc2c(cc1N(CC(F)F)C1CC1)OCCO2 386290951 QLODVYOFQRBRFI-UHFFFAOYSA-N 270.279 2.274 10 10 CECE C[C@@H]1CCN(c2ccc(CN)cc2Cl)CCO1 720483938 PWMRHCAEDUXQRW-SNVBAGLBSA-N 254.761 2.414 10 10 CECE C[C@@H]1COCCCN1[C@H](C)c1c(O)cccc1O 398931823 PDRNCKNZHMLUII-GHMZBOCLSA-N 251.326 2.270 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3[C@@H](OC)C[C@H]32)cc1O 2178343304 VOKRBELLENGMGX-FTOGJNOLSA-N 276.380 2.286 10 10 CECE CC(C)Cc1cc(C(=O)Nc2ccc(O)c(O)c2)n[nH]1 2063067124 DZIQUFSQNKLATC-UHFFFAOYSA-N 275.308 2.272 10 10 CECE O=C(c1c[nH]nc1[C@H]1CCNC1)N1CCCc2ccccc21 2064695229 JAUMSDZJMCNRRM-ZDUSSCGKSA-N 296.374 2.080 10 10 CECE OC[C@H]1[C@H]2CC[C@@H](C2)N1c1ccc(CNC2CC2)cc1 2178688582 HWZBVPIGOFRHOJ-JQFCIGGWSA-N 272.392 2.288 10 10 CECE CN(C)c1ccc([C@@H](N)c2cn(C)nc2C(F)F)cc1 2178752219 JLRHLFFIDRSITC-GFCCVEGCSA-N 280.322 2.472 10 10 CECE Cn1cc(NC(=O)Cc2ccc(N)cc2)c(C(F)F)n1 2178730682 CSRUUIXSQYKJSE-UHFFFAOYSA-N 280.278 2.121 10 10 CECE CCN[C@H](c1ccccc1O)[C@](C)(O)[C@H]1CCCOC1 2168332181 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2.127 10 10 CECE C[C@H]1CC[C@H](CN(C)c2ccc(CO)cc2[N+](=O)[O-])O1 2196179317 CNOCZLLNHZONFK-CMPLNLGQSA-N 280.324 2.091 10 10 CECE C[C@H](Nc1c[nH]c(=N)cc1C(=O)O)c1ccccc1O 2192627571 LUUFGJWIOKVZKM-QMMMGPOBSA-N 273.292 2.071 10 10 CECE CC(C)(C)[C@@H]1NCC[C@H]1NCCc1ccc(O)c(O)c1 2188108168 HMCRNQUFNSMZKQ-IUODEOHRSA-N 278.396 2.007 10 10 CECE CC[C@H]1CCN(c2ccc(CO)c([N+](=O)[O-])c2)CCO1 2188578072 WWMOFLPKRYSJOU-ZDUSSCGKSA-N 280.324 2.092 10 10 CECE Cc1cc(N(C)[C@@H]2C[C@@H]3[C@@H]2[C@H]2CC[C@H]3O2)ccc1CN 2188757284 XONDNOGIUOSSFO-UTSKFRMZSA-N 272.392 2.456 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3COCC[C@H]32)cc1O 2193270535 SYFQJVDBZGFMLB-LALPHHSUSA-N 276.380 2.288 10 10 CECE CC(C)(C)[C@H]1C[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2188921360 BJPLLDSZVLSAGH-MGCOHNPYSA-N 279.336 2.358 10 10 CECE CC(C)N(Cc1ccc(N)cc1)[C@@H]1COC(C)(C)[C@H]1O 2197085178 ILVNZFPBINKBSH-CABCVRRESA-N 278.396 2.018 10 10 CECE CCCN(c1ccc2c(c1)N(C)C(=O)[C@H]2N)C1CCC1 2197134871 NQMVBQTTXNSEOI-HNNXBMFYSA-N 273.380 2.432 10 10 CECE C[C@@H]1[C@@H](NCc2ccc3c(c2)CCO3)CCN(C)[C@@H]1C 2193721196 XMRWIZKEXTYDMR-ZENOOKHLSA-N 274.408 2.440 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H]3[C@@H]2CCN3C)cc1O 2183746877 FDFOHTBBKPCEML-CQDKDKBSSA-N 275.396 2.085 10 10 CECE COc1ccc(N2C[C@H](CO)CC2(C)C)c([N+](=O)[O-])c1 2184282475 GFISTLCVIHCAIB-SNVBAGLBSA-N 280.324 2.201 10 10 CECE COc1ccc(CNCc2ccnn2C2CC2)c(O)c1 2194143387 CWSFGZUZAHLDFK-UHFFFAOYSA-N 273.336 2.222 10 10 CECE CN[C@@H]1CCc2cc(N(C)Cc3nc(C)no3)ccc21 2184711476 SAKCQTGRSKVOGH-CQSZACIVSA-N 272.352 2.221 10 10 CECE Oc1ccc(F)cc1CNCC1CC(n2ccnc2)C1 2184863387 ICWBWRQRRDEIKO-UHFFFAOYSA-N 275.327 2.469 10 10 CECE Cc1cccc(O)c1CN[C@](C)(CO)C(F)(F)F 2043156107 DVFOPXRKCPXPNU-LLVKDONJSA-N 263.259 2.104 10 10 CECE CN1CCc2cc([C@H](N)C[C@@H]3C[C@@]34CCOC4)ccc21 2198168082 QYBAXEWZFYYGAJ-BFYDXBDKSA-N 272.392 2.495 10 10 CECE COc1ccc(N(C)[C@@H]2CCC[C@@H]2CN)c(F)c1 2044289856 RCEZZWRWIJHVFX-ZWNOBZJWSA-N 252.333 2.398 10 10 CECE Cc1ccc([C@H](C)NOCCCN(C)C)c(O)c1 2044574762 INDDPZBTRXYYEW-LBPRGKRZSA-N 252.358 2.235 10 10 CECE CN(C)c1ccc([C@H](NN)[C@H]2C[C@H]2C(F)F)cc1 2044727608 CKAGTWWGSVSVDO-TUAOUCFPSA-N 255.312 2.158 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1C[C@H]2C[C@H]1CC21OCCO1 2048190034 WBLPSBGJOLRLMU-SQWLQELKSA-N 288.391 2.242 10 10 CECE CNCCN(C)Cc1ccc(C(F)(F)F)cc1O 2050389269 BLRGZCIGDWBMDF-UHFFFAOYSA-N 262.275 2.062 10 10 CECE C[C@@H](N)c1cc(F)c(N2CCC3(CN(C)C3)C2)c(F)c1 2194698700 ZPRWNEVHOYZCLB-SNVBAGLBSA-N 281.350 2.126 10 10 CECE CC1(C)CN(c2ccc(CO)cc2Cl)CC[S@]1=O 2051264664 LESPOEMVAJEZGV-GOSISDBHSA-N 287.812 2.180 10 10 CECE CCCC[C@@H](CN)Nc1c(N)cccc1C(=O)OCC 2191698881 XHJDRMMXJDIBDU-NSHDSACASA-N 279.384 2.375 10 10 CECE CO[C@@H]1CC[C@@H]1CN[C@H](C)c1ccc(O)cc1O 2066807171 OEPLDLYRMDAVHT-GPCCPHFNSA-N 251.326 2.173 10 10 CECE CCN(CCSC)c1ccc(CO)c([N+](=O)[O-])c1 2068304539 VBDIFSGKEMOUPX-UHFFFAOYSA-N 270.354 2.276 10 10 CECE C[C@H]1[C@H](N)CCN1c1ccc(OCC(F)F)cc1 2073886612 UATWFQGLCAHZLQ-JOYOIKCWSA-N 256.296 2.256 10 10 CECE C[C@@H](N)CN(C)c1ccc(OCC(F)(F)F)cc1 2073885801 LBKHTDLPGWPCSC-SECBINFHSA-N 262.275 2.411 10 10 CECE COc1ccc(N(C)[C@H](CN)C2CC2)c(F)c1F 2081864213 SABJRCNZLVLJSE-SNVBAGLBSA-N 256.296 2.147 10 10 CECE C[C@@H]1CNCCCN1[C@H](C)c1ccc(N(C)C)cc1 2102923983 OSEVZXXRQWPKCU-ZIAGYGMSSA-N 261.413 2.497 10 10 CECE COc1ccnc(C(=O)CCc2ccc(N)cc2)c1 2102918623 TYUZYSWYTHAKNV-UHFFFAOYSA-N 256.305 2.488 10 10 CECE CCCN1CC[C@H](N(C)c2ccc(CN)c(F)c2)C1 2103807264 IVSKADWOMLPEDQ-AWEZNQCLSA-N 265.376 2.205 10 10 CECE Oc1cccc(F)c1CN1CC[C@]2(CCCNC2)C1 2104490999 LMAMCOIEHCNTHV-HNNXBMFYSA-N 264.344 2.107 10 10 CECE C[C@@H]1C[C@@H](OC(=O)Nc2ccc(N)cc2)CCO1 2084737954 NGQWNCPAZUWNJW-SKDRFNHKSA-N 250.298 2.385 10 10 CECE Nc1ccc(OCCN=c2cc(Cl)nc(Cl)[nH]2)cc1 2106070916 YNHBETXWIQGYQX-UHFFFAOYSA-N 299.161 2.278 10 10 CECE CCOc1ccc(N2CC3(CCN3)C2)cc1OCC 2106355563 HJRBPYKLUYWFBC-UHFFFAOYSA-N 262.353 2.036 10 10 CECE CN1CCCc2cc([C@H](NN)c3cncs3)ccc21 2106826614 VCTLWVAJSAJJPD-AWEZNQCLSA-N 274.393 2.078 10 10 CECE CN1CCCc2cc([C@H](O)C3CC(CN)C3)ccc21 2106819727 CKCNGSRRXMKPBM-INORYPFCSA-N 260.381 2.087 10 10 CECE Cc1nc(CN)sc1[C@@H](O)c1ccc(N(C)C)cc1 2106802717 WQKSVWFYIAOMJC-ZDUSSCGKSA-N 277.393 2.058 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2CC)C(C)(C)O 2106852602 HUWYEXBXCLNPKY-HNNXBMFYSA-N 262.397 2.491 10 10 CECE COc1cscc1[C@@H](NN)c1ccc(N(C)C)cc1 2106832940 FMBXADUDANMBBG-AWEZNQCLSA-N 277.393 2.375 10 10 CECE CCC[C@@H](CN)[C@@H](O)c1ccc2c(c1)CCN2CC 2106805492 OJVSLZRGTJJYNQ-HOCLYGCPSA-N 262.397 2.477 10 10 CECE Cc1ccc([C@@H](C)N(C)C[C@@H]2COCCO2)c(O)c1 2087387012 SSQFHIHIEUFOOA-CHWSQXEVSA-N 265.353 2.109 10 10 CECE C[C@H](N[C@H]1CC[C@H](S(C)(=O)=O)C1)c1ccccc1O 2089149000 KKQIJXDFXWGJQQ-SRVKXCTJSA-N 283.393 2.009 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CC[C@@H]1CCN1 2109414394 YQGLVIUCNXWPFD-VXGBXAGGSA-N 262.353 2.054 10 10 CECE OCc1ccc(N2CC[C@@H]2C2CCOCC2)c(F)c1 2089472613 NXATUGMYBWFVPW-CQSZACIVSA-N 265.328 2.323 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@@H]1CC[C@H]2C[C@H]2C1 2109681764 UTTJBSVPWRYFRX-GARJFASQSA-N 261.321 2.358 10 10 CECE CCCN(c1ccc(N)cc1)[C@H](C)C(=O)N1CCC1 2089715199 CWCIEWVINXRBTN-GFCCVEGCSA-N 261.369 2.106 10 10 CECE CSCC[C@H](O)CCNCc1ccc(F)c(F)c1O 2090385214 ODYJJHONRNSZGT-SNVBAGLBSA-N 291.363 2.264 10 10 CECE CN1CCc2cc([C@@H]3N[C@@H](CC4CC4)CO3)ccc21 2090430011 JXBGAISUOHCDIY-GOEBONIOSA-N 258.365 2.466 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H](O)[C@H](C3CC3)C2)cc1 2090681655 OVNDHNXUMMIHBX-XHSDSOJGSA-N 260.381 2.304 10 10 CECE Cc1ncc(C(=O)[C@@H](O)c2ccc(N(C)C)cc2)s1 2090855478 WIZFIIOZJCKOAI-ZDUSSCGKSA-N 276.361 2.434 10 10 CECE COC[C@@H]1[C@@H]2CCN(c3ccc(CO)c(C)c3)C[C@H]21 2093151703 VFJTWXNJNPEBDH-BZUAXINKSA-N 261.365 2.206 10 10 CECE C[C@]12C[C@@H]1CN(c1cc3c(cc1Cl)[C@H](N)C(=O)N3)C2 2096162145 YCCFHYSLYVZHLF-FDHQVAJDSA-N 277.755 2.138 10 10 CECE CCn1cncc1CN[C@H](C)c1ccc(O)cc1O 2096721512 ZYWOXPJZJCGIEZ-SNVBAGLBSA-N 261.325 2.165 10 10 CECE CNCc1ccc(OCc2c(C)cnn2C)c(C)c1 2098787189 ACTUAHGUAUQPGS-UHFFFAOYSA-N 259.353 2.335 10 10 CECE CN(C)c1ccc(CN(C)[C@H]2CCC[C@H](N)C2)cc1 2099834547 WJEMLSUJMHLVHA-HOCLYGCPSA-N 261.413 2.454 10 10 CECE Cc1cccc(O)c1CNCc1cn(C(C)(C)C)nn1 2200668984 KNPLQUVLKDSVGD-UHFFFAOYSA-N 274.368 2.337 10 10 CECE C[C@@H](N[C@H]1C[C@H](CN(C)C)C1)c1ccc(O)cc1O 2113149537 JCOKLBISPZAYGR-IJLUTSLNSA-N 264.369 2.089 10 10 CECE C[C@@H](N[C@H]1C[C@H](CN(C)C)C1)c1c(O)cccc1O 2113149920 NVJBBXHBVLHSAI-IJLUTSLNSA-N 264.369 2.089 10 10 CECE C[C@@H]1CN(C)CC[C@@H]1N(C)c1ccc(CN)cc1F 2113994576 AMMJFMVMUXPBJI-RISCZKNCSA-N 265.376 2.061 10 10 CECE Cc1cnc(CCN(C)Cc2cc(N)ccc2O)s1 2113980451 WCFHWUABKSWGKX-UHFFFAOYSA-N 277.393 2.414 10 10 CECE C[C@H](O)c1ccc(N2CCOCC3(CC3)C2)cc1O 2114595927 DIQCMEIAKPLRCI-NSHDSACASA-N 263.337 2.062 10 10 CECE CCNCc1ccc(N(CCO)[C@@H](C)CC)cc1OC 2204550886 YUYPNTMACHWNMZ-ZDUSSCGKSA-N 280.412 2.402 10 10 CECE COC[C@]1(C)[C@H]2C[C@@H]2CN1c1ccc(CN)c(C)c1 2269140070 XEOGFCZDKQNKLY-VNQPRFMTSA-N 260.381 2.315 10 10 CECE CN(C(=O)CO[C@@H]1CCC[C@H]2C[C@H]21)c1ccc(N)cc1 2206891149 XIIUCRPCURAWFM-NILFDRSVSA-N 274.364 2.437 10 10 CECE CN(CCOc1ccc(N)cc1)[C@H]1[C@H]2[C@H]3[C@H]2C[C@@H]2[C@H]3[C@H]12 2208382982 WIPVHHVEZIFGLO-GHLYRHEWSA-N 270.376 2.090 10 10 CECE Cn1cc([C@@](C)(N)c2ccccc2O)c(C(F)F)n1 2270975945 LDLCVRPUMYMDFN-ZDUSSCGKSA-N 267.279 2.286 10 10 CECE CCCN(C[C@@H](C)O)c1ccc(OC)cc1[N+](=O)[O-] 2272331406 QAAZFVXXKDSTEL-SNVBAGLBSA-N 268.313 2.201 10 10 CECE Oc1c(F)cccc1CN[C@@H](C(F)F)[C@@H]1CCOC1 2231056864 FRNHLBSLPLESHB-MWLCHTKSSA-N 275.270 2.291 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](O)C23CCC3)c(C)c1 2232027058 KCGROZQXWUPRJH-SWLSCSKDSA-N 260.381 2.379 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)C3(CC3)C2)c(C)c1 2232032483 ZYIQGRFSPUYBMX-IUODEOHRSA-N 260.381 2.237 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)Cc1ccnn1C 2232100632 OXTOMNVTNFYKGK-GFCCVEGCSA-N 259.353 2.418 10 10 CECE Cc1ccc(O)c(CN(C)C[C@@]2(F)CCOC2)c1 2222364982 XAGDTCQXBIVTPH-AWEZNQCLSA-N 253.317 2.261 10 10 CECE CN(CCCc1ccc(N)cc1)CCc1cnn(C)c1 2234105662 MULQPXXFMSYIHA-UHFFFAOYSA-N 272.396 2.109 10 10 CECE CC(C)[C@](C)(CC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-])C(=O)O 2234171135 JQOBVHIYYNRXKG-NRUUGDAUSA-N 282.344 2.471 10 10 CECE CN(Cc1ccc(N)cc1)C[C@H](O)c1cccc(O)c1 2234486080 AKWTZEVBQFRNRK-INIZCTEOSA-N 272.348 2.140 10 10 CECE CCCOc1ccc(N2CC3(C2)OCCC[C@@H]3O)cc1 2235104923 DEXKFQKEVHLFFF-HNNXBMFYSA-N 277.364 2.206 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H]2C[C@]3(C)O)cc1Cl 2225431529 SVFVANVKXDQSEF-YUELXQCFSA-N 280.799 2.409 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cscc1C(=O)O 2225791955 IUFSRAIZCNCBNC-RKDXNWHRSA-N 280.309 2.408 10 10 CECE Cc1ncnc(C)c1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2225793350 VVSJLGARALQYGU-NXEZZACHSA-N 260.301 2.055 10 10 CECE CCCNCc1cc(OC)ccc1N1CCC[C@@H]1CO 2235956718 ZDCYFSNJRZPVNC-CQSZACIVSA-N 278.396 2.156 10 10 CECE COCCCCN(C)c1ccc(OC)cc1C[C@H](C)N 2235973405 RSYWQCUOVSAJSE-ZDUSSCGKSA-N 280.412 2.448 10 10 CECE COc1ccc(N2CC[C@@H](N(C)C)[C@@H](C)C2)c(C=O)c1 2235983221 MBAMQVCRZYXJHS-SWLSCSKDSA-N 276.380 2.284 10 10 CECE CC[C@H](NCCc1[nH]nnc1C)c1ccccc1O 2226388469 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CC[C@H](NCCc1nccn1C)c1ccccc1O 40638786 CJNIZEKNOPDHBS-ZDUSSCGKSA-N 259.353 2.409 10 10 CECE OC[C@@H]1C[C@H]1CNCc1cc(Cl)cc(Cl)c1O 2005986760 SENQPNNAJXZJSV-CBAPKCEASA-N 276.163 2.417 10 10 CECE C[C@]1(F)CCCN(C(=O)CCOc2ccc(N)cc2)C1 2152229791 DTMFJOGVXATLKS-HNNXBMFYSA-N 280.343 2.388 10 10 CECE CCOC1CN(c2cc(Cl)c(CN)cc2F)C1 2008205068 GNAPLJWDOUCXPT-UHFFFAOYSA-N 258.724 2.163 10 10 CECE COc1ccc(O)c([C@H](C)N2CCNCC23CCC3)c1 2153344815 ACZPYZFSRGGPLF-LBPRGKRZSA-N 276.380 2.290 10 10 CECE c1cc2c(cc1N1CC3(CCOCC3)C1)CNCCC2 2154481686 HRQDDPANSAHZKU-UHFFFAOYSA-N 272.392 2.339 10 10 CECE Nc1ccc(OCC(=O)Nc2nc3c(s2)CCC3)cc1 49540776 UWRKNWZKCYKHOI-UHFFFAOYSA-N 289.360 2.232 10 10 CECE OCc1ccc(N2C[C@H]3COCC[C@H]32)cc1Cl 2017876591 JLVAFDUIMBTAQP-GXFFZTMASA-N 253.729 2.057 10 10 CECE COc1ccc(N2CCN[C@@H]3CC[C@H]32)cc1Cl 2024009497 XPWSOCRFQJIWGD-VXGBXAGGSA-N 252.745 2.289 10 10 CECE Oc1cccc(Cl)c1CN1CCCC2(CNC2)C1 2027713456 DZIKIHQXVRECRG-UHFFFAOYSA-N 266.772 2.231 10 10 CECE 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COc1ccc(O)c([C@@H](C)N2[C@H]3CC[C@@H]2C[C@@H]3CN)c1 2355419363 MYYFNDFGWOXALX-BLTAXRJOSA-N 276.380 2.273 10 10 CECE CC(C)(C)NCc1ccc(N2CCCC[C@H]2C(N)=O)cc1 62737529 ORBAQNRWUUGKEU-HNNXBMFYSA-N 289.423 2.419 10 10 CECE Nc1ccc(OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 38055701 LUSGOTYJJIGHNC-UHFFFAOYSA-N 287.275 2.195 10 10 CECE C[C@H](CNC(=O)c1ccn(-c2ccc(N)cc2)n1)C1CC1 124623260 OTDMFJDRIXBUOR-LLVKDONJSA-N 284.363 2.230 10 10 CECE Cc1cccc(CN2C[C@@H]3CCC[C@H](C2)C3O)c1O 180302220 GHLXZWIFKSRAHQ-MZBDJJRSSA-N 261.365 2.293 10 10 CECE C[C@H](NCCn1cccn1)c1ccc(F)c(F)c1O 187769728 ABOYOMDNCQVPOD-VIFPVBQESA-N 267.279 2.218 10 10 CECE Nc1ccc(OCCCn2c3c(ccc2=O)CCC3)cc1 134330227 BXBUWMSBHBECJT-UHFFFAOYSA-N 284.359 2.388 10 10 CECE CNCc1ccc(N2CCC[C@@H]2CO)c(Cl)c1 135192941 SXFRYNWZWHKYSF-LLVKDONJSA-N 254.761 2.021 10 10 CECE CCOc1cccc(CN(CCOC)[C@H](C)COC)c1O 133456384 WOLNNEAUBUSYLH-CYBMUJFWSA-N 297.395 2.274 10 10 CECE C[C@@H](NCC[C@@H]1CCOC1)c1ccc(O)cc1O 235196014 GBFMAWUWZMUVLG-GHMZBOCLSA-N 251.326 2.175 10 10 CECE C[C@H](NC[C@H]1CCCCO1)c1c(O)cccc1O 235512254 BDGIQPFAAPICNU-WDEREUQCSA-N 251.326 2.318 10 10 CECE COc1cc2c(cc1OC)C(=O)c1c(O)cccc1C2=O 90528793 YFWQNENHMSGIBO-UHFFFAOYSA-N 284.267 2.185 10 10 CECE CN1C(=O)C(=Cc2cccc(Br)c2)NC1=S 2313681181 QXVWKOKXBMPQSR-UHFFFAOYSA-N 297.177 2.137 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCc1ccccc1F 244328156 XMJQXRAWTVEUOZ-UHFFFAOYSA-N 275.279 2.096 10 10 CECE C[C@@H](C(=O)O)c1c(O)c(O)cc(Br)c1F 258422923 AYGWLSZPRHVLLU-GSVOUGTGSA-N 279.061 2.188 10 10 CECE CO[C@H]1CN(CCCOc2ccc(N)cc2)CC[C@H]1C 299957951 TZJRSCBNPTXSHH-CJNGLKHVSA-N 278.396 2.395 10 10 CECE Oc1c(F)cc(Cl)cc1CN[C@H]1CCCOC1 809783520 GFEJJYGAKMAZTC-JTQLQIEISA-N 259.708 2.453 10 10 CECE CCNCc1ccc(N2C[C@@H](OC)C[C@@H](O)C2)cc1Cl 2165321545 FSPQJOHYFFROPY-KGLIPLIRSA-N 298.814 2.036 10 10 CECE C[C@@H](c1ccccc1O)N1CCC[C@@]2(CNC(=O)C2)C1 2163334858 OKOFYZKFAFIQGS-BLLLJJGKSA-N 274.364 2.055 10 10 CECE CC1CC(CO)(NCc2ccc3c(c2)CCCN3C)C1 2163549136 RZKVVPIXUMHGSD-UHFFFAOYSA-N 274.408 2.320 10 10 CECE CO[C@@H]1C[C@H](CN)N(c2ccc(OC3CCC3)cc2)C1 2162660074 WVAZUYQXOSAPCY-CZUORRHYSA-N 276.380 2.170 10 10 CECE CNC(=O)[C@@H]1CCN(c2ccc([C@@H](C)NC)cc2Cl)C1 723185953 XRUPRZOKIPGVFZ-ZYHUDNBSSA-N 295.814 2.193 10 10 CECE CCN1CCc2cc([C@]3(O)CCN(C)C[C@H]3C)ccc21 2163066563 NFQDMMPXXXJRPI-DYVFJYSZSA-N 274.408 2.228 10 10 CECE CCN1CCc2cc([C@@H](O)c3cnc(C)n3C)ccc21 2163074102 PFLOLCZGTHRXSI-MRXNPFEDSA-N 271.364 2.193 10 10 CECE CC[C@@](O)(C1CC1)[C@H](NC)c1ccc2c(c1)CCN2C 2163132488 CHDMCHPMNHONKZ-IAGOWNOFSA-N 274.408 2.491 10 10 CECE CCC1([C@H](O)[C@H](NC)c2ccc3c(c2)CCN3C)CC1 2163141581 VXQGALZEOQCKOO-HZPDHXFCSA-N 274.408 2.491 10 10 CECE Cc1cn(C)nc1CN(C)c1ccc([C@@H](C)O)c(O)c1 723500265 TYMSOTPALWDZTJ-LLVKDONJSA-N 275.352 2.124 10 10 CECE C[C@H](N[C@H]1CNCCC1(F)F)c1cc(F)ccc1O 817980524 LEQMJHPXDBQFOH-UFBFGSQYSA-N 274.286 2.179 10 10 CECE COCC[C@H](COC)NCc1cc(Cl)c(F)cc1O 816616086 NWNVVHNFTXREFQ-SNVBAGLBSA-N 291.750 2.326 10 10 CECE CC[C@]1(C)C[C@@H](NCc2ccc(OC)cc2O)CO1 2132920650 GYVUHICZMDVKTR-IUODEOHRSA-N 265.353 2.448 10 10 CECE C[C@@H]1CN([C@H](C)c2ccccc2O)C[C@H]1CC(=O)O 722604784 UYOLNZVSZDJMAF-IJLUTSLNSA-N 263.337 2.496 10 10 CECE Cc1cc(O)c(CN2CCCN(C=O)CC2)c(Cl)c1 827867650 LJPABANUTAJCDC-UHFFFAOYSA-N 282.771 2.018 10 10 CECE CCc1cc(C(=O)N[C@@H](C)c2ccccc2O)n(C)n1 827984312 ANVNFXLFHJCLRU-JTQLQIEISA-N 273.336 2.179 10 10 CECE Cc1cc(O)c(CN2CC[C@H](O)C(F)(F)C2)cc1C 826958239 OUXUNQHBBBRBIV-ZDUSSCGKSA-N 271.307 2.211 10 10 CECE Oc1c(Cl)cccc1CN1C[C@H]2CC[C@H]1[C@H]1CNC[C@H]21 903964181 RTSOGIKBQSBDCX-PBOSXPJTSA-N 292.810 2.475 10 10 CECE Cc1cc(N(C)C)ccc1CN(C1CC1)[C@H]1CCNC1 843055660 MVQLKURKFHABSG-KRWDZBQOSA-N 273.424 2.387 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](C)c1ccc(Cl)cc1 845333764 DVMBOTKITSCYPO-QMMMGPOBSA-N 268.696 2.145 10 10 CECE Oc1c(F)cccc1CN1CC[C@]2(CCCNC2)C1 843118687 MMIDOQYJGSMUPD-HNNXBMFYSA-N 264.344 2.107 10 10 CECE Cc1cc(N(C)C)ccc1CN1CCNC[C@H]1C(F)F 843124822 NQXWSJFCJNBYRY-AWEZNQCLSA-N 283.366 2.100 10 10 CECE CCOc1ccc(O)c(CNC[C@@H](C(=O)O)C(C)C)c1 848639288 GNSUURNEJLNFQY-CYBMUJFWSA-N 281.352 2.237 10 10 CECE COc1ccc(N2CC[C@@H](NCc3conc3C)C2)cc1 850346726 IPGULCQTCHOALN-CQSZACIVSA-N 287.363 2.360 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@H](O)C23CCC3)cc1 850388273 KNKLLKZOSCLUBM-GJZGRUSLSA-N 260.381 2.146 10 10 CECE CC[C@@H]1C[C@H](C(=O)NCc2c(O)cccc2F)CCO1 928708312 JVPPOZGSZNFUPP-GHMZBOCLSA-N 281.327 2.353 10 10 CECE Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCC(C)(C)O2)c1 858375680 VAQJGWOPCNZMKI-ZDUSSCGKSA-N 292.379 2.457 10 10 CECE C[C@H](NC(=O)N[C@H]1CCN(C)[C@H](C)C1)c1ccccc1O 868374386 RBMHRNRPSHHQQW-AGIUHOORSA-N 291.395 2.235 10 10 CECE Cc1ccc(C(=O)N[C@@]23CCCC[C@@H]2C3)c(O)c1O 870537316 UUQKWRAOFRKZLM-MEBBXXQBSA-N 261.321 2.469 10 10 CECE CCOCC1CN(c2c(F)cc([C@@H](C)O)cc2F)C1 1880488541 KDLLPJPFCVYBRF-SECBINFHSA-N 271.307 2.491 10 10 CECE C[C@@H](N)c1cc(F)c(N(CCO)CC(F)F)c(F)c1 1880924531 SCKABEBPTLSKFP-SSDOTTSWSA-N 280.265 2.048 10 10 CECE Oc1c(F)cccc1CN[C@H]1CCCn2ccnc21 1883185731 XLKIPDSCJNRMSL-LBPRGKRZSA-N 261.300 2.353 10 10 CECE CCCN(CC(=O)NC)[C@H](C)c1cc(C)ccc1O 133296605 GQBJVLVMBWXQBU-GFCCVEGCSA-N 264.369 2.220 10 10 CECE COc1c(C(=O)N2Cc3cccc(O)c3C2)ccnc1F 1152573212 KAINGTSKINDMDX-UHFFFAOYSA-N 288.278 2.091 10 10 CECE Nc1ccc(CCNC(=O)[C@H]2C[C@@H]3CC[C@@H]3C2)cc1 1886020469 VRIRFMJFBFHJKN-BTTYYORXSA-N 258.365 2.364 10 10 CECE CC[C@H]1CN([C@@H](C)C(C)=O)c2ccc(CN)cc2O1 74337899 PGOLABLEROPBIT-GWCFXTLKSA-N 262.353 2.100 10 10 CECE Oc1ccc2c(c1O)CCN[C@@H]2c1c(O)cccc1F 75793709 UNTBAXSCRVSLNN-AWEZNQCLSA-N 275.279 2.178 10 10 CECE CCN(CC)C(=O)CN1C[C@H](C)Nc2cc(OC)ccc21 76927930 JWLZUKWOFYMGMD-LBPRGKRZSA-N 291.395 2.184 10 10 CECE COc1ccc(CNCc2cc(O)ccc2O)cc1 83431957 UBNHCTMBNFYLRM-UHFFFAOYSA-N 259.305 2.396 10 10 CECE N[C@H](c1nnc(C2CCCC2)o1)c1cccc(O)c1O 83543743 BUVQCQREOOTBKY-NSHDSACASA-N 275.308 2.187 10 10 CECE Oc1cc2c(cc1O)[C@H](c1ccc(F)cc1O)NCC2 83724152 VHJWSGVJOMGZDR-HNNXBMFYSA-N 275.279 2.178 10 10 CECE CC(C)C(=O)C(=O)c1ccc2c(c1)CCC(=O)N2C 84611280 GCHWFPOJUADAIZ-UHFFFAOYSA-N 259.305 2.003 10 10 CECE CCNCc1ccc(N2CCOC[C@H](C)C2)c(C#N)c1 399202037 ZOTNPOBIEVFHAP-CYBMUJFWSA-N 273.380 2.140 10 10 CECE Cc1cc(CO)ccc1N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2 686169106 XNGFHQDVZJVPLI-DLKVLKDVSA-N 261.365 2.225 10 10 CECE CCN[C@H](C)c1ccc(N(C)Cc2ncnn2C)cc1 707665587 NBWZQLXOURKANH-GFCCVEGCSA-N 273.384 2.122 10 10 CECE C[C@H]1COCC[C@H]1NCc1cc(F)cc(F)c1O 708562045 SEDGYEGIYDQOAP-QPUJVOFHSA-N 257.280 2.185 10 10 CECE CO[C@H]1CC[C@H](C)N(C(=O)CCc2ccc(N)cc2)C1 687213394 IPRJWAZRNKLQRA-WFASDCNBSA-N 276.380 2.227 10 10 CECE CN(CC12CCN(CC1)C2)c1ccc(CN)c(Cl)c1 715792742 CYQDAZNSLLXJMH-UHFFFAOYSA-N 279.815 2.331 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCN(C)[C@@H]2C)c1 719603195 QSEOLDFEKRFMPZ-WDMOLILDSA-N 264.369 2.144 10 10 CECE Oc1cc(Br)ccc1CNCc1cn[nH]c1 691426786 KTXOVNRUOBOLHY-UHFFFAOYSA-N 282.141 2.168 10 10 CECE Cc1cccc(CN[C@H](C)Cc2nccn2C)c1O 1964584018 DGOABQHWNOPYGU-GFCCVEGCSA-N 259.353 2.155 10 10 CECE CCN[C@@H](C)c1ccc(N2CCCOCC2)cc1O 93671485 BDKRAYASHPLESA-LBPRGKRZSA-N 264.369 2.289 10 10 CECE COc1ccc(O)c(CN2CC(C)(C)C[C@H](N)[C@H]2C)c1 1916274363 QFLAHTWAHSAOGN-RISCZKNCSA-N 278.396 2.349 10 10 CECE CN(C(=O)/C=C\c1cn(C)cn1)c1ccc(Cl)cn1 1264967328 IKGGPKFZHFKWCI-XQRVVYSFSA-N 276.727 2.145 10 10 CECE C[C@@H]1CCC[C@@H](OCC(=O)NCc2cc(O)ccc2O)C1 1455356225 IJLAUGPVALBWCI-BXUZGUMPSA-N 293.363 2.309 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1CCC[C@@H]1CF 2115225671 MTLMNHLCCXALRU-GXFFZTMASA-N 265.332 2.030 10 10 CECE FC[C@@H]1CN(c2ccc(CNC3CC3)cc2)CCO1 2115417559 IUEVIFGSWIKPQT-OAHLLOKOSA-N 264.344 2.113 10 10 CECE Cc1c(CN2C[C@@H]3C[C@H](C2)N3)n(C)c2ccccc12 2117058943 RIHSPQJFLJYORR-BETUJISGSA-N 255.365 2.033 10 10 CECE CC(=O)N1CCC[C@@H](CNCc2cc(F)c(F)cc2O)C1 1462190792 KXDFGLWHHXXSFJ-NSHDSACASA-N 298.333 2.019 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)c2cccc(F)c2)CC1 2117724431 LDOYKOSCDRFFBA-UHFFFAOYSA-N 284.316 2.195 10 10 CECE [N-]=[N+]=NCCCCN1Cc2ccccc2C[C@@H]1CN 2117992652 PZOQUPRPYXAAGD-CQSZACIVSA-N 259.357 2.463 10 10 CECE Cc1ccc(O)c(CNC(=O)c2csnc2C)c1 1470254896 NJKYBYLEPIYNNX-UHFFFAOYSA-N 262.334 2.396 10 10 CECE CN(C)C1CCC(N(C)c2ccc(CO)cc2)CC1 2121436437 IILYGNMDADCMSW-UHFFFAOYSA-N 262.397 2.488 10 10 CECE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ncccc1F 1626502838 DTDMJXLYOCXTKH-SECBINFHSA-N 290.294 2.052 10 10 CECE Cc1nc(C(=O)Cc2ccc(N)cc2)n2c1CCC2 2121616205 ZPCQQUOWZMBOCA-UHFFFAOYSA-N 255.321 2.145 10 10 CECE CCN(CC)CCCN[C@H](C(=O)O)c1cc(C)ccc1O 211722206 RSCROJBGGTZCIR-HNNXBMFYSA-N 294.395 2.148 10 10 CECE CCN(Cc1ccc(N)cc1)S(=O)(=O)CCC(C)C 104450223 URDXYTXARNQULC-UHFFFAOYSA-N 284.425 2.467 10 10 CECE COC[C@]1(F)CCN(c2ccc([C@H](C)O)cc2F)C1 2123226797 FMKROHORJXVEPJ-HZMBPMFUSA-N 271.307 2.444 10 10 CECE CN1CCN(C(=O)Cc2ccc(O)c(O)c2)c2ccccc21 1565586849 IXJDEYDELULFDL-UHFFFAOYSA-N 298.342 2.123 10 10 CECE Cc1ccc(O)cc1C(=O)NCc1c(O)cccc1O 1645362755 BHZQJTITIQIVDX-UHFFFAOYSA-N 273.288 2.042 10 10 CECE CC(C)[S@](C)(=O)=NC(=O)c1ccc(N=NC(N)=O)cc1 1645102040 YEOXTLGRPDLTTN-FQEVSTJZSA-N 296.352 2.495 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1csc2cncn12 1912187857 MELMQWSNQFPIFW-UHFFFAOYSA-N 264.314 2.168 10 10 CECE C[C@H](C(=O)N1CC[C@H](N=[N+]=[N-])C1)[C@@H]1CCCCO1 1912170795 BVQZJSQGCIUUBH-DCAQKATOSA-N 252.318 2.103 10 10 CECE CC(C)NC(=O)[C@H](C)N1CCCC[C@H](CN=[N+]=[N-])C1 1912175123 IIIRPUOROGUEFG-NWDGAFQWSA-N 267.377 2.312 10 10 CECE COC[C@H]1CC[C@@H](C(=O)NCc2ccccc2O)C1 2125360952 YIAHYLXLPYDCKK-NWDGAFQWSA-N 263.337 2.071 10 10 CECE CC(C)[C@H]1[C@@H](O)CCN1c1ccc(CN)c(F)c1F 2126092141 FYDZAKJOBIYQPI-FZMZJTMJSA-N 270.323 2.019 10 10 CECE C[C@@H]1CC[C@H](CCN2CCc3cc(CN)ccc32)O1 2133395482 QGPGJRBASGKJPC-IUODEOHRSA-N 260.381 2.465 10 10 CECE C[C@H](NC1CCC(O)CC1)c1cc(O)ccc1O 19918803 HGBJUQBRKNOYKM-WHXUTIOJSA-N 251.326 2.052 10 10 CECE CN(C[C@@H]1CCCN1C)c1ccc2c(c1)CC[C@H]2O 2128322580 RRSQMEMSITXZLL-GOEBONIOSA-N 260.381 2.197 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1CCOc2ccccc21 161134123 NXPVHQPLEZBQKE-CYBMUJFWSA-N 283.331 2.303 10 10 CECE CN[C@H]1CCc2cc(N3C[C@@H](O)C(C)(C)C3)ccc21 2128312171 FAYYGGPZMIRZHP-LSDHHAIUSA-N 260.381 2.100 10 10 CECE C[C@@](Cc1ccccc1F)(NCCN=[N+]=[N-])C(=O)O 158528267 OHPYCMHPVAGWQU-LBPRGKRZSA-N 266.276 2.111 10 10 CECE CCN1CC(CN(C)c2ccc3c(c2)CC[C@@H]3O)C1 2128319591 VASYOVHOKDLZPF-INIZCTEOSA-N 260.381 2.054 10 10 CECE CCN[C@@H]1CCc2cc(N(C)[C@H](C)CCO)ccc21 2128313843 YJCCLDTZMQEHOV-MLGOLLRUSA-N 262.397 2.491 10 10 CECE CC[S@@](=O)CCN[C@@H](C)c1cc(C)ccc1O 168763741 ZHUCKKAZQCNBAG-GTNSWQLSSA-N 255.383 2.120 10 10 CECE CCc1nnc(NC(=O)[C@@H](C)Oc2ccc(N)cc2)s1 1860083670 UUPSFXYBUIRHQP-MRVPVSSYSA-N 292.364 2.089 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2N)[C@H](CO)C(C)(C)C 2128293754 GYCVWWGGDOUBFB-HUUCEWRRSA-N 262.397 2.476 10 10 CECE COC[C@]1(C)CCN(c2ccc3c(c2)CC[C@H]3N)C1 2128294311 KGBFMADNGLXPHI-HZPDHXFCSA-N 260.381 2.495 10 10 CECE CC[C@@H]1CN(CC)[C@@H](c2cccc(OC)c2O)CN1 251683635 IAVURNLHNOGNIV-DGCLKSJQSA-N 264.369 2.146 10 10 CECE N[C@H]1CCCC[C@@H]1NCc1ccc2c(c1)CCCO2 258877164 GKKCNNZYBMGGIB-GJZGRUSLSA-N 260.381 2.371 10 10 CECE Cc1cc(CN)ccc1N1CCCC[C@H]1C1(O)CC1 2130494630 HNBNCNMCDONDSR-HNNXBMFYSA-N 260.381 2.338 10 10 CECE CC(C)NCc1ccc(N(C)C[C@H]2CCN2C)cc1 2129896264 ZMMUCODEEJDGPW-MRXNPFEDSA-N 261.413 2.325 10 10 CECE F[C@@H]1COCC[C@@H]1NCc1ccc2c(c1)CCCO2 2130280627 SMCFGMFOOVQIFX-KGLIPLIRSA-N 265.328 2.228 10 10 CECE COCCN1[C@@H](C)CN(CCCCN=[N+]=[N-])C[C@H]1C 2130393487 IQLWHDFNHJCHKR-BETUJISGSA-N 269.393 2.118 10 10 CECE C[C@H](F)CN1CCN(c2ccc(CN)cc2Cl)CC1 2133469115 BQFJTTCXGXCKFW-NSHDSACASA-N 285.794 2.279 10 10 CECE CO[C@H]1CCN(c2ccc([C@H](C)N)cc2F)[C@@H]1C 1914266297 FNAZERVBNBREAY-RBZYPMLTSA-N 252.333 2.459 10 10 CECE NCc1cc(F)c(N2CC[C@H](O)[C@@H]3CC[C@H]32)cc1Cl 2133745832 QLMOCQLFUHYTSB-IUPBHXKESA-N 284.762 2.287 10 10 CECE Nc1ccc(NC(=O)COC[C@@H]2CC[C@@H]3C[C@@H]23)cc1 2134536292 DHHDZCBJYNGQJP-UHIISALHSA-N 260.337 2.270 10 10 CECE CNCc1ccc(N2CC(COC)C2)c(Br)c1 1916909623 DPVKLCDMFVKFJD-UHFFFAOYSA-N 299.212 2.251 10 10 CECE Cc1ncc2c(n1)CN(c1ccc(CN)c(C)c1)C2 2141264978 CRYHHHLYXPQIRO-UHFFFAOYSA-N 254.337 2.072 10 10 CECE CNCc1ccc(N2CC[C@@]3(CCC[C@@H]3O)C2)cc1 1918914988 FKOVSIJXXXHHBL-HOTGVXAUSA-N 260.381 2.147 10 10 CECE CCCN(C(=O)c1cn(C)nc1C)c1ccc(N)cc1 227413047 ZSWTULKPPJVLJF-UHFFFAOYSA-N 272.352 2.368 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@H]2CC(O)C3)c(F)c1F 1922776757 HXMIZELCTOMUKS-QWRGUYRKSA-N 282.334 2.306 10 10 CECE CO[C@@H]1[C@H](NCc2ccc(O)cc2O)CC12CCC2 2141741567 ACALXZDLCPBESG-TZMCWYRMSA-N 263.337 2.145 10 10 CECE C[C@H]1[C@H](C)CCCN1C[C@@H](O)COc1ccc(N)cc1 252182953 QIBMCUJOAASDSX-VNHYZAJKSA-N 278.396 2.129 10 10 CECE CCNCc1ccc(N2C[C@@H](O)CC3(CC3)C2)cc1 1926420859 IBGZDZJXXNLUNN-HNNXBMFYSA-N 260.381 2.147 10 10 CECE C[C@H]1C[C@@H](C)CN(S(=O)(=O)Cc2ccc(N)cc2)[C@@H]1C 229347848 RGTLSYWQWGOZNC-FRRDWIJNSA-N 296.436 2.465 10 10 CECE COC[C@]1(CN[C@@H](C)c2ccccc2O)CCCO1 1967526752 AKNPTCNQZCJHGO-SWLSCSKDSA-N 265.353 2.238 10 10 CECE C[C@@H](N)c1ccc(N2CCN3CCCC[C@H]3C2)cc1O 251574132 VFILAGYJHCIFBQ-OCCSQVGLSA-N 275.396 2.086 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@H](O)C3(C)C)ccc21 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10 10 CECE CS[C@H]1CCCN(C(=O)COc2ccc(N)cc2)CC1 312207639 LZKFQEFOSDMFPG-AWEZNQCLSA-N 294.420 2.392 10 10 CECE Nc1ccc(Cc2nc([C@@H]3C[C@H]4CC[C@H]3O4)no2)cc1 249989655 KEWZLYVBIKWKBX-JHJVBQTASA-N 271.320 2.278 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1cc(C)nc(C)n1 2177370411 KNSDPJMWRSPNAP-MRXNPFEDSA-N 270.380 2.468 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1csc(C(F)(F)F)c1 703340843 LQPGHUQNTHPOLL-SSDOTTSWSA-N 293.274 2.193 10 10 CECE Cc1ncc(CN(C)c2ccc([C@@H](C)N)c(O)c2)n1C 689496061 ZMYDBGNEGDAUDX-SNVBAGLBSA-N 274.368 2.090 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CCCC[C@H]43)c(F)cc2[C@H]1O 706833911 XVUAVWMMYBKVKB-REAQECSSSA-N 276.311 2.190 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)c(F)c1 706973813 GXWXENFLWQXRMW-BNOWGMLFSA-N 277.387 2.104 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(OCCOC)C2)cc1 707611100 GSZVMMNJBGTXPE-ZDUSSCGKSA-N 278.396 2.209 10 10 CECE CC(C)[C@@H]1CN(c2ccc3c(c2)NC(=O)[C@H]3O)CCS1 707701993 SHPTXGAJBLSGSL-KBPBESRZSA-N 292.404 2.250 10 10 CECE 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272.348 2.096 10 10 CECE C[C@@H]1CN(c2c(F)cc(CN)cc2F)[C@H](C)CO1 62710775 HCZFOZYGMZUSLH-RKDXNWHRSA-N 256.296 2.037 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCOCC1(C)C 235171010 SVZFDYVRYNIVDI-SNVBAGLBSA-N 251.326 2.270 10 10 CECE CNC[C@@H]1CCN(C)[C@@H]1c1ccc2c(c1)CCCN2C 70281147 HVQWKBREOYPQBH-DOTOQJQBSA-N 273.424 2.281 10 10 CECE CCCOc1nc(NC)nc(Sc2nccs2)n1 122110068 FRXYHJPMBINYAB-UHFFFAOYSA-N 283.382 2.310 10 10 CECE COc1ccc(N2CCC[C@H](N)C2)cc1Br 83869870 UHTHIJQVGJHOGS-VIFPVBQESA-N 285.185 2.385 10 10 CECE CCCNCc1ccc(N(CC(N)=O)C2CCCC2)cc1 42438380 CENVFXSZOYHULB-UHFFFAOYSA-N 289.423 2.421 10 10 CECE NCc1ccc(N2CCO[C@@H]3CCC[C@H]32)cc1F 228188326 LGHIYEFERSDFEZ-ZIAGYGMSSA-N 250.317 2.042 10 10 CECE COc1ccc([C@H](C)N[C@@H](C)C(=O)NCC(C)C)c(O)c1 228970097 RVPCJIFBKGBDCJ-RYUDHWBXSA-N 294.395 2.212 10 10 CECE Fc1cc(OCC2CC2)ccc1N1CCCNCC1 87439323 UCWSPDXRMITSBP-UHFFFAOYSA-N 264.344 2.414 10 10 CECE C[C@H]1[C@H](C(=O)O)CCN1[C@H](C)c1ccc(F)cc1O 221533543 JTORDQYVUFBVQI-VDDIYKPWSA-N 267.300 2.387 10 10 CECE C[C@@H](N)c1ccc(N(CCO)CC(F)F)cc1Cl 231323239 RMJIQXSYSHWIPX-MRVPVSSYSA-N 278.730 2.424 10 10 CECE C[C@](NCCCN=[N+]=[N-])(C(=O)O)c1ccccc1F 90258849 VTOICHBMKRYLDA-GFCCVEGCSA-N 266.276 2.416 10 10 CECE CN(CC1(N(C)C)CCC1)C(=O)CCc1ccc(N)cc1 97925840 XFJBLEVSMUKMNP-UHFFFAOYSA-N 289.423 2.144 10 10 CECE C[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(N)cc1 235107744 SGVNPADKLWKWCG-QMMMGPOBSA-N 260.259 2.268 10 10 CECE OC[C@@H]1CCC[C@H]1CNCc1cc(F)ccc1O 236506797 VFHYLINQOCBUJY-QWRGUYRKSA-N 253.317 2.030 10 10 CECE CC[C@H]1CN2CCC[C@H]2CN1Cc1cc(OC)ccc1O 248418232 SIEOHCVDEHZRNE-GJZGRUSLSA-N 290.407 2.459 10 10 CECE COc1cc(OC)c2c(c1)[C@@]1(CCCNC1)CCN2C 527420076 QDJHHFOPGLINPC-INIZCTEOSA-N 276.380 2.165 10 10 CECE Oc1cc(F)c(Br)c([C@H]2CCCNC2)c1O 258533657 MASHYBMFMNNIIS-LURJTMIESA-N 290.132 2.466 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2C[C@@H]3COC[C@@H]32)c1 1308748655 VOJDCKUUOXRKQY-GIFSMMMISA-N 263.337 2.086 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2C[C@@H]3COC[C@@H]3O2)c1 724586650 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CN(Cc1c(O)cccc1Cl)C[C@@H]1C[C@H]2OCC[C@@H]2O1 2163198316 FUZCMWFVZLFNHT-NZVBXONLSA-N 297.782 2.424 10 10 CECE Cc1cc(CO)ccc1N1[C@H]2CCC[C@@H]1CN(C)C2 2226367660 KDIKUVQOFBEWQN-GASCZTMLSA-N 260.381 2.160 10 10 CECE CON1CCC(NC/C=C/c2ccc(N(C)C)cc2)CC1 817418099 AEJFOPVLYSXOGY-SNAWJCMRSA-N 289.423 2.381 10 10 CECE Cc1cn(C)nc1CN(C)CCCc1ccc(N)cc1 723499414 GUAKBPUEWPRVJU-UHFFFAOYSA-N 272.396 2.375 10 10 CECE Cc1cc(N2CCNCC2)ccc1OC[C@@H]1C[C@@H]1C 722636068 AQTDNZHYXJEJFM-JSGCOSHPSA-N 260.381 2.439 10 10 CECE COC(=O)[C@](C)(CCF)NCc1cccc(C)c1O 827352885 SHOGGZJZCDNIHK-AWEZNQCLSA-N 269.316 2.082 10 10 CECE CCc1ccc2scc(O)c2c1[C@@H](O)C(=O)O 725301481 TVSJQUJNPVZUOT-LLVKDONJSA-N 252.291 2.287 10 10 CECE Cn1cc(/C=C\C(=O)N2CCc3cc(F)c(F)cc32)cn1 915604851 UNRLAKYZBQICMH-IHWYPQMZSA-N 289.285 2.301 10 10 CECE CNC[C@@H]1CCCN1C/C=C/c1ccc(N(C)C)cc1 843055042 DTUFLIWKDBUNEO-YXMMZVCTSA-N 273.424 2.450 10 10 CECE CCOc1ccc(O)c(CN2CCC[C@@]3(CCNC3)C2)c1 843124238 WJQQPJJJHDKCQU-KRWDZBQOSA-N 290.407 2.366 10 10 CECE CCCC[C@](C)(CO)NC(=O)/C=C\c1ccc(O)c(O)c1 844020586 QYPZDUGCWLOXGN-QKIRZYONSA-N 293.363 2.168 10 10 CECE CCc1cc(CNC(=O)NCc2c(O)cccc2F)on1 920099424 SHNHGSQFMOUOAC-UHFFFAOYSA-N 293.298 2.081 10 10 CECE COC[C@@H](COC(=O)c1cccc(O)c1O)C(C)C 922619746 IPFSJZWVCGFUIT-JTQLQIEISA-N 268.309 2.173 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H](C)CCCCO)C2)cc1 850489212 RZNIMBLNGRLIGL-GJZGRUSLSA-N 292.423 2.415 10 10 CECE CCO[C@@]1(C)C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 858784408 UCFGKPRGSKBKDM-ZBFHGGJFSA-N 291.395 2.119 10 10 CECE CCN(C(=O)C=C1CCNCC1)c1ccc(F)cc1 852805234 SXECVIXLVWUFOX-UHFFFAOYSA-N 262.328 2.488 10 10 CECE Nc1ccc(NC(=O)c2ccnn2C2CCOCC2)cc1 852790235 LTJZLTOTGSFUFE-UHFFFAOYSA-N 286.335 2.069 10 10 CECE CCO[C@@H](CS(=O)(=O)Nc1ccc(O)c(C)c1)C1CC1 863406244 ZAGLAUSDAFLBRM-AWEZNQCLSA-N 299.392 2.257 10 10 CECE C[C@]1(C(F)F)CN(Cc2cc(F)ccc2O)CCO1 698946015 QQFKDMJNRNMZBJ-CYBMUJFWSA-N 275.270 2.387 10 10 CECE O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 866769281 JORHNDVNFYIDDC-KSSYENDESA-N 273.332 2.006 10 10 CECE CCOc1ccc(O)c(CN2CCO[C@@H](CCF)C2)c1 862529977 IIKYTKRSQDFRNQ-AWEZNQCLSA-N 283.343 2.351 10 10 CECE Cc1ccc(O)c(CNC(=O)c2ccn(C)c2C)c1 862755985 ORSUYQGEUALEQK-UHFFFAOYSA-N 258.321 2.278 10 10 CECE NCc1cc(F)c(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)c(F)c1 1877073670 IXNXPGSMBYQYHF-VROVMSAKSA-N 274.261 2.371 10 10 CECE CCc1nc(C(=O)NCCCSc2nccs2)no1 775389203 JBNFLFTWIYSULQ-UHFFFAOYSA-N 298.393 2.001 10 10 CECE Nc1ccc(NC(=O)N2C(=O)[C@@H]3CCCC[C@H]32)cc1 1876152672 JHIRPPAUCBIVMV-VXGBXAGGSA-N 259.309 2.202 10 10 CECE N#Cc1cc([C@H](N)C(F)(F)F)c(O)c(F)c1F 72195382 NQQCIFICYKLZON-QMMMGPOBSA-N 252.142 2.104 10 10 CECE C[C@@H](NC[C@@H](C(=O)O)C(F)(F)F)c1ccccc1O 1877554131 KMCBYGNREOJKGA-APPZFPTMSA-N 277.242 2.306 10 10 CECE CC(C)=CC[C@@H](N)C(=O)N[C@H](C)c1ccccc1O 1877587154 DKVMOSKMNCXLGK-DGCLKSJQSA-N 262.353 2.253 10 10 CECE Cc1ncc(CN(C)C(=O)Cc2ccc(O)c(O)c2)s1 1136316705 NBAHAUZHXUHRTC-UHFFFAOYSA-N 292.360 2.064 10 10 CECE COC[C@@H]1C=CCN1c1c(F)cc([C@H](C)O)cc1F 1880490110 NVUIGPPYYGUVCN-ONGXEEELSA-N 269.291 2.409 10 10 CECE C[C@H]1CCN(c2c(F)cc([C@@H](C)N)cc2F)C[C@@H]1O 1880961681 APGMSCWSCCNXLT-RWEMILLDSA-N 270.323 2.192 10 10 CECE C[C@H](N)c1cc(F)c(N(C)CC2CC(O)C2)c(F)c1 1880926322 DZQZFTCQBYNBHT-SILCLGDVSA-N 270.323 2.192 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CCC[C@@H](O)C2)c(F)c1 1880960073 GDRPGDBPZXNPAK-GXSJLCMTSA-N 270.323 2.206 10 10 CECE Cc1nc(NC(=O)c2cccc(O)c2O)cs1 790904694 XMWZZQMZBAZHQK-UHFFFAOYSA-N 250.279 2.115 10 10 CECE C[C@H](CNC(=O)OC(C)(C)C)C(=O)NCCCCN=[N+]=[N-] 1885562513 HDRHEIXJTCBCJT-SNVBAGLBSA-N 299.375 2.354 10 10 CECE C[C@@H]1OCC[C@H]1CC(=O)N(C)Cc1ccccc1O 1885773311 KLSHFMAGXOEUKG-RYUDHWBXSA-N 263.337 2.166 10 10 CECE C[C@@H](Nc1cccc(S(N)(=O)=O)c1)c1ccccc1O 19915829 AUQDGTBLYWBPIV-SNVBAGLBSA-N 292.360 2.213 10 10 CECE COc1cc2c(cc1OC)N(CCN)C[C@](C)(C(C)C)N2 76930895 BMJZKTRAIHGWBR-MRXNPFEDSA-N 293.411 2.309 10 10 CECE CCCCc1nnc([C@@H](N)Cc2ccc(O)c(O)c2)o1 83581046 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Cc1nn(C)c([C@H](N)c2ccccc2O)c1Br 2017355559 GPJKQWNLHOLEHG-LLVKDONJSA-N 296.168 2.245 10 10 CECE CCN[C@H](c1ccccc1O)[C@@]1(O)CS[C@@H](C)C1 2031143628 DIILLYMOBKGJSQ-GDLCADMTSA-N 267.394 2.299 10 10 CECE CN(C)c1ccc(CNC[C@]2(N)CCC[C@@H]3C[C@H]32)cc1 2156814230 GSINVFVXLIJTRR-DJIMGWMZSA-N 273.424 2.360 10 10 CECE C[C@@H]1CC[C@@H](CNCc2ccc(O)c(O)c2O)S1 2034236185 SYOMLIPGTYPTMB-SCZZXKLOSA-N 269.366 2.177 10 10 CECE C[C@H]1CC[C@H](CNC(=O)c2cccc(O)c2O)S1 2034231689 KAKIHXLVPOHMPR-DTWKUNHWSA-N 267.350 2.112 10 10 CECE CNCc1ccc(N2CC(C(C)(C)O)C2)c(Cl)c1 2034824822 NQORVJNDWZPWKR-UHFFFAOYSA-N 268.788 2.267 10 10 CECE CC[C@@H]1CCOC[C@H]1NCc1cccc(F)c1O 2035126300 XNVZQORLBVGMTM-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE CCCSC1CN(C(=O)c2cccc(O)c2O)C1 2036370685 MSRAHDFJTVZIOT-UHFFFAOYSA-N 267.350 2.065 10 10 CECE Nc1ccc(O)c(CN2CC[C@@H](N3CCCCC3)C2)c1 62977656 SPFQWPMVISPHPQ-OAHLLOKOSA-N 275.396 2.035 10 10 CECE CC[C@@H](NC)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1 300505759 HBZJWYNXDNGRGD-DZGCQCFKSA-N 275.396 2.059 10 10 CECE OCC1(F)CCN(c2ccc(CNC3CC3)cc2)CC1 2157521047 YWYSRXWMIVPNSG-UHFFFAOYSA-N 278.371 2.239 10 10 CECE CSC[C@@H]1CCCN1CCC(=O)Nc1ccc(N)cc1 400238681 QTPXCVXBDWTXBS-AWEZNQCLSA-N 293.436 2.425 10 10 CECE Nc1ccc(OCCCOCCOCC2CC2)cc1 400726064 NNCCDGYDVYJYKU-UHFFFAOYSA-N 265.353 2.481 10 10 CECE CCN1CCCN(c2ccc(CNC)cc2F)CC1 307867759 RKVANDSVKYWMBX-UHFFFAOYSA-N 265.376 2.077 10 10 CECE CCN(Cc1cccc(OC)c1O)[C@@H]1CCCOC1 402728975 JNROGPYAYRFJAU-CYBMUJFWSA-N 265.353 2.402 10 10 CECE Oc1cc2c(cc1CN[C@@H]1CC[C@@H]3C[C@@H]3C1)OCO2 403348600 HWAVAFXVILWBGZ-CKYFFXLPSA-N 261.321 2.399 10 10 CECE CN(C[C@@H]1CC[C@@H]2C[C@@H]21)S(=O)(=O)Cc1ccc(N)cc1 2157957515 CZXWTTOMOKLZAN-IPYPFGDCSA-N 294.420 2.077 10 10 CECE CN[C@@H](C)c1ccc(N2CCN(C(C)=O)CC2)cc1Cl 78902572 UVONYIROYWHMBN-NSHDSACASA-N 295.814 2.289 10 10 CECE CCN1CCCN(c2ccc(CN)c(F)c2)[C@H](C)C1 320198855 RAXVVFHIPOBQMK-GFCCVEGCSA-N 265.376 2.205 10 10 CECE COCCOC[C@H]1CCCN1Cc1cc(F)ccc1O 2158969876 WXBGTQZMXGULFY-CQSZACIVSA-N 283.343 2.159 10 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296.754 2.072 10 10 CECE CN1CCC12CC(CNCc1ccc3c(c1)CCO3)C2 1875868088 HSEQISGZRFEPMD-UHFFFAOYSA-N 272.392 2.195 10 10 CECE CC[C@H]1C[C@@H]1CCNS(=O)(=O)Cc1ccc(N)cc1 1875941592 ODAMNXPVBJWINZ-STQMWFEESA-N 282.409 2.124 10 10 CECE Cc1cccc(O)c1CN1CCN2C[C@H](C)C[C@@H]2C1 1876176304 GLZISWBWGFNGRM-TZMCWYRMSA-N 260.381 2.227 10 10 CECE Cc1cc(CN)ccc1N(C)[C@H]1CCCN(C)CC1 1877824585 YCBJGZQVBIULHR-HNNXBMFYSA-N 261.413 2.374 10 10 CECE C[C@@H]1CC[C@@H](O)CN1Cc1cc(F)cc(F)c1O 895033817 KLMSAFJZYVNVNK-LDYMZIIASA-N 257.280 2.016 10 10 CECE Cc1cc(CN)ccc1N1CC(O)(c2cccs2)C1 1878935592 IVBWOOWCJIQDRB-UHFFFAOYSA-N 274.389 2.223 10 10 CECE COc1cccc(CNC(=O)c2cnc(F)c(C)c2)c1O 1137473806 WWOCFGKLUDZBFD-UHFFFAOYSA-N 290.294 2.173 10 10 CECE CC1(C)SC(COc2ccc(N)cc2)=N[C@@H]1C(=O)O 1882727001 SCJZHNVBJATFJJ-LLVKDONJSA-N 280.349 2.025 10 10 CECE Nc1ccc(NC(=O)OC[C@H]2C[C@]23CCOC3)cc1 1897132092 UTYYFQGLOLHCTO-YGRLFVJLSA-N 262.309 2.244 10 10 CECE Cc1c(Cl)cccc1N=NN(C)CCS(=O)(=O)O 1088706317 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O[C@@H](c1ccc(N2CCCCC2)cc1)[C@H]1C=CCN1 2120520600 LWWJFFIGHUVUDM-CVEARBPZSA-N 258.365 2.238 10 10 CECE FC(F)C[C@H]1CN(c2ccc3c(c2)CCO3)CCN1 2120814451 LQHUXUUJWZFEMO-NSHDSACASA-N 268.307 2.055 10 10 CECE CC[C@H](C(F)F)N(C)CC(=O)c1ccc(O)c(O)c1 2122235671 MYBXZFYWXYMXKP-SECBINFHSA-N 273.279 2.256 10 10 CECE CCOc1ccc(C(=O)NCc2cc(O)ccc2O)cc1 1558174344 JTXSCUMOCSDSIU-UHFFFAOYSA-N 287.315 2.427 10 10 CECE CC[C@@H]1OCC[C@@H]1C(=O)N1CCC(N=[N+]=[N-])CC1 1912153642 CVGMOUDZDPUMGV-QWRGUYRKSA-N 252.318 2.103 10 10 CECE C[C@H]1C[C@@](NCCCN=[N+]=[N-])(C(=O)O)CCS1 1912154476 HVPVAHBAYYJKKL-WCBMZHEXSA-N 258.347 2.015 10 10 CECE CCN(CCN(C)C)c1ccc2c(c1)CCC[C@H]2N 2128277308 MGOKTXAIXDAJJD-MRXNPFEDSA-N 261.413 2.411 10 10 CECE C[C@]1(CO)CCCCN1c1ccc2c(c1)CC[C@H]2O 2128316612 HQTAVSOVOJGOPP-HZPDHXFCSA-N 261.365 2.408 10 10 CECE CN(C[C@H]1CCCN1C)c1ccc2c(c1)CC[C@H]2O 2128317900 RRSQMEMSITXZLL-GDBMZVCRSA-N 260.381 2.197 10 10 CECE O=C1c2ccc([N+](=O)[O-])cc2C(=O)c2ccc([N+](=O)[O-])cc21 5845170 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CECE COc1cc(N(C)[C@@H]2[C@H]3C[C@@H]3[C@H]3C[C@H]32)ccc1CN 2139684904 CHHMBJHIEYUKDF-FAHYXWLWSA-N 258.365 2.245 10 10 CECE Oc1cc2c(cc1CN[C@@H]1C[C@H]3C[C@H]1C[C@@H]3F)OCO2 1967870127 WLTMDGAIKJLUTK-LLHIFLOGSA-N 279.311 2.347 10 10 CECE CCOc1cccc(CN[C@H](C)C23CC(CO2)C3)c1O 1967853368 WAEXFJJPFJHHKN-OPGSHWCFSA-N 277.364 2.448 10 10 CECE [N-]=[N+]=NCCNC1(C(=O)O)CC2(C[C@H]2C(F)(F)F)C1 2140253980 YHCXGYUXNYARJK-KXNKJCORSA-N 278.234 2.072 10 10 CECE CC[C@@H]1OCC[C@@H]1CNCc1cc2c(cc1O)OCO2 233918369 QUGNJNFVEMLYQT-MFKMUULPSA-N 279.336 2.026 10 10 CECE CC[C@@H](NC[C@@H]1CCCS1(=O)=O)c1ccccc1O 126917590 DBXODFHYINOLNY-WCQYABFASA-N 283.393 2.010 10 10 CECE COC[C@H]1CC[C@@H]1N(C)c1c(F)cc(CN)cc1F 2142425873 WEIKLMOUXALTLQ-MFKMUULPSA-N 270.323 2.285 10 10 CECE C[C@@H]1CCS[C@H]1CNCc1cccc(O)c1O 1945617917 VGNAFPDRGLUCDI-SKDRFNHKSA-N 253.367 2.329 10 10 CECE COC[C@H](C)N1CCc2cc(OC)c(OC)cc21 1970280313 HZUKCCBDNDNACW-JTQLQIEISA-N 251.326 2.101 10 10 CECE NCC1CCC(Cc2cc(O)c(O)c(O)c2)CC1 1951592917 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CN[C@H](C)c1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)cc1 702343695 JDOKIYROILFXTO-UNEWFSDZSA-N 273.424 2.355 10 10 CECE Oc1c(CN[C@H]2CCN3CCC[C@@H]3C2)ccc(F)c1F 703349673 ZDNOIEFEEYKRGM-NWDGAFQWSA-N 282.334 2.387 10 10 CECE OCc1ccc(N2CC[C@H](N3CCC3)C2)cc1Cl 705391577 BKAKAVSDQAFNPX-ZDUSSCGKSA-N 266.772 2.117 10 10 CECE C[C@@H]1[C@H](N)CCCN1Cc1c(O)cccc1Br 706855753 PTNYNJRMPRSHPT-BXKDBHETSA-N 299.212 2.466 10 10 CECE CN1CCCc2cc([C@@]3(O)CNCC(C)(C)C3)ccc21 2163097629 PROYHBBWOICGSR-KRWDZBQOSA-N 274.408 2.276 10 10 CECE CN1CCc2cc(N3C[C@]4(C)CNC[C@]4(C)C3)ccc21 2163074068 OXEXTYDICIRYLG-CALCHBBNSA-N 271.408 2.115 10 10 CECE CN1CC[C@@H](CN(C)Cc2cc(F)cc(F)c2O)C1 708400845 PXWZKFWLJYQTKP-SNVBAGLBSA-N 270.323 2.054 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@@H]1CCC[C@H]1O 708580618 QJFDMFUELRRJST-CHWSQXEVSA-N 255.745 2.182 10 10 CECE CCO[C@H]1C[C@H]1C(=O)N(CC)Cc1ccc(N)cc1 689895940 FYAPNXAWSFBARR-KGLIPLIRSA-N 262.353 2.042 10 10 CECE CC(C)[C@@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)CO1 691718028 TTXCHKFSJRWFCE-STQMWFEESA-N 263.341 2.204 10 10 CECE CCOCCCN(C)c1ccc(CNC)cc1F 382785360 FGJYUJKAILCUIH-UHFFFAOYSA-N 254.349 2.408 10 10 CECE COC[C@@H](CCN[C@@H](C)c1ccc(N(C)C)cc1)OC 694362282 VQWBFQVFWCYXLX-XJKSGUPXSA-N 280.412 2.455 10 10 CECE CCN(C[C@@H](C)OC)c1ccc([C@@H](C)N)c(O)c1 383335125 OZSDSNODYFWTDV-GHMZBOCLSA-N 252.358 2.273 10 10 CECE C[C@@H]1O[C@H](C)C[C@@H]1N[C@H](C)c1c(O)cccc1O 384629637 RBMJUROIIRRUEA-ZNSHCXBVSA-N 251.326 2.314 10 10 CECE C[C@@H]1O[C@H](C)C[C@@H]1N(C)CCOc1ccc(N)cc1 384915193 OWRYHZBXPJLQOT-XUJVJEKNSA-N 264.369 2.145 10 10 CECE CNCc1coc(CN(C)c2ccc(OC)cc2)n1 387094085 BFLQNBJVMBXILH-UHFFFAOYSA-N 261.325 2.039 10 10 CECE CSCCCN(C)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 388795002 NOLAKMLYEHQKIU-LBPRGKRZSA-N 299.827 2.481 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H]2[C@@H](N)CC[C@H]2C1 389015182 XSOKJIDUQOKLST-QOBDMFJFSA-N 264.344 2.261 10 10 CECE Nc1ccc(CCN[S@@](=O)c2ccccc2)cc1 395187530 NHGXOVMFWLBOLG-SFHVURJKSA-N 260.362 2.124 10 10 CECE CCNCc1ccc(N2CCO[C@H]([C@H](C)O)C2)cc1Cl 2174147396 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Cc1ccc(O)c(CN[C@@H](C)CS(=O)(=O)C(C)(C)C)c1 2170589395 QBUJUNKGKNBBQP-LBPRGKRZSA-N 299.436 2.392 10 10 CECE CC[C@H](NC)c1ccc(N(C)[C@H]2COC[C@@H]2OC)cc1 2177271420 PSQMMWKFLIYBIC-JYJNAYRXSA-N 278.396 2.207 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@H]1CCCCNC1=O 2171241794 OGDNLFQHYUPCMP-GWCFXTLKSA-N 280.343 2.193 10 10 CECE Cc1cc(CN)ccc1N1CC[C@H](c2ccnn2C)C1 2171790951 CGOLNPBGTUZTBG-AWEZNQCLSA-N 270.380 2.181 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CC[C@H]3C(F)F)ccc21 2171881836 GSMXPTXMJOZIEW-NWDGAFQWSA-N 281.306 2.133 10 10 CECE COc1cc(CN2CCc3cc(CN)ccc32)ccn1 2189921353 KQZJPGSVEFNCTB-UHFFFAOYSA-N 269.348 2.112 10 10 CECE C[C@@H]1CN(CCN2CCc3cc(CN)ccc32)C[C@H]1C 2189918021 HQTKHEKNUYNFBV-ZIAGYGMSSA-N 273.424 2.096 10 10 CECE CNCc1ccc(N(C)C[C@](C)(COC)OC)c(F)c1 2198150626 LBIATFNATWPZSG-OAHLLOKOSA-N 284.375 2.033 10 10 CECE CN(c1ccc2c(c1)CCC[C@H]2N)[C@@H]1CN2CC[C@H]1C2 2184686329 GROKFTNDADNFHG-IAOVAPTHSA-N 271.408 2.163 10 10 CECE CN[C@H]1CCCc2cc(N3CC(CN(C)C)C3)ccc21 2184685656 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C[C@H](N[C@H]1CCN2CC[C@H]1C2)c1ccc(N(C)C)cc1 2192805120 PACBGCBZYFAZTD-QRTARXTBSA-N 273.424 2.497 10 10 CECE COCc1nc([C@@H](O)c2ccc3c(c2)CCN3C)cs1 2188782952 BMIIGSJZLOYGIL-HNNXBMFYSA-N 290.388 2.364 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN([C@H]2[C@H]3CC[C@@H](C3)[C@@H]2O)CC1 2076506607 BWXFUPZRCKFPOT-WJTVCTBASA-N 250.346 2.311 10 10 CECE CC(C)(C)C[C@H](CO)CNCc1ccc(O)cc1O 2100101567 HUMHTVDEZLTVJG-NSHDSACASA-N 267.369 2.232 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2cnnn2C)cc1Cl 2100252694 OYNPECMUICDKFF-VIFPVBQESA-N 280.759 2.158 10 10 CECE O=C(c1cccc(O)c1O)N1CCC[C@@]12CCSC2 2102290660 FGPSGZDWVNUGKK-AWEZNQCLSA-N 279.361 2.210 10 10 CECE C[C@H](CCN)N(C)Cc1ccc2c(c1)CCCN2C 2102578747 XYSFFOQPGKKVRP-CYBMUJFWSA-N 261.413 2.238 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)[C@H]1CN2CC[C@H]1C2 2102503327 BALXLHHPSSBEKR-SUNKGSAMSA-N 264.344 2.228 10 10 CECE CC(C)(C)c1ocnc1C(=O)N1CC[C@@H](N=[N+]=[N-])C1 2104138012 HZFBVFYUFKZFFD-MRVPVSSYSA-N 263.301 2.497 10 10 CECE Oc1cccc(F)c1CNC[C@@H]1C[C@H]2O[C@H]1[C@@H]1C[C@H]21 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CC[C@@H](C)CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 155743238 KCVWESAWFRSSFV-QMTHXVAHSA-N 261.369 2.145 10 10 CECE O=C(NCC/C=C/Br)c1ccc(O)c(O)c1 1980881046 JRUNVQXONZRECJ-ORCRQEGFSA-N 286.125 2.126 10 10 CECE C[C@H](N[C@H]1CCN2CCC[C@@H]2C1)c1ccc(O)cc1O 157409800 RSZCXZXCCVIYSR-RWMBFGLXSA-N 276.380 2.375 10 10 CECE CCOC(=O)C[C@H](N)c1c(O)ccc2c1CCCC2 259878988 AJBXJVCCCWYOLO-LBPRGKRZSA-N 263.337 2.224 10 10 CECE C[C@H](O)[C@@H]1C[C@H]1NCc1cccc(Br)c1O 1985622293 HQEHJTKOPDBTNK-OVYXKVPISA-N 286.169 2.014 10 10 CECE COC(=O)CC[C@H](C)N(C)c1ccc(OC)cc1 261351975 NVFAEYYPMKCEJJ-NSHDSACASA-N 251.326 2.473 10 10 CECE Nc1ccc(-n2ccc(C(=O)NC3CCCC3)n2)cc1 35427782 PXYZGEYKGPIGLV-UHFFFAOYSA-N 270.336 2.127 10 10 CECE CCN[C@H](c1ccccc1O)[C@@](C)(O)[C@H]1CCCCO1 2148153566 PGCPYLRNXKNSRW-OAGGEKHMSA-N 279.380 2.363 10 10 CECE C[C@H](O)c1ccc(N2CC3(CCO3)C2)cc1Cl 2004482560 SELPRYLWDWTMRJ-VIFPVBQESA-N 253.729 2.372 10 10 CECE CN(C)c1ccc(CN[C@H]2CCN3CCC[C@H]23)cc1 37168306 ODWBTVFKFBEHLW-JKSUJKDBSA-N 259.397 2.079 10 10 CECE C[C@@H]1CCS[C@@H]1CN(C)CC(=O)Nc1ccc(N)cc1 2150866561 HDILNUIWPAPJAW-BXUZGUMPSA-N 293.436 2.281 10 10 CECE C[C@H](NC(=O)CCOc1ccc(N)cc1)[C@H]1CCSC1 2146125869 DWNGYDZIGBBWEG-RYUDHWBXSA-N 294.420 2.296 10 10 CECE CCCN1CCO[C@@H]([C@@H](NCC)c2ccccc2O)C1 2146243135 YIYXFJBYCDONDW-CVEARBPZSA-N 278.396 2.154 10 10 CECE C[C@@H](NCCO[C@@]1(C)CCOC1)c1cc(F)ccc1O 2146262881 OBGVPOUADVPVSL-ABAIWWIYSA-N 283.343 2.378 10 10 CECE CCNCc1ccc(N2C[C@H](O)[C@@H]2C)cc1Cl 2011379649 MJJZCIZFVKVPHZ-ZANVPECISA-N 254.761 2.019 10 10 CECE CCCNCc1ccc(OC[C@@H]2COCCO2)c(C)c1 2154023842 SJRMAZDERVQPLZ-HNNXBMFYSA-N 279.380 2.289 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CO)cc1Cl 2018112448 NYWYSEWRPQFFCG-SKDRFNHKSA-N 255.745 2.182 10 10 CECE O=[N+]([O-])c1ccccc1CNCc1cccc(O)c1O 50015645 UGTCIOVNAWKAFN-UHFFFAOYSA-N 274.276 2.296 10 10 CECE Cc1ncn([C@@H](C)C(=O)Nc2ccc(N)cc2)c1C 51926009 SXONIJIAHNMMLM-NSHDSACASA-N 258.325 2.282 10 10 CECE NCc1ccc(N2CC[C@@H]3COC[C@@H]32)c(Cl)c1 2021412268 JDJUAWHLTCDAOA-MFKMUULPSA-N 252.745 2.024 10 10 CECE NCc1ccc(N2C[C@@H](O)C23CCC3)cc1Br 2023235395 ALUAMRHIOZTHLJ-GFCCVEGCSA-N 297.196 2.011 10 10 CECE Cc1cc(OCC(=O)N2CCC[C@H](N=[N+]=[N-])CC2)no1 2155558469 PTQSISDSDZBKSM-JTQLQIEISA-N 279.300 2.053 10 10 CECE COc1cc(N2CC[C@H](SC)C2)ccc1CO 2024759866 FYDDAQFPRBNFMQ-LBPRGKRZSA-N 253.367 2.129 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1nnc(C)s1 2029158547 QGVGUGMLTWUCEZ-GFCCVEGCSA-N 262.382 2.221 10 10 CECE CC[C@@H](CN(C)C)NCc1ccc(F)c(F)c1O 2029864222 PGPZGOOQTYWNNJ-JTQLQIEISA-N 258.312 2.100 10 10 CECE CCOC(C)(C)COCCOc1ccc(N)cc1 2033165486 LQJWKJWZOPDEAE-UHFFFAOYSA-N 253.342 2.479 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](O)C(F)(F)C2)c(Cl)c1 2034604771 SONFQGGPJIULBS-RDDDGLTNSA-N 276.714 2.176 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nccn2C)cc1 62253017 AUNYLKBJHJSUAC-LBPRGKRZSA-N 258.369 2.337 10 10 CECE CCN[C@H](CC)c1ccc(N(C)CCOCCO)cc1 312543144 IJVWSBSVSLDYEL-MRXNPFEDSA-N 280.412 2.192 10 10 CECE CC[C@H](O)[C@H](CC)N[C@H](C)c1cc(O)ccc1O 313124793 XDPXFHDEYUJKPR-ICCXJUOJSA-N 253.342 2.298 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)CC[C@H]1CCCN1 313217057 QHVMTYNXZDBRTF-CHWSQXEVSA-N 276.380 2.444 10 10 CECE CSCCCSC[C@H](O)COc1ccc(N)cc1 319252322 CCWVJUDTHVWGMK-GFCCVEGCSA-N 287.450 2.495 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC[S@](=O)CC2)cc1O 321640040 LERJTBCWPIMPTQ-YUNKPMOVSA-N 296.436 2.022 10 10 CECE COCc1csc(C(=O)NCCCN=[N+]=[N-])c1 701647268 NNMIGZTURUNUIH-UHFFFAOYSA-N 254.315 2.325 10 10 CECE COc1cccc(O)c1CN(CC(=O)O)C1CCCC1 2160701434 RQICOJXUEDWZFH-UHFFFAOYSA-N 279.336 2.230 10 10 CECE CN1C(=O)[C@@H](O)c2ccc(N(C3CCC3)C3CC3)cc21 2161293439 XHLNGUAFWXNPDK-HNNXBMFYSA-N 272.348 2.218 10 10 CECE C[C@H]1CC(C)(C)CN1c1cc2c(cc1F)[C@H](O)C(=O)N2 2170900670 QVAOLDVLWXBQKN-SDBXPKJASA-N 278.327 2.436 10 10 CECE CC(C)CC1(NCc2ccc(O)c(O)c2O)CC1 701466913 QGYXYNKUGXZGKA-UHFFFAOYSA-N 251.326 2.472 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3CN(C)C[C@]3(C)C2)cc1 702343691 JDOKIYROILFXTO-FRFSOERESA-N 273.424 2.355 10 10 CECE CN1C[C@@H]2CN(Cc3cccc(Cl)c3O)C[C@@]2(C)C1 702415130 UICDHLQFUFRWTM-IUODEOHRSA-N 280.799 2.429 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@@H]1CCCC12CC2 706574550 RSQUBMGVCIMEPY-CQSZACIVSA-N 274.364 2.439 10 10 CECE CN(C[C@@H]1CCC[C@@H]1O)c1ccc(CO)c(Cl)c1 689253532 MAYOWFYVMVIFPD-HZMBPMFUSA-N 269.772 2.430 10 10 CECE CCOC(=O)c1nc(C(=O)Nc2ccc(N)cc2)cs1 2162281005 ZPZZMEOJVPCATB-UHFFFAOYSA-N 291.332 2.154 10 10 CECE CCOc1nccnc1NCCc1ccc(N)cc1 686295729 UZJQKBYRMQFTFT-UHFFFAOYSA-N 258.325 2.112 10 10 CECE CCn1nc(C)cc1[C@@H](N)c1ccc(N(C)C)cc1 686756255 FRACFVIAPPHIJG-HNNXBMFYSA-N 258.369 2.326 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1C[C@H]2CC[C@H]1O2 708498097 XNEBAZOHXSNASQ-RLCGTCKNSA-N 269.291 2.328 10 10 CECE COc1cc(N)c(N(CCN(C)C)C(C)C)cc1OC 688264499 YRGRDQKFTKUSOK-UHFFFAOYSA-N 281.400 2.062 10 10 CECE CCN(CC(=O)Nc1ccc(N)cc1)Cc1ccoc1 688529243 CAIKHPGSSFZVEH-UHFFFAOYSA-N 273.336 2.322 10 10 CECE C[C@H]1CC[C@H](CO)CN1c1ccc([C@@H](C)O)cc1F 688727634 BZOCBQPFDUVVJX-TUAOUCFPSA-N 267.344 2.476 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1CNCC1(C)C 711370391 RIZLESAYTHNHHP-YPMHNXCESA-N 276.380 2.157 10 10 CECE COc1nscc1COC(=O)CCc1ccc(N)cc1 711558008 YCOWCURKYLVFGN-UHFFFAOYSA-N 292.360 2.410 10 10 CECE Cc1ccc(SCC(=O)c2ccc(O)c(O)c2)nn1 712497685 XQUPANRARAVVPA-UHFFFAOYSA-N 276.317 2.171 10 10 CECE CCCN(c1cc(OC)c(OC)cc1N)[C@@H]1CCOC1 383877968 ZXSMEHDXNXINHD-LLVKDONJSA-N 280.368 2.291 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(Cc2cnc3cccnn23)C1 2172298153 KVPSRVJQQRMAOO-LLVKDONJSA-N 271.328 2.252 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCC[C@@]2(CCNC2)C1 2163335739 UIHQUHXZPROBKK-LRDDRELGSA-N 276.380 2.234 10 10 CECE C[C@@H](N)c1ccc(N2CCS[C@@H](CO)C2)c(Cl)c1 720028542 TZZXKNPPTXCCTM-MWLCHTKSSA-N 286.828 2.274 10 10 CECE Cc1ccc([C@@H](C)N[C@H](C)c2cn(C)nn2)c(O)c1 720540990 ORNOHLRTVRJNLS-GHMZBOCLSA-N 260.341 2.241 10 10 CECE CCOc1ccccc1NC[C@H](O)CN(C)C(C)C 389016219 XYYVOMABGJRJNL-ZDUSSCGKSA-N 266.385 2.198 10 10 CECE CC(C)[C@H]1COC[C@H]1N[C@@H](C)c1c(O)cccc1O 699457183 NSNBGXYUNBLMAR-QJPTWQEYSA-N 265.353 2.419 10 10 CECE CC(C)(NS(=O)(=O)Cc1ccc(N)cc1)C(F)(F)F 393864269 DMDFKEZBQYIXLA-UHFFFAOYSA-N 296.314 2.029 10 10 CECE CC(C)CNCc1ccc(N2CC(C)(O)C2)c(F)c1 394967175 MCKNTOVQWXYFER-UHFFFAOYSA-N 266.360 2.142 10 10 CECE CN[C@H](C)c1ccc(N2C3COCC2COC3)cc1Cl 399791759 XNDMXEXFIWQRQW-QFWMXSHPSA-N 296.798 2.224 10 10 CECE COc1cccc(O)c1[C@H](C)NC[C@@H]1CCC[C@H]1O 2064627320 KGCRGEXPKOVWKY-SDDRHHMPSA-N 265.353 2.212 10 10 CECE Nc1ccnn1Cc1cccc(C(F)(F)F)c1O 2069874021 CSHSHVCSMQGWNK-UHFFFAOYSA-N 257.215 2.238 10 10 CECE Cn1cnc(Cl)c1CN1CCCc2cc(CN)ccc21 2168231795 OHHSETFQLOWYCO-UHFFFAOYSA-N 290.798 2.485 10 10 CECE COc1ccc(N(C)[C@@H](CCO)C(F)F)c([N+](=O)[O-])c1 2178518089 NCEAQPUKYXBBQU-JTQLQIEISA-N 290.266 2.056 10 10 CECE CCc1ccc(S(=O)(=O)Nc2ccc(O)cc2N)cc1 2175287242 ZYWYJXLPFIMFFA-UHFFFAOYSA-N 292.360 2.338 10 10 CECE Cn1cc(NC(=O)c2ccc(O)c(O)c2)c(C(F)F)n1 2178732785 HWXHNWJOTDUEKI-UHFFFAOYSA-N 283.234 2.021 10 10 CECE N[C@@H]1C[C@H]2[C@@H](C1)[C@@H]2[C@@H](O)c1ccc(N2CCCC2)cc1 2169212818 XWQKASOLMQSWDW-OBCVZTRHSA-N 272.392 2.304 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CO[C@@]3(CCOC3)C2)cc1 2179036329 LHJOGDHRVCGNKL-MAZHCROVSA-N 276.380 2.091 10 10 CECE Cc1cccc(O)c1Cn1nc(CN)cc1C(F)(F)F 2079180034 ICXSWAAEFMMWFF-UHFFFAOYSA-N 285.269 2.423 10 10 CECE N[C@H]1CCN(c2ccc3c(c2)CCC3)CC1(F)F 1149621734 PQKLRVXHKZMGMO-ZDUSSCGKSA-N 252.308 2.348 10 10 CECE C[C@H]1CC[C@H](CNC(=O)c2cc(O)c(O)c(O)c2)CC1 2192826387 IHNLGXDDSIIZRX-MGCOHNPYSA-N 279.336 2.360 10 10 CECE Cc1ncn(C)c1[C@@H](O)c1ccc2c(c1)CCCN2C 2188543609 RUUBXTBQQRUVAF-INIZCTEOSA-N 271.364 2.193 10 10 CECE COc1cc(N)ccc1NCCOc1ccc(N)cc1 2193211404 YKEAFOKGNZQSJV-UHFFFAOYSA-N 273.336 2.351 10 10 CECE O=C(N[C@H]1CCCC12CCC2)c1cc(O)c(O)c(O)c1 2188933266 ZUHDCJCGPRXYSM-LBPRGKRZSA-N 277.320 2.256 10 10 CECE Cc1cc(N2CCOC[C@@H]2CF)ccc1CNC1CC1 2182605218 LEUIAQYDNWIMNR-INIZCTEOSA-N 278.371 2.422 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CCCc2ccoc21 2182925351 IVLZUEOPOKNZBM-ZBFHGGJFSA-N 273.332 2.470 10 10 CECE COc1ccc(O)c(CN2CC[C@H]3CCC[C@@]32CN)c1 2197339926 KXUYXFIVYMHSIO-CZUORRHYSA-N 276.380 2.104 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@H]3C[C@@H]32)cc1Cl 1907000375 QQYMFOCNECSRQE-AQUOVQTQSA-N 253.729 2.371 10 10 CECE Cc1ccc([C@H](C)N[C@H]2C[C@H](n3ccnn3)C2)c(O)c1 2184108579 YPPQHNKOVLOZJJ-AVGNSLFASA-N 272.352 2.346 10 10 CECE C[C@H](O)c1ccc(N2[C@H]3CC[C@@H]2C[C@H](CO)C3)cc1O 2184584445 WRIVSFGCWKSGRS-RVMXOQNASA-N 277.364 2.185 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C1C[C@H]2CC[C@@H]2C1 2190336931 GNOCMLDQAMQXSP-GHMZBOCLSA-N 275.348 2.401 10 10 CECE CN1CC[C@H](CN(C)c2ccc3c(c2)CCC[C@@H]3N)C1 2184687032 NHENPDGVADMNQQ-GUYCJALGSA-N 273.424 2.411 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)C[C@H]1N(C)C 2184691692 RITNHPSNZOIBJN-VUCTXSBTSA-N 274.408 2.443 10 10 CECE CN(Cc1ccn(C)n1)c1ccc2c(c1)CCC[C@H]2N 2184687516 SCOXKMVOAZWMBN-MRXNPFEDSA-N 270.380 2.393 10 10 CECE CO[C@H]1C[C@@H](CNCc2cccc(O)c2O)C12CCC2 2190404257 SBAFIFUGSFUWCA-JSGCOSHPSA-N 277.364 2.393 10 10 CECE N[C@@H]1CCc2cc(N3CCC[C@H](N4CCC4)C3)ccc21 2184727835 XXNCWROZPGJOEG-DOTOQJQBSA-N 271.408 2.307 10 10 CECE N[C@@H]1CCc2cc(N3CCC[C@]34CC[S@@](=O)C4)ccc21 2184725075 HGPAYSZZHAHKBY-JXXFODFXSA-N 290.432 2.124 10 10 CECE CN[C@H]1CCc2cc(N3CCC[C@H]3CN(C)C)ccc21 2184719997 VIJGYURCAWUERE-RDJZCZTQSA-N 273.424 2.424 10 10 CECE O[C@@H]1CCc2cc(N3CCS[C@H]4COCC[C@@H]43)ccc21 2184731831 MWLBPBSQAKMRPW-XHSDSOJGSA-N 291.416 2.377 10 10 CECE CN(c1ccc(OCC(F)(F)F)cc1)[C@@H]1[C@@H]2CNC[C@@H]21 2194313087 CVMWBCZJFGDHDK-CLLJXQQHSA-N 286.297 2.282 10 10 CECE C[C@@H](CNCc1c(O)cccc1F)[C@H]1CCCO1 2042605416 OSEGGCSBBAWBTJ-IINYFYTJSA-N 253.317 2.436 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCCc3ccc(O)c(O)c3)[C@H]2C1 2190507548 WKJULPVIXVHGGK-YIYPIFLZSA-N 277.364 2.043 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCC2(CCC2)C1 2043612919 SZPNEEAMWRUAIT-GFCCVEGCSA-N 252.318 2.152 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)c1cnsn1 2044733296 KEXYDQIJBYCJLM-ZDUSSCGKSA-N 261.350 2.220 10 10 CECE CN1CCc2cc([C@](C)(O)c3cncs3)ccc21 2044709089 UHNFNISPXYRVBQ-AWEZNQCLSA-N 260.362 2.391 10 10 CECE C[C@@H]1CCNC[C@@H]1N(C)Cc1cc(Cl)ccc1O 2045223748 ZTRNZVXNUFTFDJ-MFKMUULPSA-N 268.788 2.475 10 10 CECE CCN(CC)c1ccc([C@H](N)c2nc(C)n(C)n2)cc1 2190730279 BGZSMFYVCCZSCR-AWEZNQCLSA-N 273.384 2.018 10 10 CECE CC1(C)COCC[C@@]1(C)NC(=O)Cc1ccc(N)cc1 2198272185 RVNMZHVYEMTRMX-MRXNPFEDSA-N 276.380 2.133 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H](O)[C@@H](C3CC3)C2)c(F)c1 2194692628 VWNDWJXNBYIMST-OLXJLDBKSA-N 282.334 2.192 10 10 CECE Nc1ccc(NC(=O)N[C@@H]2CC[C@@H]3[C@@H]2C3(F)F)cc1 2102153432 RHQPSBOFWZFMBA-MXWKQRLJSA-N 267.279 2.434 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H]3COC[C@@H]3C2)c(F)c1 2194698008 SXLVTVCHSIMVAN-NHCYSSNCSA-N 282.334 2.457 10 10 CECE CC[C@H](O)c1ccc(N2CC[S@](=O)[C@H](C)C2)cc1 2051901851 GSABFAWLUCGGTL-VZSAFFHGSA-N 267.394 2.087 10 10 CECE OCc1cc(F)c(N2C[C@@H]3C[C@@H]3[C@@H]3C[C@H]32)c(F)c1 2053729633 IAJJUMBPVXJSPB-AVWBDOJWSA-N 251.276 2.302 10 10 CECE CO[C@@H]1CN(c2cc(Cl)c(CN)cc2F)C[C@H]1F 2057248663 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10 10 CECE COC1(CNCc2ccc(F)cc2O)CC(CF)C1 2274606918 IIPPSAQHFWIWSK-UHFFFAOYSA-N 271.307 2.386 10 10 CECE COc1ccc(NCc2ccc(O)cc2O)c(C)n1 2266839729 SJAFOCLXFSNXRO-UHFFFAOYSA-N 260.293 2.422 10 10 CECE COc1ccc(N2CC[C@@H]([C@@H](C)N)C2)c2c1CCC2 2269169177 SCJDABMMQJRORM-VXGBXAGGSA-N 260.381 2.357 10 10 CECE COCC(COC)N(C)c1ccc([C@@H](C)N)c(C)c1 2269662398 SBHRVZMAEPQOBA-GFCCVEGCSA-N 266.385 2.112 10 10 CECE C[C@@H]1CC[C@H](C[S@](=O)CC(=O)c2ccc(O)c(O)c2)C1 2283992519 FRGZFQVQAIFSRK-NLQQUQSOSA-N 296.388 2.465 10 10 CECE COC[C@@]1(C)C[C@@H]1CNCc1ccc2c(c1)CCN2C 2284711870 RHSJAEWFSUXGKS-NVXWUHKLSA-N 274.408 2.441 10 10 CECE O[C@@H](C[C@H]1CC1(F)F)c1ccc(N2CCNCC2)cc1 2286068801 RRKAYDNFOSBBGP-JSGCOSHPSA-N 282.334 2.175 10 10 CECE CC(C)[S@@](C)(=O)=NCc1ccc(N2CCNCC2)cc1 2286074461 ZBSWFNZYLOSGJM-HXUWFJFHSA-N 295.452 2.102 10 10 CECE CCC=C1CN(Cc2ccc(N3CCNCC3)cc2)C1 2286068870 UFOYHIQDBGWLLE-UHFFFAOYSA-N 271.408 2.248 10 10 CECE CC[C@@H](NCc1cccc(OC)c1O)[C@H](C)CN(C)C 2288839422 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263.337 2.027 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](CO)C3(CCC3)C2)cc1 1914525389 PAQYHJNIRHEWOM-OCCSQVGLSA-N 261.365 2.339 10 10 CECE COc1ccc(N2CC[C@H](C[C@@H](C)N)C2)c(OC)c1 107946041 ZCHSEIXQFGSJKV-VXGBXAGGSA-N 264.369 2.267 10 10 CECE CC(C)(C)[C@@](CN)(Sc1nccs1)C(=O)O 1904757874 SGIMSVKRWPIRIF-JTQLQIEISA-N 260.384 2.063 10 10 CECE CNCc1ccc(N2CC[C@@]23CCOC3)cc1Cl 1915840088 SXRJYBOWTQMMPH-AWEZNQCLSA-N 266.772 2.429 10 10 CECE CNCc1cc(F)c(N2CCN(C)C(C)(C)C2)c(F)c1 110731401 LBWCXNRUWLLQDY-UHFFFAOYSA-N 283.366 2.215 10 10 CECE O=C(O)[C@@H]1CC(F)(F)CCN1Cc1ccccc1O 1968201530 PTOKQHLGARNZCQ-JTQLQIEISA-N 271.263 2.077 10 10 CECE CCc1cccc(CN[C@H](CCO)C(F)F)c1O 1918517158 GNIRDVLUCJCXRA-LLVKDONJSA-N 259.296 2.060 10 10 CECE Oc1cc(F)ccc1CN[C@@H]1C[C@H]2COC[C@H](C2)C1 2141784073 OQFDFTFVTBCYPF-YABSGUDNSA-N 265.328 2.436 10 10 CECE COc1ccc(CNCC[C@@H]2CCCCO2)c(O)c1 227336010 FRSMXLGCKIABNR-ZDUSSCGKSA-N 265.353 2.450 10 10 CECE CC[C@@H]1CN(Cc2cc(C(C)=O)ccc2O)CCC1=O 229791896 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RMSUOKMSZOCLSJ-UHFFFAOYSA-N 278.396 2.319 10 10 CECE CN(C)CC1(NCc2c(O)cccc2Cl)CC1 1942732143 OFGORBVDGJTPKX-UHFFFAOYSA-N 254.761 2.229 10 10 CECE CCN1CCc2cc([C@H](O)[C@H](N)[C@@H](C)SC)ccc21 2142096836 JQJKZZIZZBISHJ-KMUNFCNLSA-N 280.437 2.181 10 10 CECE Oc1ccsc1-c1nc([C@@H]2CN3CCC[C@H]3CO2)no1 252546734 KUVVRCQUGXKWGY-WPRPVWTQSA-N 293.348 2.039 10 10 CECE Cc1cc(N(C)[C@H]2[C@H]3[C@H]4[C@H]3C[C@@H]3[C@H]4[C@H]23)ccc1CN 2143310358 OYUJARKXRHMGEZ-GHLYRHEWSA-N 254.377 2.400 10 10 CECE CC[C@H](N)c1ccc(N2CCO[C@H]3COCC[C@@H]32)cc1 2143772943 XFBXWPICZBYJSO-JYJNAYRXSA-N 276.380 2.091 10 10 CECE N[C@H]1CCCC[C@H]1CCC(=O)NCc1ccccc1O 2143786988 SPGFAVYHSBJNHB-JSGCOSHPSA-N 276.380 2.306 10 10 CECE CC(C)(NC(=O)Cc1ccc(N)cc1)[C@H]1CCCCO1 2150559627 NRMJFEQSAWJCTR-CQSZACIVSA-N 276.380 2.275 10 10 CECE c1csc(SC[C@H]2CNCC3(CCC3)O2)n1 1979078038 PAYNPKYYECJDED-SECBINFHSA-N 256.396 2.146 10 10 CECE C[C@H](N[C@H]1CC[C@@H](C(=O)O)CC1)c1c(O)cccc1O 2144465667 HMABWSHNDMYNGV-GARJFASQSA-N 279.336 2.392 10 10 CECE COC(=O)[C@](C)(Cc1ccc(F)cc1)NCCN=[N+]=[N-] 158529681 HSAQPRWTPIAUFP-ZDUSSCGKSA-N 280.303 2.200 10 10 CECE CCN[C@H](c1ccccc1O)[C@](C)(O)C[C@H]1CCOC1 2148145479 XRCLBFGNOMCGCA-DAXOMENPSA-N 279.380 2.220 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@H](O)c1c(C)n[nH]c1C 2148155661 MHDODCADVVFABH-GJZGRUSLSA-N 275.352 2.116 10 10 CECE CC(C)NCc1ccc(N2CCOC[C@H]2CO)c(Cl)c1 168334749 MZKPNEGIPCKARK-CYBMUJFWSA-N 298.814 2.036 10 10 CECE CC(=O)N1CCN(c2ccc3c(c2)CC[C@H](C)N3)CC1 168347417 FNVHKXCYCPEYPS-LBPRGKRZSA-N 273.380 2.102 10 10 CECE CS(=O)(=O)CCCNCc1c(O)ccc2ccccc12 38047216 NKMSYPUPKMTUAK-UHFFFAOYSA-N 293.388 2.070 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@H](O)C2)cc1Br 2000825254 ROBGYENLKWXINE-KOLCDFICSA-N 298.180 2.240 10 10 CECE c1ccc(Cn2nnnc2Sc2nccs2)cc1 60217656 LOXATSOFNQXICJ-UHFFFAOYSA-N 275.362 2.329 10 10 CECE CN[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccc(N(C)C)cc1 2151260142 FGKFPXQUQPJZRX-ACHSLPGTSA-N 273.424 2.467 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H]2C[C@@H](C(=O)O)C[C@H]2C1 2158864571 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2.393 10 10 CECE Cc1nc([C@H](N)c2ccc(N(C)C)cc2)n2c1CCC2 2178108157 RIXRJUQPPXURMN-OAHLLOKOSA-N 270.380 2.252 10 10 CECE CC(C)(C)c1ocnc1[C@H](O)[C@H](N)c1ccccc1O 2178416914 GDYNKJIOPDGSSN-DGCLKSJQSA-N 276.336 2.411 10 10 CECE COc1cccc(CN2C[C@H](CN)CC23CCC3)c1O 2174637349 WZXWIRHZRBCMRP-LBPRGKRZSA-N 276.380 2.104 10 10 CECE CNCc1cc(F)c(N(C)CC2[C@@H]3COC[C@@H]23)c(F)c1 2174638184 FUPQMUTYXNEPRA-RYUDHWBXSA-N 282.334 2.013 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)c(F)c1 2178689419 QIJYPKUHRBKGAX-LESCFKLSSA-N 278.371 2.456 10 10 CECE Cn1ncc(COC(=O)CCc2ccc(N)cc2)c1Cl 2168236360 ZZQAQBFCVBDERG-UHFFFAOYSA-N 293.754 2.332 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC(C(C)(C)F)C3)ccc21 2178914102 JZVXQEAJAKXRGJ-ZDUSSCGKSA-N 277.343 2.084 10 10 CECE CN[C@@H](C)c1ccc(N2CC(=O)NCC2(C)C)cc1Cl 2175724898 KBCFTHADIRSYJO-JTQLQIEISA-N 295.814 2.335 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCO3)C[C@@H]1CNC1CC1 2169443581 YSCAJFUVLHRMMF-OCCSQVGLSA-N 272.392 2.446 10 10 CECE 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Cc1ccc(O)c(CN[C@H]2C[C@@H]3CC[C@@]2(CO)C3)c1 2329382207 JOJVYGURSYJUPA-RCBQFDQVSA-N 261.365 2.341 10 10 CECE C[C@]1(O)C[C@@H]2C[C@H]1C[C@@H]2NCc1cccc(F)c1O 2330899944 CMUBUUBJFWFLOH-UHXUCMFUSA-N 265.328 2.170 10 10 CECE Cc1ccc(CN2[C@H]3CC[C@@H]2CN(C)CC3)c(O)c1 2333190965 NNVNFHJMSLGTJN-LSDHHAIUSA-N 260.381 2.369 10 10 CECE CC[C@H](O)c1ccc(N2C[C@@]3(CO)CC[C@H]2C3)cc1 2336483435 CRODPYAIKKKTCJ-HRCADAONSA-N 261.365 2.481 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccn2nccc2c1 2337775481 ANZLZMZVAJLXGM-UHFFFAOYSA-N 258.285 2.107 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)c1cc(F)cc(F)c1 2337779061 GJEYTQNVRKEJCY-UHFFFAOYSA-N 290.295 2.286 10 10 CECE CC1(C)C[C@@H](O)CN1c1ccc(CO)c(C2CC2)c1 2339145390 JQHWIPNMTGAKGS-CQSZACIVSA-N 261.365 2.406 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC[C@]3(O)C[C@@H]3C2)c1C 2340857330 PQULZJIGDHTMNZ-ZENOOKHLSA-N 261.365 2.318 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC[C@@H](O)[C@H](F)C2)c1C 2340861543 LCTXHTRQZRWVBC-NJZAAPMLSA-N 266.360 2.232 10 10 CECE CC1(C)C[C@H](CN2CCC(N=[N+]=[N-])CC2)OC(=O)N1 2343112787 DTUWREDOSCJCLA-SNVBAGLBSA-N 267.333 2.038 10 10 CECE Oc1cccc(Cl)c1CNC1Cc2nccnc2C1 2351592528 UPTPRONEBLCDPB-UHFFFAOYSA-N 275.739 2.093 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])C[C@H]2C[C@H]1[C@@H]1C[C@H]21 2355332540 SKQINWWXOZCEBZ-MPLKPFFPSA-N 278.356 2.254 10 10 CECE CN(C)c1ccc(CNC(=O)NCc2cscn2)cc1 51191964 LVNXKDUTMVDSJQ-UHFFFAOYSA-N 290.392 2.209 10 10 CECE COCCCSCC(=O)N(C)c1ccc(N)cc1 111658744 RKCGCLKWPSJRFC-UHFFFAOYSA-N 268.382 2.001 10 10 CECE CC(C)(C(=O)O)N1C(=O)/C(=C\c2ccc[nH]2)SC1=S 27230850 RSAAFMGYMHRNII-SOFGYWHQSA-N 296.373 2.079 10 10 CECE Cc1cc(NC(=O)[C@H](C)N(C)Cc2ccccc2O)no1 171925707 BPPNXUWRHYXYIV-NSHDSACASA-N 289.335 2.148 10 10 CECE COc1ccc([C@H](C)N[C@H]2CCO[C@@H]2C)c(O)c1 149402612 DBCXIGNXDBHPDO-CWSCBRNRSA-N 251.326 2.229 10 10 CECE COc1ccc(O)c(CN[C@@H](C)c2cn[nH]c2C)c1 180900425 KTPJTSNEHOYVSK-VIFPVBQESA-N 261.325 2.283 10 10 CECE CN1CCCN(C/C=C\c2ccc(N(C)C)cc2)CC1 38195486 BNPXLCSWCWTWIM-XQRVVYSFSA-N 273.424 2.403 10 10 CECE Nc1ccc(OCCNC(=O)c2ccc(F)cc2F)cc1 38079512 QZAYQFNXXJSMHH-UHFFFAOYSA-N 292.285 2.356 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ncccc1N 317504804 OXVPPNWNYHTKFW-UHFFFAOYSA-N 298.390 2.392 10 10 CECE C[C@H]1CCC[C@H](C)N1NCc1ccc(O)cc1O 214009961 BQOKUYYMACDTDZ-QWRGUYRKSA-N 250.342 2.365 10 10 CECE Cc1ccnc(NC(=O)Nc2cc(O)c(O)c(O)c2)c1 217278943 BSCITVNLRCFLNG-UHFFFAOYSA-N 275.264 2.151 10 10 CECE COc1ccc(N2CC[C@H](NC(C)C)C2)cc1F 71199049 RTJRQPMVANLKLT-NSHDSACASA-N 252.333 2.411 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)c1csnn1 87466130 YZCWDVZKWPSZHS-UHFFFAOYSA-N 276.365 2.173 10 10 CECE CCNCc1ccc(N(CCOC)[C@H](C)COC)c(F)c1 42609300 OBHKIMARVSNQCR-CYBMUJFWSA-N 298.402 2.423 10 10 CECE c1csc(SCCCN[C@H]2CCCOC2)n1 132271219 SQIKBWKCCSMGAM-JTQLQIEISA-N 258.412 2.394 10 10 CECE Cc1cc(Br)c(O)c(CNC[C@H](C)CO)c1 134749438 RQWNLSYPCSVVJR-VIFPVBQESA-N 288.185 2.181 10 10 CECE CO[C@H]1CC[C@@H](NCc2ccc(N3CCOCC3)cc2)C1 190951211 QIEKLKOBFZHCLQ-WBVHZDCISA-N 290.407 2.180 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](O)C2)c(F)c1 227054234 FVJCHYFJJUZUHM-ZYHUDNBSSA-N 252.333 2.067 10 10 CECE CC(C)(C)CS(=O)(=O)Nc1ccc(O)cc1F 85203926 NMFDDFWKAVMWEP-UHFFFAOYSA-N 261.318 2.319 10 10 CECE C[C@@H](CCN(C)C)N[C@@H](C)c1c(O)cccc1O 235073350 BVLSVZAHPUUBJZ-QWRGUYRKSA-N 252.358 2.089 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCCC1(C)C 94310592 YJTCPKZRFLPHMN-GFCCVEGCSA-N 254.334 2.398 10 10 CECE COC(=O)[C@H](CCc1ccccc1)NCCN=[N+]=[N-] 90256973 XYMSEJLADUUEFJ-LBPRGKRZSA-N 262.313 2.061 10 10 CECE CC[C@H](O)[C@H](N)c1cc(Br)cc(F)c1O 95805185 DUMXQKOERGAALI-DTWKUNHWSA-N 278.121 2.065 10 10 CECE CCOc1ccc(O)c(CN2CC[C@]3(CCOC3)C2)c1 93820662 CAPHPLFFLRHYAN-INIZCTEOSA-N 277.364 2.403 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C)[C@@H](O)C2)c(F)c1 230260480 MZZABBQNFXIONQ-RULNRJAQSA-N 252.333 2.053 10 10 CECE COC1=C[C@H](C(F)(F)F)NN1c1ccc(N)cc1 95764119 SYVZJOKKPQGQEH-SECBINFHSA-N 259.231 2.012 10 10 CECE Cc1ccc(C(=O)NCC(=O)Nc2ccc(N)cc2)s1 700346336 DXSAIFZOULRZEE-UHFFFAOYSA-N 289.360 2.007 10 10 CECE C[C@H](NCC[C@H](C)[S@](C)=O)c1cc(F)ccc1O 252811512 OPWIJMGPPRFUTA-RAALSFIWSA-N 273.373 2.339 10 10 CECE C[C@@H](O)CCCNC(=O)/C=C\c1ccc(N(C)C)cc1 383306859 DZQGGVQXIVEMJO-BIRHUZIMSA-N 276.380 2.043 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H](N)C3=CCC=CC3)ccc21 2163073310 HXCNQYHXQLETGO-DLBZAZTESA-N 270.376 2.316 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)[C@](C)(O)C(F)F 2163131642 SSLJYDPVXNBNTM-HIFRSBDPSA-N 284.350 2.346 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2CC)C1(O)CSC1 2163139170 VSGPHPDDNHWBDV-OAHLLOKOSA-N 292.448 2.198 10 10 CECE CO[C@@H]1C[C@@H]1[C@@H](NN)c1ccc(N2CCCCC2)cc1 2163153975 MTSIBYWXZHNCCL-XHSDSOJGSA-N 275.396 2.216 10 10 CECE C[C@@H]1C[C@](O)([C@H](N)c2ccc3c(c2)CCCN3C)CS1 2163241826 DCLFOCYMGDJYNN-HFBAOOFYSA-N 292.448 2.325 10 10 CECE CC(C)c1nc([C@H](NN)c2ccc(N(C)C)cc2)ns1 2163482342 ISJFWUPDHIOKTO-GFCCVEGCSA-N 291.424 2.280 10 10 CECE COc1cncc(C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)c1 2167212583 JVEYTOUZZDBCAH-SNVBAGLBSA-N 275.312 2.253 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCCC[C@@H]1CO 2165030563 HKUPSTLUNLHVBH-ZWNOBZJWSA-N 278.352 2.018 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H](O)C2CCCC2)cc1O 2167596810 ZCPAEBRMEWKZKE-BDJLRTHQSA-N 278.396 2.399 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H](OC)C[C@@H](OC)C2)cc1 2165507377 ONTMMXRURQXIHV-XHSDSOJGSA-N 278.396 2.337 10 10 CECE CN(C)c1ccc([C@@H](N)CN[C@H]2CCCc3n[nH]cc32)cc1 817941813 LBBIIRQQCUUQCN-HOTGVXAUSA-N 299.422 2.143 10 10 CECE CC[C@H](N)c1ccc(N(C)Cc2ccn(C)n2)cc1 723521905 RRQPZRMISNSBHS-HNNXBMFYSA-N 258.369 2.466 10 10 CECE COc1ccc(O)c([C@H](C)NCc2cnn3c2CCC3)c1 825934103 HCHWRHRYLOCULX-NSHDSACASA-N 287.363 2.394 10 10 CECE Oc1ccc(CN[C@@H]2CC[C@H]3COCC[C@H]3C2)c(O)c1 723647768 RBXDLSJOCRDBIJ-FPMFFAJLSA-N 277.364 2.393 10 10 CECE CNCc1ccc(N2C3CCC2(CO)CC3)cc1C 722975176 DNVRKCKBKSHXJO-UHFFFAOYSA-N 260.381 2.208 10 10 CECE C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cc(O)cs1 732289523 HXPQTVPIMIRIQX-QWRGUYRKSA-N 282.409 2.446 10 10 CECE CCCC[C@](C)(CO)NCc1cccc(OC)c1O 842746126 JRYYLBUOJGGBBI-OAHLLOKOSA-N 267.369 2.432 10 10 CECE COCC[C@H](COC)N[C@H](C)c1cccc(OC)c1O 846172926 PPESYYTYJYQJFA-VXGBXAGGSA-N 283.368 2.103 10 10 CECE NC[C@H](NCc1c(O)cccc1Cl)C(F)(F)F 848715650 IAVZZTVSXNKFLH-VIFPVBQESA-N 268.666 2.025 10 10 CECE CCOc1ccc(O)c(CN[C@H](CN)CC(C)C)c1 841038211 HFJCLLFBUVCORV-ZDUSSCGKSA-N 266.385 2.254 10 10 CECE COc1ccc(N2CC[C@H](Nc3cnc(F)cn3)C2)cc1 853759953 FNTCVPZPESUTPA-NSHDSACASA-N 288.326 2.315 10 10 CECE CN(C)c1cc(F)c(CN[C@H]2C[C@@](C)(O)C2)cc1F 858178844 BGAKYUOQOHDRIX-WJONMLJTSA-N 270.323 2.034 10 10 CECE COC(C)(C)[C@H](C)NC(=O)N1Cc2cccc(O)c2C1 925524844 APYCLOUVYZIRBC-JTQLQIEISA-N 278.352 2.231 10 10 CECE CN(C)c1cc(F)c(CN2CCO[C@H]3C[C@@H]32)cc1F 862373869 HITMYGQDPPGYEH-KBPBESRZSA-N 268.307 2.004 10 10 CECE Nc1ccc(CCNC(=O)Cc2cccs2)cc1 32111354 ZIECTHVGZBTHRS-UHFFFAOYSA-N 260.362 2.232 10 10 CECE NCC1(NC(=O)Nc2ccc(N)cc2)CCCCC1 1876164699 XJCXXYIRKSNLRV-UHFFFAOYSA-N 262.357 2.052 10 10 CECE CN(Cc1ccccc1O)[C@@H]1CC[C@H]2CCN[C@H]1C2 1877532471 GKNCPVRCWRJAII-AEGPPILISA-N 260.381 2.355 10 10 CECE CCN(CC)c1ccc(CN2C[C@@H]3C[C@]3(CO)C2)cc1 783732459 CKTBYSCTQWMTGP-DOTOQJQBSA-N 274.408 2.347 10 10 CECE C[C@H](CCC(=O)NCCN=[N+]=[N-])NC(=O)OC(C)(C)C 1882284726 IWFRZYMDFPLREU-SECBINFHSA-N 285.348 2.106 10 10 CECE C[C@H](C(=O)NCc1ccc2cccnc2c1O)n1cccn1 1142728588 XIHPAVACNRYMAZ-LLVKDONJSA-N 296.330 2.014 10 10 CECE C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1N)c1ccccc1O 1336741625 GVHDSKBINSCSCE-UHTWSYAYSA-N 262.353 2.087 10 10 CECE CN(Cc1ccccc1)C(=O)CN1CCC[C@@H]1CN=[N+]=[N-] 1885286606 LPCNGIYAQQFFAS-CQSZACIVSA-N 287.367 2.420 10 10 CECE COc1nn(C)cc1CNCc1cccc(Cl)c1O 898029028 CWTQRJFOTYMJET-UHFFFAOYSA-N 281.743 2.078 10 10 CECE COc1cc(CC(=O)NCCCCN=[N+]=[N-])ccc1O 1963732922 TXSHZKMNJFHAFN-UHFFFAOYSA-N 278.312 2.150 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@H]1CCc2cccc(O)c21 1162279118 QTPLPJOFAAISML-ZDUSSCGKSA-N 299.326 2.150 10 10 CECE CCCOc1ccc(O)c([C@]2(C)COCCN2)c1 83385051 BUZPNMSAWJCJRC-AWEZNQCLSA-N 251.326 2.016 10 10 CECE CCCCCNC(=O)[C@@H](N)c1ccc(C)cc1O 83383173 MCHQYGVUOOLMPA-ZDUSSCGKSA-N 250.342 2.007 10 10 CECE Cc1cccc(O)c1NCc1ccc(O)c(O)c1O 83443997 TVUMBEGVOYDGLN-UHFFFAOYSA-N 261.277 2.430 10 10 CECE CCC(CC)CNC(=O)[C@H](N)c1cccc(C)c1O 83479285 PBBYOFOWYLRXAW-CYBMUJFWSA-N 264.369 2.253 10 10 CECE C[C@@H](NC(=O)c1cccc2nc(O)[nH]c12)c1ccccc1O 1171722918 GJFOQEOKMGCEJT-SECBINFHSA-N 297.314 2.465 10 10 CECE CN1CCc2cc(CNC[C@@]3(C)CCOC3)ccc21 397295578 YVMRQFJXCPXSRJ-MRXNPFEDSA-N 260.381 2.195 10 10 CECE Nc1ccc(CNC(=O)CC(=O)c2ccccc2)cc1 169819882 LBJOETGAHLWHFA-UHFFFAOYSA-N 268.316 2.158 10 10 CECE CCCCN(CCO)c1ccc(CNC)cc1F 42493978 LKPRFTCOKPZWPM-UHFFFAOYSA-N 254.349 2.144 10 10 CECE CCNCc1ccc(OC)c(CO[C@@H]2COC[C@@H]2C)c1 703576561 SGGKRUYVAPZNDI-BLLLJJGKSA-N 279.380 2.356 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CCCSCC1 692447608 GBQOYGMTQCNYOS-LBPRGKRZSA-N 286.401 2.495 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCC34CCCC4)cc21 687866267 NEYDNSJQNJXLOW-CQSZACIVSA-N 272.348 2.219 10 10 CECE C[C@H]1COC[C@@H]1N(C)c1ccc(CN)cc1Br 688225455 CHSJPVNLNSWXSF-ZANVPECISA-N 299.212 2.379 10 10 CECE 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Oc1cc(Cl)ccc1CN[C@@H]1CC12CC(O)C2 1621540580 QSAJZXSNYUBCEQ-YXMLORGKSA-N 253.729 2.049 10 10 CECE C[C@H]1C[C@@H](C(=O)N2CCC(N=[N+]=[N-])CC2)C[C@@H](C)O1 1912171420 KEKHZDZOVAPBHX-URLYPYJESA-N 266.345 2.491 10 10 CECE [N-]=[N+]=NCC1CCN(CC(=O)Nc2nccs2)CC1 1912176460 ZKSYDYZRABEAGS-UHFFFAOYSA-N 280.357 2.104 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2ccc(Cl)cn2)C1 1912191161 NYYAKKKTROFCQQ-MRVPVSSYSA-N 251.677 2.260 10 10 CECE COc1ccc(CN2CCCC[C@@H](CN=[N+]=[N-])C2)nn1 1912178757 OXPCHGMMQWJMKI-NSHDSACASA-N 276.344 2.398 10 10 CECE Cc1ccc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)nc1C 1912150310 RKJQNQICBXRMTA-NSHDSACASA-N 259.313 2.471 10 10 CECE COC(=O)C1(NCCCN=[N+]=[N-])CC2(CCC2)C1 1912174863 FLQZTTGRWHWLAR-UHFFFAOYSA-N 252.318 2.152 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)CC[C@@H]2CCCCO2)C1 1912182393 AZAIGVYABOZUAT-QWRGUYRKSA-N 252.318 2.247 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 1912208780 VVXMBRPNJJKJKF-JTQLQIEISA-N 275.268 2.049 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CC(F)F)c(Cl)cc21 136849045 ROHWQNXXBQWPRF-NSHDSACASA-N 289.713 2.254 10 10 CECE Cc1ccc([C@@H](C)NCCC(=O)N2CCCC2)c(O)c1 20127398 JICBKYYDMHCQEQ-CYBMUJFWSA-N 276.380 2.364 10 10 CECE c1cc2c(cc1CNCC13CCC(CC1)O3)CCO2 1965981446 BVFSOOXBWLZXKU-UHFFFAOYSA-N 259.349 2.423 10 10 CECE CNCc1ccc(N2CCC[C@@H]3[C@@H]2CCN3C)cc1 2127350068 MDNKPVOIVUAZFO-CVEARBPZSA-N 259.397 2.079 10 10 CECE Cc1cccc(CN2CCC[C@@H]3[C@@H]2CCN3C)c1O 2127342151 JWSKHIHISIVZQZ-CABCVRRESA-N 260.381 2.369 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCCN2CCC(=O)NC 162270503 WADLGYCHFZUAGZ-CYBMUJFWSA-N 289.423 2.246 10 10 CECE CCN[C@H](C)c1ccc2c(c1)CCCN2CC(=O)N(C)C 162263044 DBLUVXFFJFWIDE-CYBMUJFWSA-N 289.423 2.198 10 10 CECE CCNCc1ccc(N(C)CCN(C)C)c(Cl)c1 164033477 AHEXLAIQOGOMNB-UHFFFAOYSA-N 269.820 2.447 10 10 CECE CN[C@@H]1CCc2cc(N3[C@H]4CC[C@H]3COC4)ccc21 2128293093 CFGGIYIYKWFIBQ-OFQRWUPVSA-N 258.365 2.261 10 10 CECE CO[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3N)C[C@H]1F 2128271645 OVDAIGUJFHWUTP-RBSFLKMASA-N 264.344 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272.304 2.416 10 10 CECE CN(CCc1ccccc1)C(=O)c1cccc(O)c1O 126456276 GSIKZEADINRFSS-UHFFFAOYSA-N 271.316 2.413 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)c(Cl)c2)C[C@@H]1OC 234860548 IRCBHXAYJYRCCX-HERUPUMHSA-N 284.787 2.210 10 10 CECE CCn1cccc1CN(C)C(=O)c1cccc(O)c1O 1969852606 CGBBJVBWVBNPKU-UHFFFAOYSA-N 274.320 2.191 10 10 CECE Cc1ccc(NS(=O)(=O)Cc2ccc(N)cc2)cc1O 235899818 XZPBJUUYKNSJLY-UHFFFAOYSA-N 292.360 2.225 10 10 CECE Nc1ccc2c(ccn2Cc2ccn3ncnc3c2)c1 2148732819 JWSXZSQPUMGBRJ-UHFFFAOYSA-N 263.304 2.315 10 10 CECE Cc1cccc(CN=c2cc(Br)n(C)[nH]2)c1O 1949988842 APHSMJQMOYSJHM-UHFFFAOYSA-N 296.168 2.231 10 10 CECE CCN(CC)c1ccc([C@@H](O)C(C)=O)c(OC)c1 1951699674 RNXPVJGEAZMIEQ-AWEZNQCLSA-N 251.326 2.164 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@H](N)C[C@@H]2C)c1 131497759 CZPGBEVLFZALRU-SRVKXCTJSA-N 264.369 2.273 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@H]2CC[C@@]1(F)C2 2146837702 PGKKYONTCVQEOA-ZETOZRRWSA-N 277.343 2.377 10 10 CECE C[C@H]1CN(C(=O)OC(C)(C)C)CCN1CCN=[N+]=[N-] 1953751737 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Cc1cccc(O)c1CN1CC[C@@H]2CC[C@@]21C(=O)O 2136406007 KGOPTDBQEVOZDP-NHYWBVRUSA-N 261.321 2.140 10 10 CECE CC1(C)CC[C@H](CO)N1C(=O)Nc1ccc(N)cc1 2140839806 BYGQZRKQOUYCMN-GFCCVEGCSA-N 263.341 2.036 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCCC[C@@]1(C)C(=O)O 228034061 JBFBQVOCWZPIJE-BONVTDFDSA-N 279.336 2.488 10 10 CECE C[C@H](NC[C@@H]1CCC[C@H]1N(C)C)c1cc(O)ccc1O 1924673376 ZEQYMWYQSVULSE-SLEUVZQESA-N 278.396 2.479 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2CCN(C)C[C@@H]2C)c1 228611534 IAODJJAUHOWIAI-SLEUVZQESA-N 278.396 2.392 10 10 CECE COc1cc(Cl)cc(CNCc2cnc(C)cn2)c1O 229051828 GURNQPZJPTZTLK-UHFFFAOYSA-N 293.754 2.442 10 10 CECE COc1cc(N(C)C[C@@]2(C)CCCO2)ccc1CN 2139701571 VULMKBMVIGKGKD-OAHLLOKOSA-N 264.369 2.159 10 10 CECE Cc1ccc(CN2CCN(C[C@@H](C)F)CC2)c(O)c1 2139790245 LCBQWNYUPNTZQQ-CYBMUJFWSA-N 266.360 2.176 10 10 CECE Cc1cccc(CNC(=O)C[C@H]2CC[C@@H](C)O2)c1O 2139764755 SFPNEHKBMXDUMI-DGCLKSJQSA-N 263.337 2.274 10 10 CECE CN(OCc1ccccc1)C(=O)c1ccc(O)c(O)c1 1928707133 RXRBEFRBBADXTG-UHFFFAOYSA-N 273.288 2.302 10 10 CECE CCN(Cc1cc(OC)ccc1O)C[C@H]1CCCCN1 233485695 ANORZLTVVGDIOR-CQSZACIVSA-N 278.396 2.365 10 10 CECE OC[C@H](CNCc1ccc(Cl)cc1O)C1CC1 1942491366 JPMCBZSCNHENBC-NSHDSACASA-N 255.745 2.154 10 10 CECE C[C@H]1CN([C@H](C)c2c(O)cccc2O)C[C@H](C)N1C 235685154 VBXSQIXXQMTUEH-SDDRHHMPSA-N 264.369 2.183 10 10 CECE Cc1cc(NS(=O)(=O)c2cccnc2)c(C)cc1O 235898567 IAVFGJTVVUWXLD-UHFFFAOYSA-N 278.333 2.205 10 10 CECE CCCOc1cc(N2C[C@@H](O)[C@H](C3CC3)C2)ccc1N 2146826486 LJCDBCMTXDLVDJ-DZGCQCFKSA-N 276.380 2.265 10 10 CECE C[C@H]1CCS[C@@H]1CNCc1cccc(O)c1O 1945617916 VGNAFPDRGLUCDI-JOYOIKCWSA-N 253.367 2.329 10 10 CECE COC[C@@H]1CN([C@@H](C)c2ccccc2O)C[C@@H]1COC 2149238708 PEGCUDMSNPHWGA-MELADBBJSA-N 279.380 2.294 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cscn2)CC1 1949749531 QPBWMYSBCGTIRA-QMMMGPOBSA-N 251.315 2.448 10 10 CECE Nc1ccc(OCC(=O)NCCCCC(F)(F)F)cc1 130223065 AVSQTRLNPOPDMC-UHFFFAOYSA-N 290.285 2.496 10 10 CECE O=[N+]([O-])c1ccc(O)c([C@H]2CC(F)(F)CCN2)c1 1952308103 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COc1ccc(O)c(CN2CC[C@@H](CCN)C[C@@H]2C)c1 2148104689 AIILNCSNZJHACB-QWHCGFSZSA-N 278.396 2.350 10 10 CECE CCOc1cccc(CN2CC[C@@H]3COCC[C@H]32)c1O 2144958448 XFRRPFPUWUQQTO-ZIAGYGMSSA-N 277.364 2.402 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)Cc1ccccc1 35360104 UCWGDVLOTVDTHI-UHFFFAOYSA-N 254.333 2.470 10 10 CECE CC[C@@H]1C[C@@H]1C[C@H](N)[C@@H](O)c1ccc2c(c1)CCN2C 2148330986 MXCNCIFSZQYKSA-LCSDZXHASA-N 274.408 2.476 10 10 CECE CNCc1ccc(N2CC=CC[C@]23CCOC3)c(F)c1 2150024215 LJTJKVSMKJPIIS-MRXNPFEDSA-N 276.355 2.471 10 10 CECE COc1cccc([C@H](O)COc2ccc(N)cc2)c1 162236665 QPAOMJVVNKGZTI-OAHLLOKOSA-N 259.305 2.390 10 10 CECE CCCOc1cc(N2CCC[C@](C)(O)C2)ccc1N 162977660 SOUIJITVKOMYRC-HNNXBMFYSA-N 264.369 2.409 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CCCOC12CCC2 2158562576 XFINBYJMNXXBAV-GFCCVEGCSA-N 276.336 2.481 10 10 CECE N[C@@H](CC1OCCO1)c1ccc(N2CCCCC2)cc1 1999522910 GHMOCKYOEHGJPJ-HNNXBMFYSA-N 276.380 2.440 10 10 CECE COC[C@]1(OC)CCCN(Cc2cc(F)ccc2O)C1 2151849681 TVJAWVCGKFCBFO-HNNXBMFYSA-N 283.343 2.159 10 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273.329 2.272 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H](OC)C2)cc1O 300093031 IOFJWLXOQQNFBM-YPMHNXCESA-N 264.369 2.288 10 10 CECE C[C@H]1CCO[C@H]1CN(C)Cc1cc(F)ccc1O 2034983963 IFTIRLVTVPBAGA-HZMBPMFUSA-N 253.317 2.388 10 10 CECE CC[C@@H]1C[C@H](C(=O)O)N([C@@H](C)c2cc(O)ccc2O)C1 2159273092 BCIMXJGMSXQLCW-OPQQBVKSSA-N 279.336 2.344 10 10 CECE COc1ccc([C@H](C)N[C@H]2CO[C@H](C)C2)c(O)c1 402259703 BQQGFOFSPXRNFX-OUAUKWLOSA-N 251.326 2.229 10 10 CECE C[C@@H]1OC[C@@H](NCc2ccc3c(c2)CCN3C)[C@@H]1C 405592851 BGSLWYFTJPEUBR-TYNCELHUSA-N 260.381 2.192 10 10 CECE C[C@H](CCN[C@H]1CCc2cccc(O)c21)[S@@](C)=O 311044810 HDAOXAYXFHDZQA-GDAOTKPNSA-N 267.394 2.126 10 10 CECE CN1CCCc2cc([C@@H](CN)N3CC(C)(C)C3)ccc21 313269436 AQUBHAWQRCTXIL-MRXNPFEDSA-N 273.424 2.411 10 10 CECE CCCN1CC[C@H](N(C)c2ccc([C@@H](C)O)c(O)c2)C1 2160020653 IDFNSUIPRRKOGY-OCCSQVGLSA-N 278.396 2.366 10 10 CECE COc1cccc(O)c1CNc1cccnc1N(C)C 2160715484 XRPOAVPHOLTRRK-UHFFFAOYSA-N 273.336 2.474 10 10 CECE CCN[C@@H](C)c1ccc(N(C)Cc2cn(C)nn2)cc1 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CN(C)c1ccc([C@H](CN)N(C)[C@@H]2CCSC2)cc1 37174537 VSVODASTKJWMKO-CABCVRRESA-N 279.453 2.190 10 10 CECE COc1cc(N)c(N2CCOCC(C)(C)C2)cc1OC 2146249902 PXMNUWCOUIJLCF-UHFFFAOYSA-N 280.368 2.149 10 10 CECE COC[C@]1(OC)CCN(c2ccc([C@@H](C)N)cc2F)C1 2151858296 ZWLWQQGXAQIBIN-ABAIWWIYSA-N 282.359 2.087 10 10 CECE CC[C@@H]1CCOC[C@@H]1NC(=O)CCc1ccc(N)cc1 2152568295 CNZFBWSAQMZECO-HIFRSBDPSA-N 276.380 2.133 10 10 CECE C[C@@H](CNCc1cccc(O)c1O)CN1CCCCC1 41117878 MTYAQQFYVNILFZ-ZDUSSCGKSA-N 278.396 2.309 10 10 CECE Nc1ccc(CC(=O)OC[C@@]23CCC[C@@H]2CCO3)cc1 2152941615 HUYRTLLJWAAACG-CJNGLKHVSA-N 275.348 2.314 10 10 CECE Nc1ccc(CCN2CCO[C@@H]3CCCC[C@@H]32)cc1 43424016 YGSCQTUWQVPUQL-JKSUJKDBSA-N 260.381 2.455 10 10 CECE C[C@@H](N)c1ccc(N2CC=C[C@@H]2CO)c(Br)c1 2007501329 RFWATMRONLUPOG-MWLCHTKSSA-N 297.196 2.206 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC(SC(C)C)C3)ccc21 2153906650 JCSBQZIOPGVACP-AWEZNQCLSA-N 291.420 2.229 10 10 CECE CC[C@@H]1COCCN(Cc2cc(C(C)=O)ccc2O)C1 2154322441 LFGPZIBWTBJULB-ZDUSSCGKSA-N 277.364 2.453 10 10 CECE Nc1ccc(CCOc2cc(Br)cnn2)cc1 2012646186 RRQVOEILDVQXHW-UHFFFAOYSA-N 294.152 2.443 10 10 CECE Nc1ccc(COc2nc(Cl)ncc2F)cc1 2012664712 DKOUVTCCEBRLQS-UHFFFAOYSA-N 253.664 2.430 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(Cc2nnc(C3CC3)s2)C1 2013589155 PEDUPCMOJLRDEM-MRVPVSSYSA-N 250.331 2.300 10 10 CECE [N-]=[N+]=NCCCCN1CC[C@@H](c2nncs2)C1 2019796426 OWJJZQLFKFLMRX-SECBINFHSA-N 252.347 2.418 10 10 CECE COC[C@H](CNCc1ccc(O)cc1O)C(C)C 2027335501 GCXJZWJUBXLCDK-LBPRGKRZSA-N 253.342 2.106 10 10 CECE CC(C)(C)[C@@H]1CN[C@H](c2ccc(O)c(O)c2)OC1 2029718516 XOPSGEVVRYDQBK-MFKMUULPSA-N 251.326 2.379 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1nc(C)cs1 2031163842 ZEKKWIDVZJDBKN-RYUDHWBXSA-N 264.350 2.151 10 10 CECE C[C@H]1COCC[C@@H]1N(C)c1ccc(CN)cc1F 2031921835 IYEMODSJOCEXMN-GWCFXTLKSA-N 252.333 2.146 10 10 CECE C[C@@H]1CCS[C@@H]1CNC(=O)Cc1ccc(N)cc1 2033420809 IFJOIFPNPKEOTD-ZWNOBZJWSA-N 264.394 2.069 10 10 CECE O=Cc1cnc(Sc2nnc3n2CCCCC3)s1 2037805535 JXSCOPZIJSDGLT-UHFFFAOYSA-N 280.378 2.425 10 10 CECE CCOc1cccc(CN[C@@H]2CC[C@@H](C)OC2)c1O 402035618 JWUIGIYESWYGLH-DGCLKSJQSA-N 265.353 2.448 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)c2ccccc2F)C1 403683799 VUNRGWMHLSLGCI-VIFPVBQESA-N 284.316 2.289 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@](C)(OC)C2)cc1O 311559049 KJCZVURAMJMKBQ-IAQYHMDHSA-N 264.369 2.288 10 10 CECE CN1CC[C@@H](CN(C)[C@@H]2CCc3cccc(O)c32)C1 311812697 CTEKTYLGJDIKNY-TZMCWYRMSA-N 260.381 2.263 10 10 CECE CC(F)(F)[C@@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 2160120054 DNEYDFQDXJRZLE-PRHODGIISA-N 281.306 2.120 10 10 CECE C[C@H]1CNC(=O)c2sc(Cc3ccc(N)cc3)nc2C1 2160170726 DTNIMHKLCGJSNA-SECBINFHSA-N 287.388 2.238 10 10 CECE COc1cccc(O)c1CNCc1cnc(N(C)C)s1 2160722262 FHBZORKUKFGXCK-UHFFFAOYSA-N 293.392 2.213 10 10 CECE Cc1ccc([C@H](C)N(C)[C@@H]2CCCCNC2=O)c(O)c1 2171241432 KYOGGTIGUFVSOS-GXTWGEPZSA-N 276.380 2.362 10 10 CECE CCN1CCN(c2ccc([C@H](C)NC)c(O)c2)[C@H](C)C1 2161513460 JRFRIGLWZPVLNE-OLZOCXBDSA-N 277.412 2.203 10 10 CECE Cc1cc(N2CCN([C@@H]3CCSC3)CC2)ccc1CN 2171547123 NKEKJXGQKQWGOI-MRXNPFEDSA-N 291.464 2.081 10 10 CECE C[C@H](N[C@H]1CCC[C@H](C(=O)O)C1)c1cc(O)ccc1O 86786566 DBIWLLYAWJXUOT-DCAQKATOSA-N 279.336 2.392 10 10 CECE CC(C)NCc1ccc(N2CC[S@@](=O)[C@@H](C)C2)c(F)c1 2171959553 KJUZATVDCOLSKK-FKIZINRSSA-N 298.427 2.281 10 10 CECE CO[C@H]1C[C@@H](N(C)c2ccc(CN)c(C)c2)C[C@H]1OC 2172563869 BGFYUGQNOQDYPH-MUJYYYPQSA-N 278.396 2.082 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)c1ccn(C)n1 2163094394 LADAHETWJZZJGJ-INIZCTEOSA-N 270.380 2.111 10 10 CECE Cc1cnc(CNCc2cc(F)cc(F)c2O)cn1 708486245 PMFOZWOCRIPQCA-UHFFFAOYSA-N 265.263 2.059 10 10 CECE Cc1nscc1[C@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2163122752 DNEWNUCONDMFLL-GJZGRUSLSA-N 289.404 2.177 10 10 CECE Nc1ccc(CCC(=O)NC[C@@H]2CCC=CO2)cc1 379913997 NSTYGBGPIWKBFW-AWEZNQCLSA-N 260.337 2.010 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@@](C)(CO)C1 381331056 BLCWENQWLZKJML-QGZVFWFLSA-N 274.408 2.456 10 10 CECE CCCC1(O)CN(c2ccc([C@H](C)NC)c(O)c2)C1 383966927 HEWHKPRUHCAGGF-NSHDSACASA-N 264.369 2.024 10 10 CECE CCCC1(O)CN(c2ccc(CNC)cc2Cl)C1 384191565 ZNKXMRGCYUMOGD-UHFFFAOYSA-N 268.788 2.411 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@H](C3CC3)C2)cc1O 695333523 QVNLAGDGOHATPL-BONVTDFDSA-N 263.337 2.061 10 10 CECE CN=c1[nH]nc(SCCCc2ccc(N)cc2)s1 385213811 ARZZMPSKIVWUFO-UHFFFAOYSA-N 280.422 2.309 10 10 CECE C[C@H](N[C@@H]1CN(C)C[C@H]1C)c1ccc(F)cc1O 722288686 GXXSLAVVIIZILQ-GBIKHYSHSA-N 252.333 2.132 10 10 CECE CC[C@@H](CO)N(C)c1ccc([C@H](C)NC)cc1F 385982686 OHMJZFVPPWBPAH-JQWIXIFHSA-N 254.349 2.313 10 10 CECE C[C@@H](Nc1c(N)cccc1C(=O)O)[C@@H]1C[C@H]2CC[C@H]1O2 386955527 JMKJNBKJNJXEAB-MBJVOQIVSA-N 276.336 2.335 10 10 CECE CCCN(CCOc1ccc(N)cc1)[C@H]1CCOC1 388571880 GTQDRGWBPFMCJU-AWEZNQCLSA-N 264.369 2.149 10 10 CECE C[C@H](N[C@@H]1C[P@@](C)(=O)C[C@@H]1O)c1ccc(N(C)C)cc1 2177848185 NRSORBRFIDOCKZ-KRHOHVSHSA-N 296.351 2.139 10 10 CECE CO[C@@H]1CC[C@H]1N(C)c1ccc(CN)c(F)c1F 724138993 FAUDOKMSMAUWIH-MWLCHTKSSA-N 256.296 2.037 10 10 CECE CCC1(CC)CN(CC(=O)c2ccc(O)c(O)c2)C1 394048463 DZAIDQHKTYJZOK-UHFFFAOYSA-N 263.337 2.403 10 10 CECE C[C@H](CC(C)(C)O)N[C@H](C)c1cc(O)ccc1O 395052097 MMJIMIIOTVDWJY-NXEZZACHSA-N 253.342 2.298 10 10 CECE C[C@H](N[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)O)c1cc(F)ccc1O 2174236053 WKVYPWXFOGQDBE-MXHCUKRJSA-N 279.311 2.291 10 10 CECE CCCOc1cc(N(C)CC2[C@H]3COC[C@H]23)ccc1N 2174638289 GHMVFSLXKRETGC-ZIAGYGMSSA-N 276.380 2.386 10 10 CECE C[C@@H](CC1CNC1)[C@H](O)c1ccc2c(c1)CCCN2C 2178438357 UCZXMBKXLQNXSQ-SJCJKPOMSA-N 274.408 2.348 10 10 CECE CO[C@H]1C[C@H](CN(C)Cc2ccccc2O)C[C@H]1OC 2174906879 QRXHSHRKMVZBBB-DVSIDAKKSA-N 279.380 2.264 10 10 CECE Cc1cc(N2CCN(C)[C@@H]3C[C@@H]32)ccc1CNC(C)C 2168360795 NATWWNQCQDPTDO-SJORKVTESA-N 273.424 2.386 10 10 CECE O=C(NC1CC1)c1ccnn1Cc1c(O)cccc1Cl 2069952610 CJKAHHZMPHOFDJ-UHFFFAOYSA-N 291.738 2.183 10 10 CECE CCOc1cccc(CN(C)[C@@H]2CCCCNC2)c1O 2169147507 LGGORUCVGUFOAA-CQSZACIVSA-N 278.396 2.365 10 10 CECE Cc1ncc(N2Cc3ccccc3[C@@H](CN)C2)nc1C 2176225415 ZGZUBBCXAFKXGX-AWEZNQCLSA-N 268.364 2.156 10 10 CECE CS[C@@H]1CN(c2ccc([C@@H](C)O)cc2F)C[C@H]1N(C)C 2170712031 YXPYBLZPIZJHRS-VCTAVGKDSA-N 298.427 2.361 10 10 CECE Cc1nc2n(c1C)CCN(CCc1ccc(N)cc1)C2 2171166010 MUNIEZKXAKBTQW-UHFFFAOYSA-N 270.380 2.140 10 10 CECE CC(C)O[C@@]1(CN(C)Cc2ccccc2O)CCOC1 2188179788 SJOFFKAHESRPGG-MRXNPFEDSA-N 279.380 2.408 10 10 CECE CO[C@@H]1C[C@@H]1COc1ccc(N2CCC[C@H](N)C2)cc1 2188208312 PIZCWNWOIXFMSX-DVOMOZLQSA-N 276.380 2.028 10 10 CECE C[C@H]1SCCC[C@@H]1N(C)C(=O)COc1ccc(N)cc1 2197309578 QKVMUOLPGOJARI-RISCZKNCSA-N 294.420 2.390 10 10 CECE CN(C)C[C@H]1CC[C@H](NCc2cccc(O)c2O)CC1 2182828569 IPOUIEMWPGRSQR-MQMHXKEQSA-N 278.396 2.308 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@H]2C[C@]23CCCOC3)C1 2198140586 FWSTZWKCXLDTNI-SCRDCRAPSA-N 278.356 2.352 10 10 CECE CO[C@]1([C@@H](NN)c2ccc(N(C)C)cc2)CCCSC1 2194262059 DNFUWFDSGTVOQF-LSDHHAIUSA-N 295.452 2.169 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCC[C@H]3O)CC[S@@]1=O 2184681430 DJQFCMGQBNEYCH-QRWLVFNGSA-N 293.432 2.404 10 10 CECE CN[C@@H]1CCc2cc(N3CCC([C@@H](C)O)CC3)ccc21 2184726616 KXBSVKCBIVZNSN-SJKOYZFVSA-N 274.408 2.491 10 10 CECE Cc1cnn(C)c1CN(C)c1ccc2c(c1)CC[C@H]2N 2184741340 IJIICEBBNBGJNR-OAHLLOKOSA-N 270.380 2.311 10 10 CECE OC[C@@H]1C[C@@H]2CCC[C@H]2N1c1ccc2c(c1)CC[C@@H]2O 2184734731 XGHTYZJNEVAXRM-SDNTUTLCSA-N 273.376 2.406 10 10 CECE CN(C)c1ccc(-c2nc([C@@H](N)CC(=O)O)cs2)cc1 2185246975 BHERHCLEYMARQO-NSHDSACASA-N 291.376 2.351 10 10 CECE CN1CCc2cc([C@]3(O)CO[C@H](C(F)(F)F)C3)ccc21 2185561565 HEIDUPPLMMEBOB-QWHCGFSZSA-N 287.281 2.218 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@@]1(C)CC=CCC1 2047677814 BYCIMBOGTXPEIZ-JQWIXIFHSA-N 252.318 2.174 10 10 CECE CCC1(C)CCC(NCCN=[N+]=[N-])(C(N)=O)CC1 2051624131 SWIDHIPUXBASLV-UHFFFAOYSA-N 253.350 2.101 10 10 CECE Cc1cc(N2CCNCC2)ccc1OC[C@@H]1C[C@@H]1CF 2191454285 ZRMUPIZQHJAUFH-KGLIPLIRSA-N 278.371 2.389 10 10 CECE N[C@H](c1cnn(C(F)(F)F)c1)c1ccccc1O 2054728272 VFVGGRISDZMMGD-SNVBAGLBSA-N 257.215 2.113 10 10 CECE CN[C@]1(C(=O)O)C[C@@H](C)C[C@@H](Sc2nccs2)C1 2055137697 KUVFZQGFJCJGQC-YGOYTEALSA-N 286.422 2.467 10 10 CECE Nc1ccc(CC(=O)N2C(=O)C[C@H]3CCCC[C@H]32)cc1 2191663306 HGQAIAOWOBAWPJ-TZMCWYRMSA-N 272.348 2.129 10 10 CECE C[C@@H](C[S@](C)=O)N(C)c1cc(Cl)c(CN)cc1F 2057247997 BKOPUSARBMAXGY-ASCAZGACSA-N 292.807 2.141 10 10 CECE C[C@@H](F)CS(=O)(=O)N(C)[C@H](C)c1ccccc1O 2057400490 WLLKXHSCLQWCOH-NXEZZACHSA-N 275.345 2.073 10 10 CECE C[C@H]1OCC[C@H]1CN(C)Cc1c(O)cccc1F 2057474329 GLBIWCIIMYBIJF-MNOVXSKESA-N 253.317 2.388 10 10 CECE C[C@H](C(F)F)N(C)c1ccc(CO)cc1[N+](=O)[O-] 2058421281 QIGFHLVFWIKJQN-SSDOTTSWSA-N 260.240 2.177 10 10 CECE CN1CCc2cc(N3CCN[C@H](C(F)(F)F)C3)ccc21 2186680604 CZKZDVPYYBYJMO-ZDUSSCGKSA-N 285.313 2.019 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C[C@@H](C)C(=O)O)C1CC1 2187730418 AWWIXAHZVMCLFA-ZJUUUORDSA-N 279.336 2.344 10 10 CECE CCN1CCc2cc([C@H](O)C34CC(CCN3)C4)ccc21 2192518892 IPZDJPDXSBEJCF-PDOTXMHQSA-N 272.392 2.245 10 10 CECE Nc1ccc(NC(=O)NOCC2(F)CCC2)cc1 2071565438 NELILBGUTWYXID-UHFFFAOYSA-N 253.277 2.214 10 10 CECE CCCN(CC1COCCOC1)c1ccc(CN)cc1 2187979842 MMUUPCURTSWQBZ-UHFFFAOYSA-N 278.396 2.025 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@H](CC(=O)O)C(F)F 2100593545 NSEMIPJSOUFYOW-SCZZXKLOSA-N 273.279 2.493 10 10 CECE CCN1CCC[C@H](N(C)CCc2ccc(N)cc2)C1 2102509523 KGESUAMPPDGWSP-INIZCTEOSA-N 261.413 2.227 10 10 CECE CN1CCCc2cc(CNC3CC(C)(O)C3)ccc21 2102590063 HVSDRRPJTGKSAE-UHFFFAOYSA-N 260.381 2.072 10 10 CECE Cc1ccc([C@@H](C)N(C)[C@H]2CN3CC[C@H]2C3)c(O)c1 2102501682 HUHPWSONKFCKGW-IPYPFGDCSA-N 260.381 2.398 10 10 CECE CCN(Cc1ccc(F)cc1O)C[C@H]1CCCN1 2084080894 WKIWPJZZAYDTMB-CYBMUJFWSA-N 252.333 2.105 10 10 CECE NC(=O)[C@@H](Nc1ccccc1)c1c(O)cccc1F 2104474626 UHPNHVBLWXNFOV-ZDUSSCGKSA-N 260.268 2.170 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CC(C)(C)C1(C)C 2084343680 LNCIYXYHAOESPW-LBPRGKRZSA-N 254.334 2.254 10 10 CECE CN1CCc2cc([C@H]3N[C@](C)(C(F)F)CO3)ccc21 2105086180 LIMSCJQCJMIYDC-JSGCOSHPSA-N 268.307 2.321 10 10 CECE COc1cc(Cl)cc(CN[C@H]2CC(C)(C)[C@H]2O)c1O 2105095917 JYFCZFZUASTNCY-GWCFXTLKSA-N 285.771 2.303 10 10 CECE Cc1ncoc1CN(C)c1c(F)cc(CO)cc1F 2105611566 VANMRAGKLGKRKU-UHFFFAOYSA-N 268.263 2.390 10 10 CECE COc1ccc(N2C[C@H](CN)C3(CCC3)C2)cc1F 2106391455 AOPRGDGJIYUPMR-NSHDSACASA-N 264.344 2.400 10 10 CECE CCN(CC)c1ccc([C@@H](O)c2cnccn2)cc1 2106830911 LIFBFAQASHBXGM-OAHLLOKOSA-N 257.337 2.405 10 10 CECE CCN1CCc2cc([C@@]3(O)CCCC[C@H]3N)ccc21 2106804840 GPUVRTOUEKZTDB-CVEARBPZSA-N 260.381 2.158 10 10 CECE [N-]=[N+]=NCCCCN1CCC[C@@]2(CCCNC2=O)C1 2106975476 TZWFXDIOXAXWMW-ZDUSSCGKSA-N 265.361 2.069 10 10 CECE C[C@@H](NCc1cc(=O)cc[nH]1)c1ccc(F)cc1O 2088349850 XHOCPCMGHSQGDB-SECBINFHSA-N 262.284 2.070 10 10 CECE O=C(C[S@](=O)c1ccccc1)c1ccc(O)c(O)c1 2089660280 IYZRSMKTDQMSFI-IBGZPJMESA-N 276.313 2.088 10 10 CECE Cc1cc(N(C)C[C@@H]2CC3(CC3)CO2)ccc1CO 2110082846 QLXVCWCNZZXHJD-HNNXBMFYSA-N 261.365 2.493 10 10 CECE COC1(C(=O)N(Cc2ccc(N)cc2)C(C)C)CC1 2110256541 WOWVPUPANKSCQB-UHFFFAOYSA-N 262.353 2.185 10 10 CECE C[C@H]1CC[C@H](CO)CN1CCCc1ccc(N)cc1 2090607892 UATBNRSZKBGCAB-ZFWWWQNUSA-N 262.397 2.294 10 10 CECE CC[C@@H](NC)c1ccc(N(CC)C2CN(C)C2)cc1 2090753668 NSDFWWMQVYZPBR-MRXNPFEDSA-N 261.413 2.497 10 10 CECE CCCN[C@H](c1ccccc1O)[C@H](O)C(C)(C)OC 2091868094 PMLKONWTEUCNPW-KGLIPLIRSA-N 267.369 2.219 10 10 CECE C[C@H](O)c1ccc(N2CCOC(C)(C)CC2)cc1O 2092415466 QVPUCKDMFHDPNV-NSHDSACASA-N 265.353 2.451 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)c(O)c2)CC12CC2 2093330858 SRXGIQNVRBGYMU-HZMBPMFUSA-N 262.353 2.027 10 10 CECE CCCN(c1ccc(N)cc1)S(=O)(=O)C1[C@@H](C)[C@@H]1C 2094580102 GGRSMPLOFUAJGY-QWRGUYRKSA-N 282.409 2.469 10 10 CECE CCc1nocc1CN[C@H](C)c1ccc(O)cc1O 2096344553 JHSCTUDYKNAFFS-SECBINFHSA-N 262.309 2.499 10 10 CECE Nc1ccc(OCC(=O)NC[C@@H]2C=CCCC2)cc1 2096766375 NMXPBZSQFDWDAL-GFCCVEGCSA-N 260.337 2.120 10 10 CECE COc1ccc(O)c([C@H](C)N2CCN[C@H](C)CC2)c1 2096967257 FOKBTNBYNOBZAH-NEPJUHHUSA-N 264.369 2.146 10 10 CECE Cc1cc(N2CC3(CC[C@H]2CO)CC3)ccc1CN 2097890196 JKBRJOUCNHNMHU-HNNXBMFYSA-N 260.381 2.195 10 10 CECE CN(C)[C@@H]1CN(Cc2ccc(N)cc2)C2(CCC2)C1 2099164545 ZSWFVEIPODUGTD-HNNXBMFYSA-N 259.397 2.327 10 10 CECE CC(=O)N[C@H]1CCN([C@@H](C)c2cc(Cl)ccc2O)C1 228357078 DEJILRBSVGFVOC-CABZTGNLSA-N 282.771 2.317 10 10 CECE N[C@@]12CCCC[C@@H]1CN(c1ccc3c(c1)CCO3)C2 2113314076 PIPYSIGAUSIHNW-CZUORRHYSA-N 258.365 2.329 10 10 CECE CCCN1CCCN(CCc2ccc(N)cc2)CC1 2113701301 ZEYUOVIEZZORDY-UHFFFAOYSA-N 261.413 2.229 10 10 CECE CC(C)c1nnc2n1CCN(CCCCN=[N+]=[N-])C2 2114235399 IQXPFAUYBCSEAY-UHFFFAOYSA-N 263.349 2.308 10 10 CECE Cc1cc(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])sn1 2213592635 MWTUVFSUVUFPOV-YUMQZZPRSA-N 251.315 2.413 10 10 CECE COc1cc(N(C)[C@@H]2C[C@@H]3CC[C@H](C2)O3)ccc1CO 2204558689 GGVHTDAKUJZZIZ-QDMKHBRRSA-N 277.364 2.334 10 10 CECE Cc1cccc(CNC(=O)[C@H](N)C2CC(C)(C)C2)c1O 2204627384 YAOLAIVVTVSWRM-CYBMUJFWSA-N 276.380 2.080 10 10 CECE C[C@H](N=c1[nH]nc([C@@H]2CCOC2)s1)c1ccccc1O 2204766682 SMMIDOLUKKVXSE-VHSXEESVSA-N 291.376 2.343 10 10 CECE COc1ccc(N2CC[C@@H]3CNC[C@@H]3C2)c(C)c1C 2269117599 ZJNURIQKZSAJOG-ZIAGYGMSSA-N 260.381 2.358 10 10 CECE 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2.099 10 10 CECE CC(C)(C)CCN(CCO)Cc1ccc(N)cc1 2261142055 HQULKWWAEOBZQG-UHFFFAOYSA-N 250.386 2.499 10 10 CECE CO[C@H](CSc1ncc([C@@H](C)N)s1)[C@H]1CCOC1 2261493779 SIPOXSQMMCFPSM-KXUCPTDWSA-N 288.438 2.306 10 10 CECE O[C@@H]1CC[C@@H]2CN(c3ccc(OC(F)F)cc3)C[C@@H]21 2278505325 LITNGXYSVQQGTL-JIMOISOXSA-N 269.291 2.495 10 10 CECE O=C(c1cccc2c1NCC2)c1cncn1C(F)F 2269494382 AGGZGAOIZRHKPA-UHFFFAOYSA-N 263.247 2.477 10 10 CECE CCN1CC(CN(C)c2ccc([C@H](C)O)c(C)c2)C1 2269680779 DWHSKNGNVRZFLA-ZDUSSCGKSA-N 262.397 2.436 10 10 CECE Cc1cc(N(C)Cc2ccncn2)ccc1[C@@H](C)O 2269696406 UAODHTLCIZFZKE-GFCCVEGCSA-N 257.337 2.475 10 10 CECE C[C@@H]1C[C@H]2CCC[C@@H]2N1S(=O)(=O)Cc1ccc(N)cc1 2280174456 USUACOWIQNVMSP-KYOSRNDESA-N 294.420 2.362 10 10 CECE COC[C@@]1(C)C=CCN1CCCOc1ccc(N)cc1 2284694804 VDUMIIJNFYTJOY-MRXNPFEDSA-N 276.380 2.315 10 10 CECE O=C(O)[C@@H]1C[C@H]2CCC[C@H]1N2Cc1c(O)cccc1F 2295116599 YPSOJQUHCDOBGD-GIPNMCIBSA-N 279.311 2.359 10 10 CECE CS[C@H]1C[C@H](COC[C@H](O)COc2ccc(N)cc2)C1 2287658409 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C[C@]1(CNCc2cc(F)cc(F)c2O)CC=CCO1 2340186703 MDLQJPXZUPNMJI-CQSZACIVSA-N 269.291 2.495 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H](CO)[C@@H](F)C2)c1C 2340847632 GYHDOGKJOJNCEI-OBJOEFQTSA-N 266.360 2.090 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@@H](C)[C@@H](O)C2)cc1 2341298972 WJMVXQREKSSPBB-IOASZLSFSA-N 262.397 2.392 10 10 CECE C[C@H]1C[C@@H](C)[C@]1(C(=O)O)N(C)Cc1ccccc1O 2347718344 GYDQBEABMUADTE-HBYGRHMLSA-N 263.337 2.323 10 10 CECE C[C@@H]1CCC[C@](CO)(NCc2cc3c(cc2O)OCO3)C1 53117444 GRVSEUBSYILSIQ-BZNIZROVSA-N 293.363 2.152 10 10 CECE CCC(C)(C)N(C)C[C@@H](O)COc1ccc(N)cc1 69428012 PGYHYDPVHMUUHU-CYBMUJFWSA-N 266.385 2.129 10 10 CECE Cc1ccc(O)c(CN2CC[C@@H](CCC(=O)O)C2)c1 134709533 QLXBLEVNNHZHCC-GFCCVEGCSA-N 263.337 2.387 10 10 CECE Nc1ccc(CNC(=O)[C@H]2CCOc3ccccc32)cc1 111184396 SLGCRSIZFIQGDH-HNNXBMFYSA-N 282.343 2.451 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CCn2ccnc2C1 62254876 BUQJLWBBDFXQNW-UHFFFAOYSA-N 282.391 2.464 10 10 CECE CCOC(=O)[C@@H]1CCCCN1C(=O)Nc1ccc(N)cc1 36869264 MVGJMEGYJDSOGY-ZDUSSCGKSA-N 291.351 2.218 10 10 CECE Nc1c(O)c(O)c(Br)c2c1CCCC2 218286937 JXUYCPDKGQNSHZ-UHFFFAOYSA-N 258.115 2.321 10 10 CECE CCO[C@H]1CCCN(c2cc3c(cc2N)NC(=O)CC3)C1 42421357 HYHNMQKOLCPFLP-LBPRGKRZSA-N 289.379 2.159 10 10 CECE Nc1ccc(CC(=O)Nc2n[nH]c3ccccc23)cc1 82284189 ZOGQGWPWLLOTNG-UHFFFAOYSA-N 266.304 2.326 10 10 CECE CC[C@@H]1CN(c2ccc(OC)c(F)c2)CCCN1 86287050 FYEFIDHQGCBEQZ-LLVKDONJSA-N 252.333 2.413 10 10 CECE COc1ccc(O)c(CN[C@H]2[C@H]3CCO[C@H]3C23CCC3)c1 194101471 OCHJPWVBZGFQNC-VNQPRFMTSA-N 289.375 2.448 10 10 CECE C[C@H]1CN([C@@H](CN)c2ccc(N(C)C)cc2)CC(C)(C)O1 45664455 HLYADJDRYGCOFF-BBRMVZONSA-N 291.439 2.252 10 10 CECE CCN(Cc1ccc(O)c(O)c1)C[C@@H]1CCCCN1 233480162 XMMQZXIIAHRJKE-ZDUSSCGKSA-N 264.369 2.062 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1cccc2c1CNC2 2132770605 LPWOHTXAJUTZFN-UHFFFAOYSA-N 256.305 2.396 10 10 CECE CC(C)(C)OC(=O)NC[C@H](N)c1c(O)cccc1F 238166785 WZJDKCCZSBODMS-VIFPVBQESA-N 270.304 2.056 10 10 CECE O=C1N[C@H](c2ccc(F)c(Br)c2O)CCO1 95718620 KWNHTDDBJNIXLF-ZETCQYMHSA-N 290.088 2.465 10 10 CECE CC[C@H](C)N(CCOC)[C@H](CN)c1ccc(N(C)C)cc1 251950901 ULQXQIGPGAPJDN-WMLDXEAASA-N 293.455 2.499 10 10 CECE Cc1cccc(N(C)c2ncnc3c2CCNCC3)c1 2169058474 LLNKYJDJELKEGU-UHFFFAOYSA-N 268.364 2.241 10 10 CECE CN[C@H](COC[C@H]1CCCO1)c1ccc(N(C)C)cc1 2163061122 FDBHVUAWFSTLSF-HZPDHXFCSA-N 278.396 2.209 10 10 CECE CCN1CCc2cc([C@]3(N)[C@H](C)[C@H]4OCC[C@@H]43)ccc21 2163065608 BTVNIQJDNSAICT-IPALMDDQSA-N 272.392 2.278 10 10 CECE C[C@H]1C[C@](O)(c2ccc3c(c2)CCN3C)CN1C1CC1 2163076522 OIJYIBMGXIWUHW-YVEFUNNKSA-N 272.392 2.123 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1[C@H]2CCNC[C@@H]21 2163102565 LSVYGJYXMICUTG-MWDXBVQZSA-N 272.392 2.176 10 10 CECE Cc1ncsc1[C@H](O)[C@H](N)c1ccc2c(c1)CCN2C 2163136615 VNGPZZIFVZQHDM-ZIAGYGMSSA-N 289.404 2.177 10 10 CECE CN1CCc2cc(CN3CC[C@H](CN)C3(C)C)ccc21 2163176092 WOZWXYRDLWBSKJ-OAHLLOKOSA-N 273.424 2.238 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)c1ncoc1C(F)(F)F 2167837565 FWUSSFXAQQSVGG-ZCFIWIBFSA-N 293.205 2.109 10 10 CECE O=C(NCC1(F)CCCC1)[C@H]1CNc2ccccc2N1 2165908720 LTUIXZVWGVMRAD-CYBMUJFWSA-N 277.343 2.291 10 10 CECE O=C(O)[C@H](O)c1ccc2scc(O)c2c1S 396371527 ILKBLSWVYOGVJC-MRVPVSSYSA-N 256.304 2.014 10 10 CECE Cc1cc(N(C)[C@H](C)C[S@](C)=O)ccc1/C=C/C(=O)O 398823915 BBZMSOZFWUKBJV-WOOSYLQVSA-N 295.404 2.296 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3C[C@H]2CO3)c(Br)c1 718283853 FYZFDXAKRLIJAX-MIMYLULJSA-N 298.180 2.480 10 10 CECE C[C@@H](C(N)=O)N(C)c1ccc([C@@H](C)N)c(C(F)(F)F)c1 723182146 ILHDAURLMJQVSW-SFYZADRCSA-N 289.301 2.035 10 10 CECE CC(=O)N[C@@](C)(C(=O)N[C@@H](C)c1ccccc1O)C(C)C 828538833 AZWFCNJTJYTGGL-MEDUHNTESA-N 292.379 2.120 10 10 CECE COCCC1CN(Cc2ccc(N(C)C)c(F)c2)C1 826899949 ZVCHGUBUMONHNM-UHFFFAOYSA-N 266.360 2.360 10 10 CECE C[C@@H]1CCN(CCCOc2ccc(N)cc2)CCO1 720514238 AKBMDKGJTZGDIE-CYBMUJFWSA-N 264.369 2.149 10 10 CECE COC(C)(C)C[C@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 588406625 RRRZHLZDBLXXKV-JYKYSHPRSA-N 293.363 2.431 10 10 CECE COC[C@](C)(O)CCN[C@H](C)c1cc(C)ccc1O 834844943 WILMXXGOOMYBDD-IUODEOHRSA-N 267.369 2.139 10 10 CECE NCc1ccc2c(c1)CCCN2Cc1cnc2cnccn12 843057444 DLRXWQPRAIECHT-UHFFFAOYSA-N 293.374 2.141 10 10 CECE Nc1ccc(CCNC(=O)N2CC[C@@H]2C2CC2)cc1 841956073 UDJFUNDWHBFPJL-CQSZACIVSA-N 259.353 2.005 10 10 CECE Cc1cc(O)c(CN2CC[C@@]3(CNC(=O)C3)C2)c(Cl)c1 840941274 VHWXZJYFFGBYES-OAHLLOKOSA-N 294.782 2.066 10 10 CECE CCOC(=O)CC[C@H](C)NC(=O)Nc1ccc(N)cc1 841298532 QRUHJFQHPQCOOL-JTQLQIEISA-N 279.340 2.122 10 10 CECE N[C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2ccccc2O)C1 844909971 FWWXHOBGLXYQRJ-HLLBOEOZSA-N 290.407 2.253 10 10 CECE C[C@H]1C[C@@H](C(=O)NCc2cc(Cl)ccc2O)CCN1C 846474219 SEYBTRMLZMOAJK-QWRGUYRKSA-N 296.798 2.392 10 10 CECE CCO[C@@H](CN[C@H](CC)c1ccccc1O)CN(C)C 926958246 FIBNYHLDSLSSCY-DZGCQCFKSA-N 280.412 2.400 10 10 CECE CC[C@@H](NC(=O)NCc1c(O)cccc1F)[C@H]1CCCO1 921647456 CWGBKPCXLIPQRC-TZMCWYRMSA-N 296.342 2.288 10 10 CECE Cc1cc(CNC(=O)N[C@@H](C)c2ccccc2O)on1 868188963 UELJIYCEWRJNIQ-JTQLQIEISA-N 275.308 2.249 10 10 CECE C[C@@H](NC(=O)[C@@]1(C)CCCCN1)c1ccccc1O 870988298 MEEMGTTYDNYCGO-IAQYHMDHSA-N 262.353 2.102 10 10 CECE C[C@@H](Cc1ccc(N)cc1)N(C)C1CCN(C)CC1 71426040 VFBRFEMTWFDNSG-ZDUSSCGKSA-N 261.413 2.226 10 10 CECE CC/C=C(\F)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 867301647 DAPMTCFVNTUNCU-BUBXLPKJSA-N 267.300 2.408 10 10 CECE Cc1cc(O)c(CN2C[C@@H]3[C@H]4CC[C@@H](NC4)[C@H]3C2)cc1C 863650880 BKFOUVWJYVKWBS-PQEBFOHHSA-N 286.419 2.439 10 10 CECE CC[C@H](C)N(CCO)Cc1ccc(N2CCOCC2)cc1 862388259 YPYYVUKWPIIELI-HNNXBMFYSA-N 292.423 2.116 10 10 CECE Cc1ccc(C(=O)N[C@]23CCCC[C@@H]2C3)c(O)c1O 870537314 UUQKWRAOFRKZLM-BMIGLBTASA-N 261.321 2.469 10 10 CECE CNc1cccc(NC(=O)Cc2ccc(N)cc2)c1 1876524425 YOQPTZHYJACLKD-UHFFFAOYSA-N 255.321 2.492 10 10 CECE O=C(NC1(c2ncccn2)CCC1)c1cc(O)cs1 881997935 WOTBRLVILZBTHC-UHFFFAOYSA-N 275.333 2.053 10 10 CECE C[C@H](c1ccccc1O)N(C)C1[C@H]2CC[C@H]1CNC2 1877518213 ROBPFOWCBFIFAS-AGIUHOORSA-N 260.381 2.383 10 10 CECE C[C@H](NCc1cnsc1C(=O)O)c1ccccc1O 1877570871 SYOPJKUDDRGLEQ-QMMMGPOBSA-N 278.333 2.398 10 10 CECE Cc1cc(Cl)cc(CN2CCN(C(C)C)C(=O)C2)c1O 780791768 CNROBUNEIWQPQX-UHFFFAOYSA-N 296.798 2.407 10 10 CECE Oc1ccc(Cl)cc1CN1CCC2(CC1)COCCO2 895694777 KCMZRYNUTWTRHK-UHFFFAOYSA-N 297.782 2.427 10 10 CECE CC[C@@H]1CCN2C(=O)N(c3ccc(N)cc3)C(=O)[C@@H]2C1 132690947 GQXVBIGPXPBIDF-MFKMUULPSA-N 273.336 2.226 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3CC[C@H](C2)O3)c(F)c1 1880485974 MPPNOGCNEQZGMR-INTQDDNPSA-N 269.291 2.386 10 10 CECE C[C@H](N)c1cc(F)c(N2CC=C(CO)CC2)c(F)c1 1880927047 KNFSLSHCTCEIKW-VIFPVBQESA-N 268.307 2.113 10 10 CECE Cc1ccc2nc(NC(=O)Cc3ccc(O)c(O)c3)[nH]c2c1 1141482167 NDYWUOACQDGPRG-UHFFFAOYSA-N 297.314 2.464 10 10 CECE CC(C)c1nnc([C@H](N)c2cccc(F)c2O)o1 83384439 XHZDLMRYNRTCKV-SECBINFHSA-N 251.261 2.086 10 10 CECE O=c1ccc(CNCc2cc(Cl)ccc2O)c[nH]1 83480191 AXIPLMZMDJKYMY-UHFFFAOYSA-N 264.712 2.024 10 10 CECE COc1ccc(CNCC[C@H]2CCN(C)C2)cc1C 1963438235 DPIJBKKTVHINPI-AWEZNQCLSA-N 262.397 2.435 10 10 CECE CC(=O)c1ccc(CC(=O)NCc2c(O)cccc2O)cc1 1178911730 PARUGGQXNYNXGW-UHFFFAOYSA-N 299.326 2.159 10 10 CECE COc1ccc(N2C[C@@H](C)C(O)[C@H](C)C2)c([N+](=O)[O-])c1 688051875 AQCPHRVAQQCSGG-NXEZZACHSA-N 280.324 2.057 10 10 CECE COC[C@@H]1CN(c2ccc([C@H](C)N)cc2Cl)CCO1 705788251 SBGKQFZMJXAPFI-JQWIXIFHSA-N 284.787 2.211 10 10 CECE CN(C(=O)CN(CC1CC1)C1CC1)c1ccc(N)cc1 80364555 JIDJKQYIGANDOH-UHFFFAOYSA-N 273.380 2.106 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)cc1 706997546 YCTPUYVCARTIIL-LZWOXQAQSA-N 259.397 2.094 10 10 CECE C[C@@H]1CN(C)CCN([C@H](C)c2cc(F)ccc2O)C1 707527634 BFHXWFIDFKATEQ-VXGBXAGGSA-N 266.360 2.476 10 10 CECE CC[C@H]1COC[C@H]1NCc1cc(F)cc(F)c1O 708535615 NVYURRAWNFFWPJ-QPUJVOFHSA-N 257.280 2.185 10 10 CECE CC(C)(C)CN(CCO)c1c(F)cc(CO)cc1F 691047146 XHSZPWBASTWIQU-UHFFFAOYSA-N 273.323 2.302 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1C[C@H]2CCCN(C2)C1 717400080 WFDBOMPYZGRAFE-GDBMZVCRSA-N 259.397 2.185 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nnc(C)s2)cc1O 697804821 HXFRIRRVHQBIEZ-VIFPVBQESA-N 292.408 2.469 10 10 CECE CN1CCC[C@H]2[C@@H]1CCN2Cc1ccc(F)c(F)c1O 720461406 XCQQMKDSHRCRQV-STQMWFEESA-N 282.334 2.339 10 10 CECE C[C@@H](CS(C)(=O)=O)NCc1c(O)ccc2ccccc12 78640352 RFLKNWROLYYTSR-NSHDSACASA-N 293.388 2.068 10 10 CECE C[C@H]1CN(Cc2cc(N)ccc2O)C[C@@](C)(C(F)F)O1 698801157 VLDOHAXRLQVQQV-XPTSAGLGSA-N 286.322 2.219 10 10 CECE CCCN(c1ccc(N)cc1)[C@@H]1C[P@@](C)(=O)C[C@H]1O 2116376369 NPETTXJGWTZDHU-PJIJBLCYSA-N 282.324 2.221 10 10 CECE CCN[C@H](C[C@]1(C)COCCO1)c1ccccc1O 2117623991 OOZDIMROFCBTHW-UKRRQHHQSA-N 265.353 2.238 10 10 CECE CC(C)(C)NC(=O)CCOCCc1ccc(N)cc1 2119733921 PKNRWXXYXUCFSL-UHFFFAOYSA-N 264.369 2.133 10 10 CECE c1cc2c(cc1CNC[C@@H]1[C@@H]3CCCO[C@H]31)CCO2 2119934545 PSUQMDNWAOSAIO-SQWLQELKSA-N 259.349 2.136 10 10 CECE CC1=NN(C)C(=O)/C1=C/c1ccc(Cl)c([N+](=O)[O-])c1 1865676855 NXIMXLWGPYTGSQ-WEVVVXLNSA-N 279.683 2.480 10 10 CECE CC1(C)[C@H](O)[C@H]2CCN(c3ccc(CO)cc3Cl)[C@H]21 2121663231 CIPDHPIXKYFAHB-ZLKJLUDKSA-N 281.783 2.428 10 10 CECE CCOc1cc(CN[C@H](C)CC)ccc1N(C)CC(=O)O 211979123 BWGMKAOYUFCXIZ-GFCCVEGCSA-N 294.395 2.494 10 10 CECE Nc1ccc(NC(=O)CC[C@@H]2CN3CCC2CC3)cc1 212617457 LCRWMGCLKUIPHR-CYBMUJFWSA-N 273.380 2.329 10 10 CECE COc1ccc(N2[C@@H](C)CCNC[C@@H]2C)c(OC)c1 217114068 LIEJMHZQVJRITG-RYUDHWBXSA-N 264.369 2.281 10 10 CECE O=C(NOCCOc1ccccc1)c1cc(O)cs1 1640504413 LIVBRDWTYTWZJB-UHFFFAOYSA-N 279.317 2.194 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC[C@H]1[C@H](C)O 2125818906 SVMVBVNXTYUFKZ-BBRMVZONSA-N 262.397 2.453 10 10 CECE O=C(O)C12CCC(CC1)N(Cc1c(O)cccc1F)C2 1964727406 JMALCYVEVQNNGZ-UHFFFAOYSA-N 279.311 2.361 10 10 CECE CCC[C@@H](C(=O)OCC)N1CC[C@H](CN=[N+]=[N-])C1 1912168112 RTIRYEKXKXERPH-MNOVXSKESA-N 254.334 2.350 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)COc2ccc(F)cc2)C1 1912211424 WXEQPANFYYEBLG-SNVBAGLBSA-N 278.287 2.363 10 10 CECE COCC1CN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 1912254824 ZERUBOVHMMNREK-UHFFFAOYSA-N 283.755 2.326 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@@H]2CC[C@@H]21 1912207878 YWSCLXKYOOEXDX-NHCYSSNCSA-N 252.318 2.008 10 10 CECE CC(C)N1CCC(NCc2ccc(O)cc2O)CC1 20189050 VMDHSKWXKPUROC-UHFFFAOYSA-N 264.369 2.060 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1CC=CCO1 1966039923 KXTFNAFXKDMRSX-NSHDSACASA-N 255.264 2.105 10 10 CECE C[C@H]1CC[C@@H](O)CN1c1ccc2c(c1)CCC[C@@H]2N 2128273461 WLSOACABRQJNPL-PEYYIBSZSA-N 260.381 2.372 10 10 CECE CN(c1ccc2c(c1)CCC[C@@H]2O)C1(CO)CCC1 2128273074 JSRWESVWBDJXPT-HNNXBMFYSA-N 261.365 2.408 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCC[C@@H]3O)C[C@H]1O 2128274359 OFLXLNSTRZXYHW-LSDHHAIUSA-N 261.365 2.263 10 10 CECE CCC1(O)CCN(c2ccc3c(c2)CC[C@H]3O)CC1 2128323678 YTWSJMSRUNFUHT-OAHLLOKOSA-N 261.365 2.408 10 10 CECE COC[C@H]1CN(c2ccc3c(c2)CC[C@H]3O)C[C@H]1C 2128327729 IXJSUZPVVHYKEZ-AXAPSJFSSA-N 261.365 2.385 10 10 CECE CC1(C)C[C@@H](O)CN(c2ccc3c(c2)CC[C@@H]3N)C1 2128328308 MQRUFSSXKMZGRQ-HIFRSBDPSA-N 260.381 2.230 10 10 CECE CCNCc1ccc(N2CC3(OC)CC2C3)c(F)c1 2129033946 OPOXLMMXELRWBZ-UHFFFAOYSA-N 264.344 2.303 10 10 CECE COc1ccc2c(c1)CCN2C(=O)Cc1ccc(N)cc1 154057645 DUDCQAQSXAJRQR-UHFFFAOYSA-N 282.343 2.409 10 10 CECE CC(=O)N1C[C@H]2C[C@H]1CC[C@H]2Oc1ccc(N)cc1 259479192 HVBOLAUNEVMQNH-UXIGCNINSA-N 260.337 2.047 10 10 CECE C[C@@H](N)c1ccc(N2CCC3(CC[C@H]3O)CC2)cc1 2130887930 FQJFLIFHGOCAJG-IUODEOHRSA-N 260.381 2.448 10 10 CECE Cc1cccc(O)c1CN[C@@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12 2132229416 YEPCIPRMZOCKCX-NIHBDADESA-N 259.349 2.356 10 10 CECE NC(=O)[C@@H](NCc1ccc(Cl)cc1O)c1ccccc1 1659062631 VJJNVZQUDWKBRF-AWEZNQCLSA-N 290.750 2.362 10 10 CECE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)cs1 802779212 PNTSSLOSMWJPDI-UHFFFAOYSA-N 277.345 2.440 10 10 CECE CN[C@@H]1CCN(c2ccc(OC)c(OC)c2)C[C@@H]1C 219757073 VHCGGULRRWVRGG-WCQYABFASA-N 264.369 2.138 10 10 CECE COc1ccc(N2CC[C@@H](C[C@@H](C)N)C2)cc1OC 107938316 ALWHEYCNKIWVFZ-NEPJUHHUSA-N 264.369 2.267 10 10 CECE O=C(O)[C@H]1[C@H](C2CC2)CCN1Cc1ccccc1O 1968212983 ZSHDHIUOAGIJTH-GXTWGEPZSA-N 261.321 2.077 10 10 CECE Cc1ccc(CN[C@H]2CCC[C@@H](C(=O)O)C2)c(O)c1 1968589595 CFSBSNUNZXVNFQ-YPMHNXCESA-N 263.337 2.434 10 10 CECE CN(C)[C@@H]1CCCC[C@H]1NCc1ccc(O)cc1O 1922010502 IEKLCFWDXQYLLU-ZIAGYGMSSA-N 264.369 2.060 10 10 CECE COc1ccc(O)c(CNC[C@]2(C3CC3)CCCO2)c1 1922752850 XFXITVMLFVMMGN-INIZCTEOSA-N 277.364 2.450 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](N)CC(C)(F)F 1924411057 LYBNVLDKKQIICG-MWLCHTKSSA-N 286.322 2.284 10 10 CECE CO[C@@H]1CC[C@H](C(=O)NCc2cccc(C)c2O)C1 2139761267 GCMGBQROQQQADG-WCQYABFASA-N 263.337 2.132 10 10 CECE C[C@H](NCCN1C[C@H]2C[C@H]2C1)c1cc(F)ccc1O 1967516756 MWXRURVKVWHXPQ-SDDRHHMPSA-N 264.344 2.134 10 10 CECE C[C@H](c1ccc(O)cc1O)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2 251505131 GVRWZYQSEREWJT-DTVLGXAZSA-N 277.320 2.096 10 10 CECE Cn1ncc2c1C[C@H](NCc1cccc(Cl)c1O)CC2 1967769856 MTHUKBHVMVDGEM-GFCCVEGCSA-N 291.782 2.426 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@H](OC)[C@H](OC)C2)cc1 234041012 HCFYSESBKNGZSH-HRCADAONSA-N 278.396 2.207 10 10 CECE COC(=O)c1sccc1NC(=O)c1cccc(O)c1O 126243182 GFOIEQVEXZALNT-UHFFFAOYSA-N 293.300 2.198 10 10 CECE Cn1c(Cl)cnc1C=C1CCNCCC1(F)F 1943976540 HMFREGNPMOAOPL-UHFFFAOYSA-N 261.703 2.476 10 10 CECE Nc1ccc(CCC[C@H]2CCS(=O)(=O)C2)cc1 1944076774 XUADMCWTKGZZLW-LBPRGKRZSA-N 253.367 2.026 10 10 CECE O[C@H]1CN(c2ccc(CNC3CC3)cc2F)CC12CC2 2149758030 VNGXWQVJZZILHU-HNNXBMFYSA-N 276.355 2.039 10 10 CECE CC(C)(C)OC(=O)CC[C@H](CN)c1cccc(O)c1O 1951602510 ASCTUOUMDPZENL-SNVBAGLBSA-N 281.352 2.262 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCCSC[C@H]3C)ccc21 2143626117 PWUKOCJWKAOLIQ-YGRLFVJLSA-N 291.420 2.231 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@H](C(=O)N(C)C)C2)cc1 2143659773 JQNRMENAXYHUFR-DZGCQCFKSA-N 276.380 2.045 10 10 CECE O=C(c1cccc(O)c1O)N1CCS[C@@H]2CCC[C@@H]21 1970217800 KLWFIDDOCWHSBF-CMPLNLGQSA-N 279.361 2.208 10 10 CECE COC[C@@H](NC(=O)OC(C)(C)C)c1cc(N)ccc1O 1952761736 SESMOCHFKLCKHV-LLVKDONJSA-N 282.340 2.187 10 10 CECE COC[C@H](NC(=O)OC(C)(C)C)c1cccc(N)c1O 1952931474 REEPZZZEKBLXLY-NSHDSACASA-N 282.340 2.187 10 10 CECE CC[C@@H](C)[C@@H](CO)NCc1ccc(F)c(F)c1O 1970429938 PTALPTWUWJMVSG-LDYMZIIASA-N 259.296 2.167 10 10 CECE Oc1cccc(F)c1CNC1CC(n2ccnc2)C1 1970511839 BSJSSPMGPWNPFM-UHFFFAOYSA-N 261.300 2.221 10 10 CECE Cc1cccc(CN2CCCN3CCC[C@H]3C2)c1O 252729576 HHEFTFDFYKPQPT-HNNXBMFYSA-N 260.381 2.371 10 10 CECE C[C@H]1CN([C@H](CN)c2ccc(N(C)C)cc2)CCS1 252978387 BPJXCHYHKGRQTJ-SWLSCSKDSA-N 279.453 2.190 10 10 CECE O=C(O)[C@H]1CN(Cc2ccc(F)cc2O)C2(CCC2)C1 1974193568 UXJLLKPNNICEBI-LLVKDONJSA-N 279.311 2.361 10 10 CECE Oc1cccc2c1[C@H](NC[C@H]1C[C@@]13CCOC3)CC2 1974225612 PWJSBSYIRPKZQU-XJKCOSOUSA-N 259.349 2.396 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)N1CCCC(C)(C)C1 2150063015 JUQRVBNYPLIDIZ-UHFFFAOYSA-N 297.424 2.072 10 10 CECE Oc1cc(C[C@H]2CCCN2)c(C(F)(F)F)cc1O 258487028 VHYOIXKRDCHZAL-MRVPVSSYSA-N 261.243 2.411 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCNC[C@@]1(C)C1CC1 2151091316 WURANEJIZDRIID-BZNIZROVSA-N 276.380 2.233 10 10 CECE C[C@]1(C(=O)NCCc2ccc(O)c(O)c2)CCCS1 158001844 XVTFJEHFUHQXMF-CQSZACIVSA-N 281.377 2.042 10 10 CECE CO[C@H](CN(C)c1ccc(CN)cc1)C1CCOCC1 2150291757 DBAAOLWTQKCICZ-MRXNPFEDSA-N 278.396 2.023 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@@H]3C[C@H]32)c(Br)c1 2004447878 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CCNCc1ccc(OCC[C@@H]2COCCO2)c(C)c1 2155013000 LPONGAGSZMLIQY-OAHLLOKOSA-N 279.380 2.289 10 10 CECE CN1CCC[C@H](CC(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)C1 2155556766 RXFRIHNADIWDQX-CHWSQXEVSA-N 279.388 2.410 10 10 CECE c1cc2c(cc1CN[C@@H]1CNC3(CCC3)C1)CCCO2 2160556972 PYCKKNRCYBMPQD-HNNXBMFYSA-N 272.392 2.386 10 10 CECE CC1(C)C[C@H](CCNC(=O)c2ccc(O)c(O)c2)CO1 2159411168 XFVQGJYKZOXURF-JTQLQIEISA-N 279.336 2.033 10 10 CECE NCc1ccc(N2CC[C@@]3(CCCO3)C2)c(F)c1 2028416464 RFCJJQWLQGGOEH-AWEZNQCLSA-N 250.317 2.044 10 10 CECE CCc1nc(CN[C@@H](C)c2ccc(F)cc2O)n[nH]1 297394377 SAENZTYRBKHHCM-QMMMGPOBSA-N 264.304 2.063 10 10 CECE CN(C)c1ccc([C@@H](O)C(=O)c2ccns2)cc1 2030375086 KCWOFDUJLFVAOK-GFCCVEGCSA-N 262.334 2.125 10 10 CECE C[C@H](NC[C@@H]1OCC[C@H]1C)c1ccc(O)cc1O 2034984833 MCLMYCPILGMSTJ-BFVZDQMLSA-N 251.326 2.173 10 10 CECE CNCc1cc(F)c(N(C)C[C@@H]2CCCO2)c(F)c1 62712254 KUZCQNNWJTUJLJ-NSHDSACASA-N 270.323 2.299 10 10 CECE Cc1csc(CCNC(=O)Nc2ccc(N)cc2)n1 63136071 CBLIKMYNVSSHAP-UHFFFAOYSA-N 276.365 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251.301 2.046 10 10 CECE CCC[C@]1(NCc2c(O)cccc2OC)CCOC1 2104434208 RWABWDRJTZNZTN-HNNXBMFYSA-N 265.353 2.450 10 10 CECE CN(Cc1c(O)ccc2ccccc12)[C@H]1CC[C@H]1N 2105091462 KWENTDBQBFKTBP-CABCVRRESA-N 256.349 2.467 10 10 CECE N[C@@H]1CC[S@](=O)(=Nc2ccc(C3=S=CC=C3)s2)C1 2085062177 AJBYIIKKQPTCGZ-DYBLOJMWSA-N 298.458 2.204 10 10 CECE C[C@H]1Cc2cc(N3CCC34CCNCC4)ccc2O1 2106577892 OGFCPIOLRBITSR-LBPRGKRZSA-N 258.365 2.342 10 10 CECE CCOC(OCC)[C@@H](O)c1ccc2c(c1)CCN2C 2106791892 XLQRATQONRLDSW-AWEZNQCLSA-N 265.353 2.111 10 10 CECE C[C@@H]1CN[C@H]1[C@@H](O)c1ccc(N2CCCCC2)cc1 2106819731 CKLGJCZWOYIWHE-WQVCFCJDSA-N 260.381 2.318 10 10 CECE NC[C@@H]1CC[C@H]1[C@@H](O)c1ccc(N2CCCC2)cc1 2106825244 HVHQWRNGIIAHQB-IMJJTQAJSA-N 260.381 2.305 10 10 CECE C[C@@H]1CC[C@@H]([C@@H](O)c2ccc3c(c2)CCN3C)NC1 2106800256 FVGAIUHFLKZNFM-WPGHFRTFSA-N 260.381 2.100 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@H]1CCOC1 2106833052 GPHMPRHFGOJNEQ-GOEBONIOSA-N 260.381 2.366 10 10 CECE Cn1cncc1[C@H](O)c1ccc(N2CCCC2)cc1 2106829911 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10 CECE CN[C@H](C)c1ccc(N2[C@H]3C[C@@H]2CN(C)C3)c(C)c1 2232025897 BQGVATFVQVKZPL-YUELXQCFSA-N 259.397 2.168 10 10 CECE Cc1cc([C@H](C)O)ccc1N1C[C@@H]2CC[C@H](O)[C@H]2C1 2232096518 RCVJATTZBIVEQS-PCBIJLKTSA-N 261.365 2.255 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@@H]4[C@H](O)C[C@H]4C3)ccc21 2232886887 GXEIPHSOIOYOIB-KKBVYLPWSA-N 272.392 2.230 10 10 CECE CN(C(=O)C[S@](=O)CCCC1CC1)c1ccc(N)cc1 2235458482 SCRBEDZKPDIRNZ-HXUWFJFHSA-N 294.420 2.171 10 10 CECE COc1ccc(N2CCCC(C)(C)[C@@H]2CO)c(CN)c1 2235964208 RTJJECCNKMYVQA-HNNXBMFYSA-N 278.396 2.141 10 10 CECE COc1ccc(N(C)Cc2csnc2OC)c(CO)c1 2235999087 FIQNFFWTBSHCMM-UHFFFAOYSA-N 294.376 2.289 10 10 CECE COc1ccc(N(C)CCCn2cccc2)c(CN)c1 2235955812 VQSQQZSPMBNVAY-UHFFFAOYSA-N 273.380 2.482 10 10 CECE COc1ccc(N2CC(C)(OC)C2)c(CNC2CC2)c1 2235968117 NWIJTRAIGLCLRY-UHFFFAOYSA-N 276.380 2.172 10 10 CECE COc1ccc(N(C)C[C@@]2(C)CCOC2)c(C(=O)O)c1 2235951140 VYSVQDPWNJYGMR-OAHLLOKOSA-N 279.336 2.256 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](N(C)C)C3(CC3)C2)c(F)c1 2236362391 KDDYMFLMLKATCW-XHDPSFHLSA-N 278.371 2.409 10 10 CECE COC[C@@H]1CN(Cc2ccc(F)cc2O)CC(C)(C)O1 294636009 JYNKHZJEOFGCHS-ZDUSSCGKSA-N 283.343 2.157 10 10 CECE OC[C@]1(F)CCN(c2ccc(OCC(F)F)cc2)C1 2226741662 TWAOMUUUXXLOSO-ZDUSSCGKSA-N 275.270 2.241 10 10 CECE CC[C@H]1[C@H](CO)CCN1c1ccc2c(c1)COCC2 2226716397 TYDVXYNMJXTDBT-BBRMVZONSA-N 261.365 2.357 10 10 CECE COc1ccc(N2C[C@]3(CO)CCC[C@]3(F)C2)cc1 2226800009 WNYRWQZHCADXCC-GJZGRUSLSA-N 265.328 2.386 10 10 CECE COc1ccc(N2C[C@@H](O)[C@@H](C3CC3)C2)c(F)c1F 2226925322 SECVGTFGRAFJBB-MWLCHTKSSA-N 269.291 2.181 10 10 CECE c1cc(N2CCN3CC[C@H]2C3)ccc1CNC1CCC1 2240034515 ARLHFUZZDCHISF-KRWDZBQOSA-N 271.408 2.223 10 10 CECE Nc1ccc(O)c(CN2[C@H](CO)C[C@@H]3CCCC[C@H]32)c1 2240673504 UNYALIGMLMSXSY-TUKIKUTGSA-N 276.380 2.100 10 10 CECE CCN[C@@H](C)c1ccc(N(CCO)CCOC)c(C)c1 2240746898 YGLRZIJMLLFYLY-AWEZNQCLSA-N 280.412 2.111 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](O)C(F)(F)C2)c(C)c1 2240834321 YOODHJOJPZWMPC-BXUZGUMPSA-N 284.350 2.482 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)[C@H]1CCC(=O)N(C)C1 2240830240 PYBQXIMXZOZJGO-OCCSQVGLSA-N 276.380 2.105 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCCSC2)cc1 2253406022 HAQPNGKVESMQEW-CQSZACIVSA-N 266.410 2.356 10 10 CECE CCCCNC(=O)[C@@H](C)NCc1cnc(SC)s1 2256940833 PIPSFXKMLNFNKP-SECBINFHSA-N 287.454 2.259 10 10 CECE CSc1ncc(CNC[C@]23CCC[C@@H]2NCC3)s1 2257122421 CDAHZLWWCUSTOP-WCQYABFASA-N 283.466 2.487 10 10 CECE O[C@@H]1CCCc2cc(N3C[C@H]4COC[C@H]3C4)ccc21 2271351261 VMCRGPHUIMGMOE-SGIREYDYSA-N 259.349 2.281 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N1C[C@H]2C[C@@]2(N)C1 2271766264 LVDVFTLFICORSE-DSZLRUIBSA-N 258.365 2.282 10 10 CECE C[C@@H](O)CN(Cc1cc(N)ccc1O)CC(C)(C)C 2272519938 IPZIMURUNKSMTF-LLVKDONJSA-N 266.385 2.203 10 10 CECE NC1C[C@@H]2CC[C@H](C1)N2c1ccc(OCF)cc1 2263919903 BCMNEYYRZSUANI-VGPLMAKISA-N 250.317 2.451 10 10 CECE N=C(NO)c1cnc(SCCCOCC2CC2)s1 2264161977 GVVQIEVQJLEGLX-UHFFFAOYSA-N 287.410 2.356 10 10 CECE COc1ccc(N(C)C[C@@H](O)c2ccc(N)cc2)cc1 2279039233 UAVRQNFZSOFHDE-MRXNPFEDSA-N 272.348 2.447 10 10 CECE Cc1cc(N2C[C@@H](N(C)C)[C@H](C)C2)ccc1[C@H](C)O 2269676749 MOZHRFCQFWVTES-DVOMOZLQSA-N 262.397 2.435 10 10 CECE C[C@@H](N)c1ccc(N2CCC3(CC2)CN(C)C3)c(F)c1 2279984051 AZEKWSPGHHDVGM-GFCCVEGCSA-N 277.387 2.377 10 10 CECE C[C@]1(C(=O)O)CN(Cc2c(O)cccc2F)CC1(F)F 2295526181 DLRDMVUFFYEVGW-GFCCVEGCSA-N 289.253 2.073 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)cc1C 2286222482 PJWIILRJFDMLMM-WVZRYYJFSA-N 274.408 2.483 10 10 CECE CCNCc1ccc(N2CCn3cncc3C2)cc1C 2286512356 XKDHUOJHQRRHSU-UHFFFAOYSA-N 270.380 2.321 10 10 CECE COC[C@H]1C[C@@H](CN)N(c2ccc(OC)c(C)c2C)C1 2289514999 IIMDPNUOSAUEHM-KBPBESRZSA-N 278.396 2.112 10 10 CECE CC[C@@]1(C)CN(C(=O)C=Cc2ccc(O)c(O)c2)CCO1 2310979641 OGTCBPVGLGAJIJ-INIZCTEOSA-N 291.347 2.139 10 10 CECE CC[C@H](O)c1ccc(N2CCOC[C@@H](F)C2)cc1 2315065198 AUXAKXUOGUNDKR-JSGCOSHPSA-N 253.317 2.305 10 10 CECE COc1ccc(N2CC(F)(F)[C@](C)(N)C2)c(C)c1 2315265702 YCIPFKYVNBIQDF-GFCCVEGCSA-N 256.296 2.176 10 10 CECE CN[C@@H]1CCCN(c2ccc(OC)c(F)c2)CC1 2317792740 UVCBMUUBKUEOAL-LLVKDONJSA-N 252.333 2.413 10 10 CECE C[C@H]1Cc2cc(N3[C@H]4CC[C@@H]3C[C@H]4CN)ccc2O1 2330484020 JUWHCOFIFWPTDF-DNVSUFBTSA-N 258.365 2.326 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1[C@H]2CC[C@@H]1C[C@H]2CN 2330487522 KXXOPJLKGPJUSX-XVMOGABASA-N 264.344 2.404 10 10 CECE CCN1CCc2cc([C@H](N)[C@H]3[C@@H]4CCO[C@@H]43)ccc21 2330725018 PVSSGPCRRMPGDA-UKMLZYKCSA-N 258.365 2.104 10 10 CECE Cc1cc(N2CC[C@@H]3CC[C@@H](O)[C@H]2C3)ccc1CO 2330967640 XRADHLBLGRNOGP-APHBMKBZSA-N 261.365 2.227 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@H]1C[C@@H]2C[C@@H]2CO1 2331066609 DQDHWHPCYYQXBJ-RRFJBIMHSA-N 261.365 2.349 10 10 CECE COc1ccc(N2[C@H]3CC[C@H](C3)[C@H]2CO)cc1OC 2333690791 VHFHDSCWDYJCCM-NTZNESFSSA-N 263.337 2.053 10 10 CECE COC[C@@]1(C)[C@@H]2C[C@@H]2CN1c1ccc(CO)cc1C 2334402584 QJGOFRIJEGLKNX-FMKPAKJESA-N 261.365 2.349 10 10 CECE COc1ccc(N2C[C@@]3(CO)CC[C@H]2C3)c(OC)c1 2336491840 XDAQJPROFLVVFB-XHDPSFHLSA-N 263.337 2.055 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC(F)(F)[C@@](C)(N)C2)c1 2336779576 ZTEDHXREMUEVIE-MFKMUULPSA-N 270.323 2.430 10 10 CECE CN(C)c1ccc2c(c1)CCN2CCOCC(F)F 2353463415 JCJOGLJVKISVCB-UHFFFAOYSA-N 270.323 2.397 10 10 CECE CSc1cc(N(C)[C@H]2CN3CC[C@H]2C3)ccc1CN 2353850255 ZAQWXVSZGQLYLK-JSGCOSHPSA-N 277.437 2.008 10 10 CECE C[C@H](NCCOCC(F)F)c1ccc(O)cc1O 235517652 SVZNWMKNIHIQDH-QMMMGPOBSA-N 261.268 2.030 10 10 CECE Oc1ccc(CN[C@@H]2C[C@@H]3[C@H]4CC[C@H](C4)[C@@H]23)c(O)c1O 2357250467 NAOABKLXJTWIEB-XKYXEJCGSA-N 275.348 2.328 10 10 CECE Nc1ccc(-n2ccc(C(=O)Nc3ccncc3)n2)cc1 35427810 LJSKKKZVYTWLNT-UHFFFAOYSA-N 279.303 2.102 10 10 CECE CC(C)[C@@H](C)OC[C@@H](O)COc1ccc(N)cc1 123563021 HZECUBSSZNTPSD-DGCLKSJQSA-N 253.342 2.070 10 10 CECE C[C@H](O)C[C@@H]1CCCCCN1Cc1cc(N)ccc1O 312965748 ODEYWDQASCGGGG-WFASDCNBSA-N 278.396 2.490 10 10 CECE COc1ccc([C@H](C)N2CCCN(C(C)=O)CC2)c(O)c1 133273079 ZHOLYNCIKFYIIP-LBPRGKRZSA-N 292.379 2.016 10 10 CECE O=C(O)c1csc(CNCc2ccccc2O)c1 228407516 PCYVGEDWLRXXHX-UHFFFAOYSA-N 263.318 2.442 10 10 CECE OC[C@H]1CCCC[C@@H]1NCc1cccc(F)c1O 226610117 UTPQPABHLNCDNX-YPMHNXCESA-N 253.317 2.172 10 10 CECE O=C([C@@H]1CCCO1)N1CCc2cc(N3CCCC3)ccc21 41121251 UMPOFEPCBSMDHC-INIZCTEOSA-N 286.375 2.355 10 10 CECE [N-]=[N+]=NCCS(=O)(=O)c1ccc2c(c1)CCC2 42416511 QCOXNBIFKBZIOE-UHFFFAOYSA-N 251.311 2.259 10 10 CECE COc1ccc(N2CCN(C3CCC(O)CC3)CC2)cc1 97912300 BHINNWXCBCKBFR-UHFFFAOYSA-N 290.407 2.121 10 10 CECE CC(C)OCCCNC(=O)[C@@H](C)Cc1ccc(O)c(O)c1 96785326 IQZUMDDRDXPNEK-LBPRGKRZSA-N 295.379 2.208 10 10 CECE COCCN1[C@@H](C)CN(Cc2cc(C)ccc2O)C[C@@H]1C 93479192 MCUAVWGONWZAIM-GJZGRUSLSA-N 292.423 2.242 10 10 CECE COc1cccc(CN2[C@@H](C)COC[C@H]2C)c1O 93607243 YERRQMPAKPMSTR-PHIMTYICSA-N 251.326 2.010 10 10 CECE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCCOC2)c1 273624140 ZXOFPSHITNYEKL-PWSUYJOCSA-N 279.336 2.008 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[C@H](O)CC2)cc1O 381160464 VRDTTYJYRMDRGY-OCCSQVGLSA-N 278.396 2.414 10 10 CECE C[C@@H](NCc1cc(Cl)c(F)cc1O)c1ncnn1C 294661365 LOCSFSUBSGVBOY-SSDOTTSWSA-N 284.722 2.164 10 10 CECE CO[C@@H](CNCc1cc2c(cc1O)OCO2)C1CCC1 703057274 BHULXXMFFWBDGK-HNNXBMFYSA-N 279.336 2.026 10 10 CECE CC(=O)C(=O)COC(=O)C[C@H]1CCCC(C)(C)C1 808531148 LBLAQWDDROXISA-LLVKDONJSA-N 254.326 2.294 10 10 CECE CCCN(CCC)c1ccc([C@H]2NC(=O)CN2C)cc1 298792380 RGLNRLDQRIXGAX-INIZCTEOSA-N 275.396 2.373 10 10 CECE CCN1CCc2cc([C@]3(O)C[C@H]4C[C@H]3CC4=O)ccc21 2167084178 BITNLTVZISWNTM-HACGYAERSA-N 271.360 2.256 10 10 CECE C[C@@H]1C[C@@H]1N(CCO)c1ccc(CO)cc1C(F)(F)F 2167110539 XEBHMDOYIROYOU-RNCFNFMXSA-N 289.297 2.405 10 10 CECE CC(=O)C(=O)COC(=O)C=C1CCC(C)(C)CC1 808530029 JERHLZISCJPRIG-UHFFFAOYSA-N 252.310 2.214 10 10 CECE CCN1C[C@@H](N[C@@H](C)c2ccc(O)cc2O)C(C)(C)C1 722295424 KDMIONFNDCPCHI-XHDPSFHLSA-N 278.396 2.479 10 10 CECE CCOc1ccc(CN[C@H]2CCCOC2)c(O)c1 808436423 WCYSXVTXEWJEKV-LBPRGKRZSA-N 251.326 2.060 10 10 CECE Cc1nc([C@H](NN)c2ccc3c(c2)CCCN3C)cs1 2163100892 WCMNGEUELRVSCI-OAHLLOKOSA-N 288.420 2.387 10 10 CECE C[C@@H](CCN(C)c1ccc2c(c1)NC(=O)[C@H]2N)C(F)F 2166575726 JMJVWMMVGSEADV-UFBFGSQYSA-N 283.322 2.366 10 10 CECE COC[C@@H]1CCN1Cc1ccc(Br)cc1O 826011405 HFHSQRUBQQMZRV-NSHDSACASA-N 286.169 2.375 10 10 CECE CC(=O)C(=O)COC(=O)[C@]1(C)CCC(C)=C(C)C1 909737974 VGRIYWSSBZGCPS-CQSZACIVSA-N 252.310 2.214 10 10 CECE C[C@@H](NC[C@H]1CCCCN1CCO)c1ccc(F)cc1O 834849348 BBCHMWGWVLHONS-TZMCWYRMSA-N 296.386 2.029 10 10 CECE COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)C1 840910398 LXCNXWAVMVCHRZ-CQSZACIVSA-N 276.380 2.056 10 10 CECE CC(=O)c1cnc(NC(=O)c2cc(O)cs2)s1 743421368 ZUMQNVCUJJXDRB-UHFFFAOYSA-N 268.319 2.365 10 10 CECE COc1ccc(CNC[C@H]2CN(C3CC3)C(=O)O2)cc1C 848578301 QGLYMPZVDPHPJP-AWEZNQCLSA-N 290.363 2.076 10 10 CECE Nc1ccc(CCNC[C@]23CCC[C@@H]2OCC3)cc1 687484052 RCWAHXXDEHPQFN-JKSUJKDBSA-N 260.381 2.360 10 10 CECE CON(C)C(=O)CN(C)c1ccc(-c2nccs2)cc1 846991137 DILHUNRBBJSNKD-UHFFFAOYSA-N 291.376 2.266 10 10 CECE C[C@]1(C2CC2)CN(Cc2cc3c(cc2O)OCO3)CCO1 853527633 CBJSCLUFSSDXID-MRXNPFEDSA-N 291.347 2.122 10 10 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Oc1ccc(CCNc2ccnc(C3CC3)n2)cc1O 128683500 SFBSSSSBEKPNAN-UHFFFAOYSA-N 271.320 2.420 10 10 CECE CO[C@@H](CNCc1cccc(C)c1O)C1CCOCC1 2150206651 BMDWMHLRPPIKAV-HNNXBMFYSA-N 279.380 2.232 10 10 CECE CCN1CCc2cc([C@@H](N)CCCC(=O)O)ccc21 1952054093 XFLYRNKIJRNSIL-ZDUSSCGKSA-N 262.353 2.324 10 10 CECE CCN(CC)c1ccc([C@H]2C[C@@H](O)CCN2)c(O)c1 1952135029 IGZBHQWANDPZLZ-GXTWGEPZSA-N 264.369 2.024 10 10 CECE CC(C)(C)OC(=O)C1(N)CC(c2ccc(O)c(O)c2)C1 1952495714 PVASTLKOESFZOP-UHFFFAOYSA-N 279.336 2.014 10 10 CECE N[C@@H](c1ccccc1O)[C@]1(O)CCCc2cccnc21 2148161269 LOFLDCGNUCNEDZ-GOEBONIOSA-N 270.332 2.011 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCOC[C@@H]1C(F)(F)F 2150467999 FZPBEYVDESQJES-GZMMTYOYSA-N 291.269 2.422 10 10 CECE Oc1ccccc1CN[C@@H]1CCC[C@@H]1[C@H]1CCCN1 253086216 AUQWQPZTTNVZHY-RBSFLKMASA-N 260.381 2.403 10 10 CECE Nc1ccc(CC(=O)NC2C[C@H]3CSC[C@@H]3C2)cc1 1973979635 XDNZAUHOEPATFN-RYUDHWBXSA-N 276.405 2.069 10 10 CECE C[C@]1(C2CC2)COCCN1c1c(F)cc(CN)cc1F 2144667874 ILSCKAJYIUVEMI-OAHLLOKOSA-N 282.334 2.429 10 10 CECE Oc1cc(F)ccc1CN1CC[C@@H](OC(F)F)C1 2222939658 BOQJIPWTZZAPHO-SNVBAGLBSA-N 261.243 2.345 10 10 CECE CC(C)(F)[C@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 2145586860 UGDCJPSOHFSRCG-TVQRCGJNSA-N 277.343 2.213 10 10 CECE CN(C)c1ccc([C@H](CN)N2C[C@H]3CCC[C@H]3C2)cc1 158053412 WKYPBIZBEHMASJ-UXLLHSPISA-N 273.424 2.484 10 10 CECE CCc1noc(CN2CCc3cc([C@@H](C)N)ccc32)n1 2145822965 MBIIDWBIBSNZMM-SNVBAGLBSA-N 272.352 2.214 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@H](O)[C@H](F)C2)c(F)c1 2149247177 FENCUZKFJZNIMG-OCCSQVGLSA-N 284.350 2.233 10 10 CECE C[C@H](OC[C@@H]1OCC[C@@H]1C)C(=O)Nc1ccc(N)cc1 2152441411 TUFIODXMXSWTHT-MJVIPROJSA-N 278.352 2.037 10 10 CECE C[C@@H](NC[C@@H](C)N1CCCC1)c1ccc(O)cc1O 160975639 GRMCPQNJRQQSMS-VXGBXAGGSA-N 264.369 2.233 10 10 CECE COc1ccc(NC(=O)Cc2ccc(N)cc2)cc1O 37040812 IOANSPKOMNDOSL-UHFFFAOYSA-N 272.304 2.164 10 10 CECE Nc1ccc(CCC(=O)NC[C@H]2CCCCCO2)cc1 2152629738 QKQUIFGDSIVSRW-OAHLLOKOSA-N 276.380 2.277 10 10 CECE Cc1nc2n(c1[C@@H](O)CCc1ccc(N)cc1)CCC2 2151142777 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2011232856 HMOBNAQBHWVBPI-UHFFFAOYSA-N 253.371 2.168 10 10 CECE CNCc1ccc(N(CCO)C2CCCC2)c(C)c1 50562053 XLXKBEJTVGPLGX-UHFFFAOYSA-N 262.397 2.456 10 10 CECE Oc1ccc(Br)cc1CN[C@H]1C[C@@]12CCOC2 2021244534 VKYPSNPCAAPRNV-QWHCGFSZSA-N 298.180 2.423 10 10 CECE Nc1ccc(N2CCN(c3ncccc3F)CC2)cc1 54701064 WSFVFATVZMBWKO-UHFFFAOYSA-N 272.327 2.130 10 10 CECE C[C@H]1CCC[C@@]1(O)CNCc1ccc(F)cc1O 293957441 JEHGOFGARBQPCK-IINYFYTJSA-N 253.317 2.172 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2CN(C)C3)cc1 2160691129 PRBGSIDZJCDDMR-KEYYUXOJSA-N 273.424 2.497 10 10 CECE CCC[C@H](O)CCNCc1ccc(F)c(F)c1O 2029925704 YUAWDJKUICVSFU-JTQLQIEISA-N 259.296 2.311 10 10 CECE COc1ccc(N(C)C[C@@H](N)c2cnsc2)cc1 2031561026 RQGGOQYGBGFJDT-CYBMUJFWSA-N 263.366 2.288 10 10 CECE C[C@H](N[C@H](CO)C1(C)CC1)c1cc(F)ccc1O 2033114264 KJNOKTLEINPSSO-TVQRCGJNSA-N 253.317 2.343 10 10 CECE Oc1cccc(F)c1CN[C@@H]1CCCN2CCSC[C@H]12 2160777681 FOIYGWJFVDPJJL-ZIAGYGMSSA-N 296.411 2.201 10 10 CECE C[C@@H](C1CNC1)N(C)[C@H](C)c1ccc(F)cc1O 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CCN[C@H](c1ccc(N(C)C)cc1)[C@H]1OCCO[C@H]1C 2163078864 KTUPPXCNXYJNQN-MAZHCROVSA-N 278.396 2.207 10 10 CECE CCN1CCc2cc([C@H](O)c3ccnc(C)n3)ccc21 2163075957 JRFMKDRJXKGCLS-INIZCTEOSA-N 269.348 2.249 10 10 CECE CCN1CCc2cc([C@H](O)c3ccn(CC)n3)ccc21 2163073151 GGPSLOJEOSUNPW-INIZCTEOSA-N 271.364 2.367 10 10 CECE CC(C)[C@@H]1CN(c2ccc3c(c2)CN(C)C3)[C@H](C)CN1 689412035 VMMIQYNRRDAZTA-DYVFJYSZSA-N 273.424 2.455 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3N[C@H]4CC[C@H]3C4)ccc21 2163109248 XJYUBAQAKFERBG-SDNTUTLCSA-N 272.392 2.243 10 10 CECE Oc1c(F)cc(F)cc1CN1CCO[C@H]2CCC[C@@H]21 708402910 XSLCGUGSBQSJKF-STQMWFEESA-N 269.291 2.424 10 10 CECE CO[C@H]1C[C@@H](CN[C@H](C)c2cc(O)ccc2O)C1 708677628 RIBUSRJENXINPO-FOGDFJRCSA-N 251.326 2.173 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)Cc1c(O)cccc1OC 2163612189 HNUPOASTKNDFHX-JSGCOSHPSA-N 278.396 2.221 10 10 CECE COc1ccc(N2CCCC[C@H]2[C@@H](C)O)c([N+](=O)[O-])c1 688056262 XRTYQKUYOKIBLQ-PWSUYJOCSA-N 280.324 2.343 10 10 CECE C[C@H]1CN(C(=O)COc2ccc(N)cc2)C(C)(C)C1 380503533 JEHUUOBAPWXCRH-LLVKDONJSA-N 262.353 2.295 10 10 CECE C[C@H]1[C@H](N)CCCN1Cc1cc(Br)ccc1O 381392936 SMGGQZALGUICIU-JOYOIKCWSA-N 299.212 2.466 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C[C@]12CCC[C@@H]1C2 693771510 WOVKLUWRRDTNTJ-MLGOLLRUSA-N 275.348 2.403 10 10 CECE CN1C(=O)[C@@H](O)c2ccc(N(C)[C@H]3CCC3(C)C)cc21 694250997 ZRQXQRKKBSDXMO-KBPBESRZSA-N 274.364 2.321 10 10 CECE CCNCc1cc(F)c(N(C)[C@@H]2CCN(C)C2)c(F)c1 383307052 OTBNHBUZMGTOQJ-GFCCVEGCSA-N 283.366 2.215 10 10 CECE C[C@@H](NCC12CCN(CC1)C2)c1cc(F)ccc1O 715625694 TWJZAQXVJIERAW-LLVKDONJSA-N 264.344 2.278 10 10 CECE CC[C@]1(NCc2ccc(OC)cc2O)CCOC1 385962910 KVSPWGNDFIBMDI-AWEZNQCLSA-N 251.326 2.060 10 10 CECE COc1ccc(N(C)[C@@H](CN)[C@H](OC)C(C)C)cc1 386147677 RNFALRANQOKLIV-LSDHHAIUSA-N 266.385 2.130 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H](CC)[C@H](O)CC 2164996788 UTQPHRMQQUQTQZ-CHWSQXEVSA-N 280.368 2.407 10 10 CECE CCCC(=O)NCCNCc1cccc(Cl)c1O 393057186 BRBADEDBCVFZNH-UHFFFAOYSA-N 270.760 2.052 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](CO)[C@@H](C)C2)c(F)c1 2165331157 RGZJPGATYUEOSC-JQWIXIFHSA-N 284.350 2.139 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(N)=O)CC[C@H]2CCCC[C@H]2C1 723628558 JOFMQTQBGYSQBW-MBNYWOFBSA-N 279.388 2.491 10 10 CECE CCOc1cccc(CN[C@@H]2CC[C@H]2OC)c1O 724187385 JFSUGHFUSCBKDL-VXGBXAGGSA-N 251.326 2.058 10 10 CECE CCO[C@H]1C[C@@H](OC)CN(c2ccc(CN)cc2Cl)C1 2165449615 OOMUWHWVSRUEGT-OLZOCXBDSA-N 298.814 2.429 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc([C@@H](C)NC)c(O)c1 395249989 TYAGVFSIUQKHNY-TYNCELHUSA-N 278.396 2.270 10 10 CECE O=C(N[C@H]1CCCC1(F)F)c1ccc(O)c(O)c1 398384376 OLYUGDYLITVZEF-JTQLQIEISA-N 257.236 2.015 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C4CCC3CC4)c(Cl)cc21 398896725 BYQVOTIZZDMTNV-ROKYYSGWSA-N 277.755 2.423 10 10 CECE OC[C@@H](NCc1ccc(Br)cc1O)C1CC1 825290995 BQXHZPSWLMDNLP-LLVKDONJSA-N 286.169 2.015 10 10 CECE C[C@@H](N(C)c1ccc2c(c1)N(C)C(=O)[C@H]2O)C(C)(F)F 2178861045 OWBJZHAFFCKQKO-PELKAZGASA-N 284.306 2.176 10 10 CECE COc1ccc(O)c(Cn2nc(C3CC3)cc2N)c1 2070130636 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10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@H]3C[C@H](O)[C@H]2C3)cc1O 2177160830 WQSLRAJRTXAPSW-CIGZNWKYSA-N 276.380 2.022 10 10 CECE Cc1ccc([C@@H](C)n2nc(C)c(C=O)c2N)c(O)c1 2079106205 CZRUSCJDSSIJSD-SNVBAGLBSA-N 259.309 2.210 10 10 CECE C[C@@H](N)Cc1ccnc(N2CCCc3cnccc32)c1 2171298979 ZPAYUEWAAKCTQN-GFCCVEGCSA-N 268.364 2.451 10 10 CECE Cc1cc(O)c([C@@H](C)n2nc(C)c(C(=O)O)c2N)cc1C 2079936684 MZBCGNWAJJAXGS-SNVBAGLBSA-N 289.335 2.404 10 10 CECE CN1CCc2cc([C@@H](N)[C@]3(O)CC[C@H]4C[C@@H]3C4)ccc21 2189656675 SGIHARKDSRPSFN-HWHUXHBOSA-N 272.392 2.230 10 10 CECE NC1CC2(CC[C@@]2(O)c2ccc(N3CCCC3)cc2)C1 2184085798 CWJCTZVBRVXBCP-BDVYOWHSSA-N 272.392 2.376 10 10 CECE CN[C@@H]1CCc2cc(N(C)Cc3nccn3C)ccc21 2184710649 HYGHEFDLEFMWFB-OAHLLOKOSA-N 270.380 2.263 10 10 CECE CCCN[C@@H]1CCc2cc(N(C)CC[S@@](C)=O)ccc21 2184734684 WUCXDCMYIAGOKI-OXQOHEQNSA-N 294.464 2.488 10 10 CECE CCn1nccc1CN(C)c1ccc2c(c1)CC[C@@H]2N 2184740902 BCHJRTSHXQIRAN-INIZCTEOSA-N 270.380 2.485 10 10 CECE 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CC(=O)NCCN(C)[C@H](C)c1ccc(Cl)cc1O 2083083031 KFLNTCPIFLYLIJ-SECBINFHSA-N 270.760 2.175 10 10 CECE CCNCc1ccc(N(C)Cc2ncno2)cc1C 2104125550 MPDOWOFXLFJLNM-UHFFFAOYSA-N 260.341 2.124 10 10 CECE CCNCc1ccc(N2CC(CF)C2)cc1OC 2084013408 DSZPLFRHNOTMGG-UHFFFAOYSA-N 252.333 2.210 10 10 CECE COc1cc(N2CCC[C@H](SC)C2)ccc1CN 2084015656 GREWUXBMVFJIFK-ZDUSSCGKSA-N 266.410 2.486 10 10 CECE C[C@@H]1C(COc2ccc(N3CCNCC3)cc2)[C@H]1C 2105344059 JLKBKPIADHXSER-STQMWFEESA-N 260.381 2.377 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@H](CN)C2)cc1OC 2106341111 SWYPPAKPKAWHGH-VXGBXAGGSA-N 264.369 2.125 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H](O)CCSC)ccc21 2106853016 LTIKNIUOXUJFIZ-GJZGRUSLSA-N 280.437 2.183 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3CC[C@H]3CN)ccc21 2106824383 YRZABLOXYOVCCA-LZWOXQAQSA-N 260.381 2.087 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H](O)c3ccoc3)ccc21 2106849485 WSARMUVWNKUTCR-CABCVRRESA-N 258.321 2.005 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3CCCNCC3)ccc21 2106805097 JJMQQIZANMGDHI-MLGOLLRUSA-N 260.381 2.102 10 10 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CC[C@H](C)NCc1ccc(N2C[C@H]3[C@H](O)C[C@H]3C2)cc1 2240053279 LNLGFWKLMFHSLU-GUDXXQAFSA-N 274.408 2.392 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCC[C@H](OCCO)C1 2240839750 JOXWFJAFICUCDR-HIFRSBDPSA-N 279.380 2.026 10 10 CECE CCOC(=O)CCSCCOc1ccc(N)cc1 2255240888 JUMPFDSGNRCWIR-UHFFFAOYSA-N 269.366 2.334 10 10 CECE COc1c(F)cc(N2C[C@H](C)NC[C@@H]2C)cc1F 2256196643 MMKZMKYTFKAONR-IUCAKERBSA-N 256.296 2.160 10 10 CECE CSc1ncc(CNC[C@H]2NCC[C@@H]2C2CC2)s1 2257132562 DLHDBIWXGQZBTD-VXGBXAGGSA-N 283.466 2.343 10 10 CECE CN[C@@H](CCNCc1cnc(SC)s1)C(F)(F)F 2257135330 OYDSHZCUNPEIMT-QMMMGPOBSA-N 299.387 2.495 10 10 CECE CN(CCC1CC1)Cc1ccc(N2CCNCC2)cc1 2286066318 REKQFYLWDWBSGM-UHFFFAOYSA-N 273.424 2.328 10 10 CECE CNCc1ccc(N2CC(P(C)(C)=O)C2)c(F)c1 2258287279 IQTIIWZTGLHNIG-UHFFFAOYSA-N 270.288 2.356 10 10 CECE CC[C@H]1CCNC[C@H]1NCc1cnc(SC)s1 2248705268 NPCDUKIOTWLLPD-GXSJLCMTSA-N 271.455 2.343 10 10 CECE COc1cscc1[C@H](NCCCN=[N+]=[N-])C(=O)O 2258901140 FCYHOAUBXHTPAX-VIFPVBQESA-N 270.314 2.172 10 10 CECE 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251.326 2.055 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@H](C)C2)c(F)c1F 2219761411 JZWLEQWRASKTOI-PSASIEDQSA-N 257.280 2.181 10 10 CECE CCCN(C[C@H](C)O)c1ccc(CNC)c(OC)c1 2272442271 RQLHGBJISYVLPU-LBPRGKRZSA-N 266.385 2.012 10 10 CECE COc1ccc(N2C[C@H](O)CCC23CC3)c(F)c1 2220278342 BKTAFMJBTPCINX-SNVBAGLBSA-N 251.301 2.328 10 10 CECE COc1ccc(N2CC(F)C2)c(CNC2CCC2)c1 2231433635 OTVGKHHQFGUPSI-UHFFFAOYSA-N 264.344 2.495 10 10 CECE CCN1CC(CN(C)c2ccc([C@@H](C)O)cc2C)C1 2232105648 VXFMIIQZDJXXJL-CYBMUJFWSA-N 262.397 2.436 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@@H]4[C@H](O)C[C@H]4C3)ccc21 2232788907 GBLNXDXULFYJEN-KKBVYLPWSA-N 273.376 2.263 10 10 CECE Oc1ccc(CNC[C@@H]2OC[C@H]3CCCC[C@@H]32)cc1O 2233215263 JBGYDKUUQRKRPE-WWGRRREGSA-N 277.364 2.393 10 10 CECE CCOc1ccc(N2CC([C@@H](F)CO)C2)cc1OCC 2234893122 GJCHHJOYIFGZEB-ZDUSSCGKSA-N 283.343 2.251 10 10 CECE NN[C@H](c1ccccc1O)[C@@H]1OC[C@@H]2CCCC[C@H]21 2224948464 IZGGYFMAYCJEAT-RBDSIQFVSA-N 262.353 2.102 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cnc2n1CCOC2 2235044030 WVEPTZGYYQOWJD-NSHDSACASA-N 273.336 2.316 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@@H](F)[C@H](O)C3)cc1OC 2235114415 AMBQRHAJEAJRTQ-APAOZMKASA-N 281.327 2.144 10 10 CECE COc1ccc(N2CCC([C@@H](F)CO)CC2)c(OC)c1 2235119726 KIKSKIVOCMATTN-ZDUSSCGKSA-N 283.343 2.251 10 10 CECE CNCc1cc(OC)ccc1N1C[C@@H](C)OCC[C@H]1C 2235977978 XMWQBWZWTGUVBZ-CHWSQXEVSA-N 278.396 2.418 10 10 CECE C[C@@H]1CC[C@H]1CN(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 2236136624 ZYMRZOVRABNOJY-ZETOZRRWSA-N 273.380 2.145 10 10 CECE CC1(NC(=O)c2cc(O)c(O)c(O)c2)CC2(CCC2)C1 2236488625 PFAKPYVXHGBSQR-UHFFFAOYSA-N 277.320 2.256 10 10 CECE O[C@H]1CN(c2ccc(OCC(F)F)cc2)CC1(F)F 2226742234 VNEWFGRKPGVEKR-JTQLQIEISA-N 279.233 2.147 10 10 CECE COc1ccc(N(C)[C@@H]2CCC[C@@H]2OC)c(CN)c1 2227671608 BGRKJGQTQLBEHQ-CABCVRRESA-N 264.369 2.158 10 10 CECE COc1ccc(N2CC(C(F)F)C2)c(C[C@@H](C)N)c1 2227686147 PBUNRROKMKGMPP-SECBINFHSA-N 270.323 2.286 10 10 CECE COc1ccc(N2CC[C@H](OC)[C@H](C)C2)c(CO)c1 2227711561 QMHFHPAWKKJRIG-ABAIWWIYSA-N 265.353 2.049 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H]3CC[C@H](O)[C@H]2CC3)cc1O 2238215792 SUYRGBVRRXPCMN-DRABBMOASA-N 276.380 2.165 10 10 CECE C[C@@H](C(N)=O)N(C)c1ccc(CNC2CCC2)c(Cl)c1 2240035041 HWPJVCPUFGLXJD-JTQLQIEISA-N 295.814 2.292 10 10 CECE CC[C@H](C)NCc1ccc(N(C)[C@H](C)C(=O)NC)cc1 2240037665 LEGKHWRUERJISV-QWHCGFSZSA-N 277.412 2.145 10 10 CECE Oc1ccc(CNC[C@H]2OCC[C@@H]2C(F)(F)F)cc1O 2240534975 LKMLUWCHPLBWRQ-JOYOIKCWSA-N 291.269 2.155 10 10 CECE CO[C@H]1CCN(c2ccc([C@H](C)N)cc2C)C[C@H]1OC 2240835220 HUJPRVZXARMJRS-VBNZEHGJSA-N 278.396 2.255 10 10 CECE NN[C@H](c1ccccc1O)c1cocc1Br 2244205590 LEPHAOLIJYIHTG-LLVKDONJSA-N 283.125 2.300 10 10 CECE Oc1cccc(CNC2CC3(CC(F)C3)C2)c1O 2254501641 FLLVPKBWKUNUQM-UHFFFAOYSA-N 251.301 2.468 10 10 CECE C[C@@H](CCN(C)C)N(C)Cc1cccc(F)c1O 2260326927 MSBYNIWTLWUFCC-NSHDSACASA-N 254.349 2.303 10 10 CECE CCN(C[C@@H](C)O)c1ccc(OC)c(C)c1OC 2263546018 UYYQIPBLKJZQLT-SNVBAGLBSA-N 253.342 2.219 10 10 CECE O[C@@H]1CCN(c2ccc(OCF)cc2)C12CCC2 2263853237 MZQIYWSDJTUQBY-CYBMUJFWSA-N 251.301 2.486 10 10 CECE CCOC1CC(NC(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2265427865 CPMAFLWIPOJWSE-TVUZUIDESA-N 267.333 2.085 10 10 CECE CCO[C@H]1C[C@H](NC(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2265438591 KGRZFCQQWVSQMP-DCAQKATOSA-N 267.333 2.038 10 10 CECE COC[C@@H]1CC[C@H](N(C)c2ccc(OC)cc2)C[C@H]1N 2279054656 RYROBSJDCNHHHR-DUVNUKRYSA-N 278.396 2.274 10 10 CECE COC(=O)c1c[nH]ccc1=NCc1cnc(SC)s1 2269121925 SQLPWTZENQNOMN-UHFFFAOYSA-N 295.389 2.081 10 10 CECE COc1ccc(N2C[C@H](O)C[C@H]3CCCC[C@@H]32)c(N)c1 2279550135 AMFQPBHREAUUIP-JMSVASOKSA-N 276.380 2.407 10 10 CECE CCCNCc1ccc(N2CC[C@]3(O)C[C@@H]3C2)c(C)c1 2280018102 OQESTJSEHLACAE-WBVHZDCISA-N 274.408 2.456 10 10 CECE COc1cc(N2CC[C@H](OC)CC23CC3)ccc1CO 2280608564 CBBWOELXVJCFGJ-AWEZNQCLSA-N 277.364 2.335 10 10 CECE c1cc(N2CCNCC2)ccc1CNCCCC1CC1 2286066525 UOFHDGILXPCOMF-UHFFFAOYSA-N 273.424 2.376 10 10 CECE CC[C@H](O)CN(C)c1ccc(CN)c(SC)c1 2308065111 FMXGSMMYUNXUEH-LBPRGKRZSA-N 254.399 2.074 10 10 CECE C[C@H](O)CCCN(C)c1ccc(CN)c(F)c1F 2314584511 XOWOKGXTPPKTMB-VIFPVBQESA-N 258.312 2.021 10 10 CECE CSc1ncc(CN[C@]2(C(=O)O)C[C@@H](C)[C@H]2C)s1 2323762282 URBNIKPHQVOLRR-DNSOKLHBSA-N 286.422 2.454 10 10 CECE COc1ccc(CN(C)[C@@H]2CCN(C)[C@H](C)C2)c(O)c1 93644993 QNWSMFQSPDYKGH-TZMCWYRMSA-N 278.396 2.315 10 10 CECE C[C@H](NC[C@H]1C[C@@H]2CC[C@H]1O2)c1ccc(O)cc1O 2330009699 ROXRCRCOYQZJND-NPZRNVLXSA-N 263.337 2.316 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@H]2C)cc1C1CC1 2339166284 OUXYWWKNEZUZIW-BZNIZROVSA-N 260.381 2.243 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1 2349954677 IZGKNTZFLAOMPP-MWNCTCPHSA-N 260.381 2.446 10 10 CECE CS[C@@H]1CC[C@H]1OCC(=O)N(C)c1ccc(N)cc1 2352364181 RBSONZQDENHHCX-CHWSQXEVSA-N 280.393 2.142 10 10 CECE NCCc1ccc2ccn(CCOCC(F)F)c2c1 2353411074 RHQIJKWTGWDEDX-UHFFFAOYSA-N 268.307 2.424 10 10 CECE CSc1cc(N2CC[C@@H]3OCC[C@@H]3C2)ccc1CN 2353854412 SQFRAXNOQKMGCZ-OCCSQVGLSA-N 278.421 2.482 10 10 CECE COc1ccc(O)c(CN(C)C[C@@H]2C[C@@H]3CC[C@H]2O3)c1 2355021859 JLBWOESCBWOHIL-DUVNUKRYSA-N 277.364 2.400 10 10 CECE CCOC(=O)CN(Cc1cc2c(cc1O)CCC2)C1CC1 102392680 PHULYXXPUOICHQ-UHFFFAOYSA-N 289.375 2.408 10 10 CECE Oc1ccc(F)cc1CN1[C@@H]2CC[C@@H]1CC(O)C2 179913627 YMNAKDYKHODXNX-VXGBXAGGSA-N 251.301 2.019 10 10 CECE Oc1cccc(CNCCOC2CCCC2)c1O 111634579 RMZVTMGZKXTSBX-UHFFFAOYSA-N 251.326 2.147 10 10 CECE O=C(N[C@@H]1C[C@@H]2[C@H]3CC[C@H](C3)[C@@H]12)c1ccc(O)c(O)c1 2357251725 XQGAKHHVDXTIQN-OPYVMVOTSA-N 273.332 2.262 10 10 CECE CCCCNC(=O)[C@@H](C)N(c1ccc(CN)cc1)C1CC1 34655521 JMPJRUSVIRKVRH-CYBMUJFWSA-N 289.423 2.419 10 10 CECE CN(Cc1ccccc1)[C@H](CN)c1ccc(O)cc1O 32048917 LQGJIRQEJBXWBT-OAHLLOKOSA-N 272.348 2.230 10 10 CECE Cn1ccc(Nc2ccc3c(c2)CCCN3)cc1=O 314567725 FLLBNDXVUWLOEX-UHFFFAOYSA-N 255.321 2.487 10 10 CECE CNC(=O)[C@@H]1CCCN1Cc1c(O)ccc2ccccc12 133595044 CGNWOEGRAXVRSA-HNNXBMFYSA-N 284.359 2.256 10 10 CECE CN1CCNC[C@H]1c1cc(Cl)cc(Cl)c1O 83443005 MKPTVYXPHMQHRW-JTQLQIEISA-N 261.152 2.275 10 10 CECE CC(C)c1ccc(O)c([C@H]2N[C@H](C(=O)O)CS2)c1 83236671 VYNUXJHDYCYYPJ-JQWIXIFHSA-N 267.350 2.304 10 10 CECE C[C@@H](CCc1ccco1)NC(=O)COc1ccc(N)cc1 49562746 DWJSTQCBTJFXSS-LBPRGKRZSA-N 288.347 2.378 10 10 CECE CN[C@@H](CO)c1cc(Cl)c(Br)cc1O 238359299 CLEVNDWPEJGHMJ-QMMMGPOBSA-N 280.549 2.061 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(CC(=O)O)CC1CC1 94622192 ZPNFNAULEDKMLU-VIFPVBQESA-N 267.300 2.389 10 10 CECE C[C@@H](NCC1COC1)c1ccc(Br)cc1O 528023446 DEAFGBSANFNNGT-MRVPVSSYSA-N 286.169 2.452 10 10 CECE CN(Cc1ccccc1O)[C@@H]1Cc2ccccc2[C@H]1O 245868984 RBSQWFADHBJVNR-NVXWUHKLSA-N 269.344 2.482 10 10 CECE C[C@@H](N)[C@H]1c2c(c(F)cc3ccn(C)c23)CCN1C 606596442 BLCSJMDDGQNCKZ-OTYXRUKQSA-N 261.344 2.194 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])C[C@H]2CC[C@H]1C2 250431185 RVLQJOHSAYRXNM-JBLDHEPKSA-N 252.318 2.008 10 10 CECE COC(=O)[C@H](C)Cc1cc(O)c(O)c(Br)c1 260244018 UGOCDXALGIYTDF-ZCFIWIBFSA-N 289.125 2.212 10 10 CECE C[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)c1cn[nH]c1 270127100 LOXBQWJOUDXOPR-LLVKDONJSA-N 287.367 2.036 10 10 CECE Cc1cc(Cl)cc(CN(C)CCN(C)C)c1O 289654832 CMMBJFYNZZTENS-UHFFFAOYSA-N 256.777 2.347 10 10 CECE CO[C@]1(CN(C)c2ccc(CO)cc2Cl)CCCOC1 2166169754 BYPHSIVCCMSBHZ-HNNXBMFYSA-N 299.798 2.464 10 10 CECE CN1CCCC[C@H]1CCC(=O)NCc1ccccc1O 806717507 IMLQAJXWAMGYLA-AWEZNQCLSA-N 276.380 2.273 10 10 CECE CN1CCc2cc(N3CC[C@H](N)C(F)(F)CC3)ccc21 2163070595 XSGVNIXUFJDLLI-AWEZNQCLSA-N 281.350 2.242 10 10 CECE CCCN[C@H](c1ccc(N(C)C)cc1)[C@@H]1COCCO1 2163070888 JSEBQWUGEATEOT-JKSUJKDBSA-N 278.396 2.209 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@@H](C)O)cc2F)C1 2165489063 BJZDWVWYDOTQRU-WXHSDQCUSA-N 283.343 2.119 10 10 CECE CC[C@@](O)([C@@H](N)c1ccc2c(c1)CCN2C)C(F)(F)F 2163129185 ZRFBPHUFURZKQF-QWHCGFSZSA-N 288.313 2.382 10 10 CECE CC[C@@H](COC)C[C@@H](NN)c1ccc2c(c1)CCN2C 2163144616 SAYPWCBYNVSXEQ-IUODEOHRSA-N 277.412 2.246 10 10 CECE CCOC[C@@](C)(O)[C@@H](N)c1ccc(N2CCCC2)cc1 2163241989 DMEVSMPKXQLMBV-JKSUJKDBSA-N 278.396 2.074 10 10 CECE CCOc1cnc(C(=O)CCc2ccc(N)cc2)nc1 2165655073 NIVJYUXGQHLLID-UHFFFAOYSA-N 271.320 2.273 10 10 CECE CO[C@@]1(CN(C)Cc2cccc(C)c2O)CCCOC1 2166144321 KTMFFYBMTLWLMC-MRXNPFEDSA-N 279.380 2.328 10 10 CECE CNC(=O)[C@@H](C)CN(C)c1ccc([C@@H](C)NC)c(Cl)c1 723149143 BTBMXGHCLNVOGT-WDEREUQCSA-N 297.830 2.439 10 10 CECE CCOc1cccc(CN2CCC3(COC3)C2)c1O 827644690 QLEJKOXMJYBNJE-UHFFFAOYSA-N 263.337 2.013 10 10 CECE Cc1ccc(O)c(CNCc2ncnn2C(C)C)c1 865639889 AVWYWNRDILKSSV-UHFFFAOYSA-N 260.341 2.163 10 10 CECE Cc1cc(Cl)cc(CNCCc2cn(C)cn2)c1O 839150579 ZHHAGYRHQKUWIF-UHFFFAOYSA-N 279.771 2.420 10 10 CECE CC[C@@H](C[C@H](C)O)NCc1c(O)cccc1OC 865871333 BPVSKBJSCQSOGO-QWRGUYRKSA-N 253.342 2.040 10 10 CECE CN(C)c1ccc(/C=C/CN2CC[C@](C)(CN)C2)cc1 843114950 LRKVVJNXSOHJTF-LAQIPUCWSA-N 273.424 2.437 10 10 CECE CN(C)c1ccc(/C=C/CN2CC[C@@]3(CCNC3)C2)cc1 843121054 ZRQIXWKNUMMDBC-OAJJDEHYSA-N 285.435 2.451 10 10 CECE C[C@@H](NC(=O)NCCc1ccc(N)cc1)c1cscn1 851662962 PAAVZABKQLCGKO-SNVBAGLBSA-N 290.392 2.328 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2C[C@@H](OC)C2)c1 858593231 WXGOWWOBFMGJAP-GMXVVIOVSA-N 293.363 2.254 10 10 CECE COC[C@H]1CCCN1c1ccc(/C=C\C(=O)O)cc1 696565901 JMDYKQVULPDOAX-DEBLGDTFSA-N 261.321 2.400 10 10 CECE C[C@H]1C[C@@H]1NC(=N)NCc1cccc(Br)c1O 864464816 IPDZMPFECTWJHP-XVKPBYJWSA-N 298.184 2.177 10 10 CECE Cc1ccc(C(=O)N2CCC(=O)CC(C)(C)C2)c(O)c1O 862773259 YCXRPVGVHSPVHW-UHFFFAOYSA-N 291.347 2.238 10 10 CECE CN1CCC[C@H]1CNCc1cc(Cl)cc(F)c1O 776099455 RMSWKDUSGKIJKY-NSHDSACASA-N 272.751 2.369 10 10 CECE CC(C)SC[C@H](N)C(=O)N[C@H](C)c1ccccc1O 1877595845 ODKIRNIGRCLACL-PWSUYJOCSA-N 282.409 2.038 10 10 CECE C[C@@H](c1ccccc1O)N(C)C[C@@H]1CCCC(=O)N1 1877518740 XQWNMJABGIFUPK-RYUDHWBXSA-N 262.353 2.054 10 10 CECE C[C@@H](N=c1cc[nH]cc1[N+](=O)[O-])c1ccccc1O 1877587669 PNJMELQFFBZYDO-SECBINFHSA-N 259.265 2.290 10 10 CECE NCc1ccc(N(CC2CC2)C2COC2)c(F)c1F 1879151545 DBVVONGSIZFUNH-UHFFFAOYSA-N 268.307 2.039 10 10 CECE Cc1ccc(O)cc1NC(=O)Cc1ccc(O)c(O)c1 1171489817 NBPCBZSHKQGLKP-UHFFFAOYSA-N 273.288 2.293 10 10 CECE CNCc1ccc(N(C)C[C@]23C[C@H](CO2)C3)c(F)c1 1879896651 URWZQOFVPMUCLK-JNSHFYNHSA-N 264.344 2.160 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@]12CCOC[C@@H]1C2 1880196841 YUCZMIGSQGXFDM-HZMBPMFUSA-N 269.291 2.187 10 10 CECE C[C@H](O)c1cc(F)c(N2CC(OC(F)F)C2)c(F)c1 1880480620 XYTRBDNBIXHLBH-LURJTMIESA-N 279.233 2.446 10 10 CECE O=C(c1cc(O)c(O)c(O)c1)N1CCCC(F)(F)CC1 1148580447 GFEYWLVAPLZXFE-UHFFFAOYSA-N 287.262 2.065 10 10 CECE CSC(C)(C)CNC(=O)CCOc1ccc(N)cc1 133753255 QVVDQLVQPXGJAE-UHFFFAOYSA-N 282.409 2.296 10 10 CECE C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963705055 YJDAOLLBVBEJPT-SNVBAGLBSA-N 299.375 2.306 10 10 CECE CCCN(C1CCC1)S(=O)(=O)Cc1ccc(N)cc1 1888627953 FTYNBJYJLZSILK-UHFFFAOYSA-N 282.409 2.363 10 10 CECE CC[C@H]1CN(CCC(C)=O)c2cc3c(cc2N1)OCO3 76928992 XKDWRBMPCPDTLH-NSHDSACASA-N 276.336 2.405 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC([C@H]3CCNC3)C2)c1 1886866587 GIWGGFPBKXVGKU-STQMWFEESA-N 260.381 2.303 10 10 CECE CN(CCCCCO)c1ccc2c(c1)OCCO2 1964196849 QJFKLCZVGFUTIL-UHFFFAOYSA-N 251.326 2.057 10 10 CECE Nc1ccc(CN2CCO[C@H](c3nccs3)C2)cc1 1963537807 IFRVRBCSTDXVFJ-ZDUSSCGKSA-N 275.377 2.299 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ccc2c(c1)OCCCO2 701292228 XSMSXVPBOMMWLJ-UHFFFAOYSA-N 276.296 2.278 10 10 CECE Nc1ccc(CNC(=O)c2cc(Cl)ccn2)cc1 701365239 WHRRZKIGMJWGNY-UHFFFAOYSA-N 261.712 2.247 10 10 CECE CCN(CC)c1ccc(CNC(C)(C)CO)c(O)c1 83493310 JYCIPHVGFXDLSW-UHFFFAOYSA-N 266.385 2.099 10 10 CECE COc1cc(OC)c2c(c1)[C@@H](C)CN2CCC(=O)O 84802031 RWCINPJOPATSJK-VIFPVBQESA-N 265.309 2.102 10 10 CECE C[C@@H](NC[C@]1(C)CCCO1)c1ccc(O)cc1O 94798185 DPAIAJAQXPLKFO-YGRLFVJLSA-N 251.326 2.318 10 10 CECE C[C@H](NC1CCC(C)(O)CC1)c1c(O)cccc1O 703549640 ORWYCIPOEORWCV-NLTNOIMHSA-N 265.353 2.442 10 10 CECE NC[C@@H]1CCC[C@H](NCc2ccc3c(c2)CCO3)C1 1964655050 WRDWNDWNVRJMJX-DOMZBBRYSA-N 260.381 2.229 10 10 CECE CN(Cc1ccc(N)cc1)Cc1nn(C)cc1Cl 1964655254 DZHSVJMLFKTSEB-UHFFFAOYSA-N 264.760 2.288 10 10 CECE CCc1cccc(CNCCN(CC)CC)c1O 691485036 YCFNIQCIPMQPKT-UHFFFAOYSA-N 250.386 2.386 10 10 CECE CCN(c1ccc(OC)cc1[N+](=O)[O-])[C@H](C)CC(=O)O 61182148 QRYOURXSUQTTSC-SECBINFHSA-N 282.296 2.293 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H](C)c2cnn(C)c2)cc1O 710526887 VCNVSICZRGYGSO-QWRGUYRKSA-N 275.352 2.376 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@]3(CCOC3)C2)cc1O 687920074 AMLJXQIKJDASDS-ABAIWWIYSA-N 263.337 2.062 10 10 CECE Cn1cc(COc2ccc(N)cc2)c(Br)n1 714082326 VNHUCHXCOBWFGV-UHFFFAOYSA-N 282.141 2.344 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC1CC(C(N)=O)C1 716687856 SUNQVFNTJILVDF-HBIQZDMRSA-N 274.364 2.102 10 10 CECE COc1ccc(C(=O)N2CCC[C@H]2CN=[N+]=[N-])cc1O 692857159 XFABJKPIZYYOAR-JTQLQIEISA-N 276.296 2.316 10 10 CECE CCNCc1ccc(N(C)C[C@@H](O)C2CC2)cc1C 690257456 HWVPUWWKKAPUQM-MRXNPFEDSA-N 262.397 2.312 10 10 CECE CCOc1cccc(CNc2cn(C)nc2OC)c1O 788971540 LPJBTOQBMBQQNH-UHFFFAOYSA-N 277.324 2.145 10 10 CECE C[P@]1(=O)C[C@H](O)[C@@H](N2CCCC[C@H](CN=[N+]=[N-])C2)C1 2116369534 WTIWQFDQJSEGHE-FCOUNWEESA-N 286.316 2.135 10 10 CECE CCCNCc1ccc(N2CCO[C@H]3C[C@H]32)c(F)c1 2115158850 NNSZCIFTCRJEAA-CABCVRRESA-N 264.344 2.303 10 10 CECE 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2.319 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])C1CC(C)(C)C1 1912166679 AKACTMJCDMXKRR-JTQLQIEISA-N 254.334 2.254 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@@H]2[C@@H](C1)C2(F)F 1912147313 XFONFEMQFHOGMJ-KKZNHRDASA-N 288.298 2.253 10 10 CECE C[C@@H]1CCCN(C(=O)CN2CCC(CN=[N+]=[N-])CC2)C1 1912161193 GCKVTPXLCTXINH-GFCCVEGCSA-N 279.388 2.267 10 10 CECE [N-]=[N+]=N[C@@H]1CCN([C@H]2CCOC3(CCOCC3)C2)C1 1912202554 JCDIAKQIDKHYQT-NEPJUHHUSA-N 266.345 2.099 10 10 CECE Cc1ccc(C(=O)N2CCC(N=[N+]=[N-])CC2)c(O)n1 1912204193 VJVNPPLEUHVQPO-UHFFFAOYSA-N 261.285 2.011 10 10 CECE Cc1cc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)sn1 1912204876 LVDHVWPSVCRVDX-QMMMGPOBSA-N 251.315 2.224 10 10 CECE C[C@@H](O)c1ccc(N(C)C2CC3(COC3)C2)c(F)c1 2125778937 SMGPYBNQTDNZFT-SNVBAGLBSA-N 265.328 2.494 10 10 CECE CN(c1ccc(CN)cc1)C1CC(n2ccnc2)C1 2125775742 RVWVOCKFLZDJPK-UHFFFAOYSA-N 256.353 2.182 10 10 CECE CCNCc1ccc(N2CC3(C2)CC(C)(O)C3)cc1 2126888433 JHCSYXFXBAODRA-UHFFFAOYSA-N 260.381 2.147 10 10 CECE 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290.407 2.433 10 10 CECE Nc1ccc(CCNCC(F)(F)[C@@H]2CCOC2)cc1 2128945803 LBEBJCAYAORIGA-GFCCVEGCSA-N 270.323 2.073 10 10 CECE CCc1cc(CNC[C@@H](C)CC(=O)O)ccc1OC 258900951 ODVNBYLALMTELI-NSHDSACASA-N 265.353 2.458 10 10 CECE CNC(=O)[C@@H](Cc1ccc(N)cc1)c1ccccc1 20227939 ZNBVFSUQARBFJA-HNNXBMFYSA-N 254.333 2.341 10 10 CECE Oc1ccc(CNc2ccc3c(c2)OCO3)c(O)c1 19966221 LHAOIDWBGAZXCZ-UHFFFAOYSA-N 259.261 2.439 10 10 CECE C[C@@]1(C(=O)O)CCCN(c2ccc3c(c2)OCO3)C1 259416702 SSJPDWSJRYBKQS-CQSZACIVSA-N 263.293 2.106 10 10 CECE CC(C)CN(CC1=C[C@@H](O)[C@H](N)C1)c1ccccc1 2131478699 STSNVFULVKTNSN-HZPDHXFCSA-N 260.381 2.167 10 10 CECE C[C@H](O)c1ccc(N2CCn3nncc3C2)c(Cl)c1 2130070531 BHJXKBKTOYIVGP-VIFPVBQESA-N 278.743 2.005 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)[C@H]1CCOC[C@@H]1F 2130198540 CAPFCJZQMYJGDA-KKUMJFAQSA-N 264.344 2.196 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@H]2OC)c([N+](=O)[O-])c1 2131631154 QBVHXLKYOOVPLT-NOZJJQNGSA-N 266.297 2.075 10 10 CECE CN1C[C@H]2CN(Cc3ccc(Cl)cc3O)C[C@H]2C1 1140466150 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CN[C@@H](C)c1ccc2c(c1)CCCN2C[C@H](C)CO 252915210 ALSQLWYGMGZWSL-STQMWFEESA-N 262.397 2.348 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2COCCO2)cc1Cl 2143687579 PNJWBXGPYCKOFF-DGCLKSJQSA-N 298.814 2.472 10 10 CECE Nc1ccc(CCC(=O)NC2([C@H]3CCCO3)CC2)cc1 2143902962 LYBSVIRUUCXJSC-CQSZACIVSA-N 274.364 2.029 10 10 CECE COc1ccccc1OC[C@@H](N)c1ccccc1O 258074406 IWABTVAAGPUEON-GFCCVEGCSA-N 259.305 2.480 10 10 CECE CCOc1cccc(CNCc2cn(CC)cn2)c1O 2144314927 TWBKQPOXAKJOPJ-UHFFFAOYSA-N 275.352 2.297 10 10 CECE Cc1c(C[C@H]2CCCCN2)ccc(O)c1CN(C)C 258350372 FBIYZHUKCVLBSB-CQSZACIVSA-N 262.397 2.447 10 10 CECE COC(=O)CC[C@H](N)c1cc2ccccc2cc1O 260353860 SQFAAYVVGQAEHL-ZDUSSCGKSA-N 259.305 2.498 10 10 CECE Cc1ccc(-c2cc(C#N)[nH]n2)c(O)c1CN(C)C 260919970 ZGYCAZVJTCMTNM-UHFFFAOYSA-N 256.309 2.024 10 10 CECE Nc1ccc(OCCC[S@@](=O)C[C@@H]2CCCOC2)cc1 2145513286 JMIDQSGCGJIPKG-ZUOKHONESA-N 297.420 2.213 10 10 CECE Nc1ccc(OCCC(=O)NC2C[C@@H]3CC[C@H]3C2)cc1 2145678066 GHIRLMFDZYNNCT-RYUDHWBXSA-N 274.364 2.343 10 10 CECE 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275.348 2.193 10 10 CECE CN1CC[C@H](N(C)c2ccc(/C=C/C(=O)O)cc2F)C1 312684612 LQXWEUSXKOBIFH-FUEXJSSKSA-N 278.327 2.064 10 10 CECE CN1CC[C@@H](CN(C)c2ccc(CN)cc2Cl)C1 71187583 OPHKWKPWAKTZKH-GFCCVEGCSA-N 267.804 2.187 10 10 CECE CNCc1cc(F)c(N(C)[C@@H]2CCCC[C@@H]2O)c(F)c1 132060408 QRCYLWZCLGLUHV-KGLIPLIRSA-N 284.350 2.424 10 10 CECE CCCNCc1ccc(N(C)CC(=O)NC2CC2)c(F)c1 42691842 FKSVRNVBTFZMDB-UHFFFAOYSA-N 293.386 2.040 10 10 CECE CCN(Cc1cccc(OC)c1O)[C@@H](C)CC(=O)O 86763183 PMCAZKRMQBBYMC-JTQLQIEISA-N 267.325 2.086 10 10 CECE CCCN(CCn1cccn1)c1ccc(CN)cc1 49313922 GJPHKLBARUMHKZ-UHFFFAOYSA-N 258.369 2.258 10 10 CECE Nc1ccc(CCN2CCOc3ccccc3C2=O)cc1 228200107 DLINLJXHWZYTNL-UHFFFAOYSA-N 282.343 2.346 10 10 CECE COc1ccc(N(C)CC[C@](C)(NC2CC2)C(=O)O)cc1 49972100 PGDDIQUWOVNENO-INIZCTEOSA-N 292.379 2.117 10 10 CECE CC(C)[C@@H](CCO)N[C@H](C)c1cc(O)ccc1O 231072545 ODBSEWIAUZWHFK-ZWNOBZJWSA-N 253.342 2.155 10 10 CECE COc1cc(O)c(CN[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc1OC 529670091 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Oc1ccc(F)cc1CNC[C@H]1CCn2nccc2C1 2165200511 JWSGAGUAFMRAHL-NSHDSACASA-N 275.327 2.080 10 10 CECE CC[C@@H]1CCOCC[C@H]1NCc1ccc(O)c(O)c1O 2165393280 MKBNDGKKMULGOO-ZYHUDNBSSA-N 281.352 2.098 10 10 CECE C[C@H]1CCC2(CC2)N(c2ccc3c(c2)NC(=O)[C@H]3N)C1 2168991106 KQDXVXLZEAKUTL-HZMBPMFUSA-N 271.364 2.407 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@]2(C)CO)cc1O 722978748 NMMRCWGZTBGGQK-ABAIWWIYSA-N 264.369 2.024 10 10 CECE COc1c([N+](=O)[O-])ccc(CN2CC[C@H]2C2CC2)c1O 824650684 OWNJUDKOLDMEHA-NSHDSACASA-N 278.308 2.293 10 10 CECE CCc1cccc(CN[C@@](C)(CCF)C(=O)OC)c1O 827352723 OCMRQSVTPPIYHP-HNNXBMFYSA-N 283.343 2.336 10 10 CECE Cc1cc(C)cc(N(C)C(=O)c2c[nH]nc2[C@H]2CCNC2)c1 662522915 GSKWIKINRHERGW-ZDUSSCGKSA-N 298.390 2.380 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@]2(C)CO)cc1O 723033340 XPVTXHDPWQFTCK-XHDPSFHLSA-N 265.353 2.187 10 10 CECE CCN(CC)c1ccc(CN(C)C[C@](C)(O)C(C)=O)cc1 827337205 TZFDCULZPSBBDY-KRWDZBQOSA-N 292.423 2.305 10 10 CECE CC(C)[C@@H](CO)NC/C=C/c1ccc(N(C)C)cc1 835043133 NEDACPCHLVIUSK-SQRWCISFSA-N 262.397 2.372 10 10 CECE CC(C)(C)n1ccc(C(=O)NCc2ccccc2O)n1 847589554 JRIWCLDMIGLZMP-UHFFFAOYSA-N 273.336 2.274 10 10 CECE CCN(C)c1ccc([C@@H](C)NC[C@](C)(CO)OC)cc1 848558240 KOVWHXWRBOLIQL-CZUORRHYSA-N 280.412 2.191 10 10 CECE Cc1cc(N(C)C)ccc1CN1CC[C@H]2CN(C)C[C@@H]21 840950944 ULUJZNPZBBTFDM-RDJZCZTQSA-N 273.424 2.197 10 10 CECE O=C1O[C@@H](CNCc2cccc(Cl)c2O)CN1C1CC1 848928143 ADUQBQVLVGDOCH-NSHDSACASA-N 296.754 2.118 10 10 CECE CCOc1ccc(CN2C[C@@H]3[C@H](C2)C3(F)F)c(O)c1 846110307 GLCOEFGBKBPGDS-TXEJJXNPSA-N 269.291 2.488 10 10 CECE COc1ccc(N(C)C[C@H](OC)[C@@H]2CCOC2)c(OC)c1 851864855 MEKZWEXEGGPMMN-WBMJQRKESA-N 295.379 2.192 10 10 CECE Cc1cc(N2CCO[C@](C)(C(F)F)C2)ccc1CO 698725224 CHHRPVAWHGDHAQ-AWEZNQCLSA-N 271.307 2.348 10 10 CECE Cc1ccn([C@H](C)CC(=O)N2Cc3cccc(O)c3C2)n1 871205755 KRMHQNHBOHXXIE-GFCCVEGCSA-N 285.347 2.391 10 10 CECE CCOc1cccc(CN2CCSC[C@H]2CCO)c1O 770305713 JIYZEODFKBBEHM-CYBMUJFWSA-N 297.420 2.091 10 10 CECE Nc1ccc(CN=c2[nH]c3c(N)cccc3o2)cc1 1876390566 PHJZMRVHWWZZLR-UHFFFAOYSA-N 254.293 2.026 10 10 CECE C[C@](F)(CNCc1ccc(O)c(O)c1O)C(F)(F)F 1876646316 UGIOASQQRWZVOP-JTQLQIEISA-N 283.221 2.184 10 10 CECE C[C@H](N[C@H](C)c1ccc(O)cc1O)c1ccn(C)n1 1876949073 ZDIHWUBNZDQBAR-ZJUUUORDSA-N 261.325 2.243 10 10 CECE CC(=O)C(C)(C)CCC(=O)NCc1cccc(O)c1O 1123977959 MZUQSSVJUOULCR-UHFFFAOYSA-N 279.336 2.109 10 10 CECE CN(CCCF)C(=O)c1ccc(N=NC(N)=O)cc1 899814083 FCOMBRBVHSWJCK-UHFFFAOYSA-N 266.276 2.281 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC(C)(N(C)C)C2)c(F)c1 1880930169 YVONYIGVLAAIEN-SECBINFHSA-N 269.339 2.125 10 10 CECE O=C(N[C@H](c1cccnc1)C1CC1)c1cccc(O)c1O 790904924 HXLIWRSTSDYPPM-AWEZNQCLSA-N 284.315 2.374 10 10 CECE CCN(CC)C[C@@H](C)NCc1c(O)cccc1F 1964037231 IBCWELVVMOPBKM-LLVKDONJSA-N 254.349 2.351 10 10 CECE O=[N+]([O-])c1cc(N2CC(SC(F)F)C2)ccc1CO 1887041734 LNQNKFLHDIAHAS-UHFFFAOYSA-N 290.291 2.232 10 10 CECE CN(Cc1ccccc1O)c1cc(O)nc(C2CC2)n1 2192597000 ZNRJDCTYICGZHV-UHFFFAOYSA-N 271.320 2.402 10 10 CECE CC[C@@]1(c2cc(OC)ccc2O)COC(C)(C)CN1 83482262 CIXWHAWRXIOBEB-HNNXBMFYSA-N 265.353 2.405 10 10 CECE Oc1ccc(CNCc2cccc(F)c2)c(O)c1O 83458268 XXRMLZOVZUQOCO-UHFFFAOYSA-N 263.268 2.232 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)CC[C@@H](C)O 135584171 YNPKZUZUXDVDJV-CYBMUJFWSA-N 262.397 2.454 10 10 CECE O=Cc1ccc(O)c([C@H]2NCCc3cccc(O)c32)c1 83659670 WBEDNEKBPKKWMO-MRXNPFEDSA-N 269.300 2.145 10 10 CECE CN(Cc1ccccc1O)C(=O)c1sccc1N 40331974 BITGNUBESDQGQD-UHFFFAOYSA-N 262.334 2.308 10 10 CECE CCOc1cccc([C@@H](NCCN=[N+]=[N-])C(=O)O)c1 90256316 KIVUWBWZXLEWQA-LLVKDONJSA-N 264.285 2.111 10 10 CECE Nc1ccc(OCCN2CCO[C@H](C(F)F)CC2)cc1 687573606 PZRFJOLGANUFBR-ZDUSSCGKSA-N 286.322 2.004 10 10 CECE CC[C@H](NCc1cccc(Br)c1O)[C@@H](C)O 395711934 HCGJAIYATHPOMV-KCJUWKMLSA-N 288.185 2.404 10 10 CECE Oc1ccc(CNC[C@@H]2CC23CCOCC3)c(O)c1 1894128129 KCJJDOSLFAJSGZ-LBPRGKRZSA-N 263.337 2.004 10 10 CECE CCN(Cc1cc(Cl)cc(OC)c1O)C[C@H](C)N 1964652191 BVFYZTKDFKRMBW-VIFPVBQESA-N 272.776 2.223 10 10 CECE C[C@@H]1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)[C@@H]1C 1324276227 NZIJYZZTPFOJHC-ZIAGYGMSSA-N 291.414 2.418 10 10 CECE CN(C)c1ccc(CN(C)[C@@H]2C[C@H]3CN[C@@H](C3)C2)cc1 709028384 ZTCTUAAIANBLKG-YQQAZPJKSA-N 273.424 2.325 10 10 CECE C[C@H]1CCc2cc(N3CC[C@H](CC(N)=O)C3)ccc2N1 690731066 HHSQPNLBOCXPTB-NWDGAFQWSA-N 273.380 2.135 10 10 CECE Oc1cccc2c1[C@@H](NCCO[C@@H]1CC1(F)F)CC2 690723677 BFRBYWQWZNCAIV-CMPLNLGQSA-N 269.291 2.393 10 10 CECE CN(C)c1ccc(CNCC[C@@H](O)C(F)(F)F)cc1 717413375 SENACNUPJGHBEJ-GFCCVEGCSA-N 276.302 2.156 10 10 CECE [N-]=[N+]=NCCCN1CCC[C@@](O)(C(F)(F)F)C1 718910196 OLWCJEVNSUXURO-QMMMGPOBSA-N 252.240 2.076 10 10 CECE C[C@H]1CC[C@H](OCC(=O)N(C)c2ccc(N)cc2)C1 721575352 IMRYILRUWSCJIV-FZMZJTMJSA-N 262.353 2.437 10 10 CECE c1cc(N2[C@H]3CC[C@H]2COC3)ccc1CNC1CC1 695039010 XLDJDGIRXKMRBD-HOTGVXAUSA-N 258.365 2.306 10 10 CECE Nc1ccc(OCCCN2CCO[C@H](C3CC3)C2)cc1 822249975 LKQUBOBWEWEAPB-INIZCTEOSA-N 276.380 2.149 10 10 CECE COc1cccc(CNC[C@@H]2CCCC[C@H]2CO)c1O 89523958 ULZPMYCYHKWBTH-JSGCOSHPSA-N 279.380 2.289 10 10 CECE C[C@@H]1CN([C@@H](CN)c2ccc(N(C)C)cc2)C[C@@H]1C 92082864 JPXRPSAPWYPMSM-ZENOOKHLSA-N 261.413 2.340 10 10 CECE Cc1ccsc1CNS(=O)(=O)Cc1ccc(N)cc1 94873724 SAHNGHPIBSZXKV-UHFFFAOYSA-N 296.417 2.258 10 10 CECE CC[C@](Cc1ccccc1)(NCCCN=[N+]=[N-])C(N)=O 97500084 JOVGJPUGWFCWDJ-CQSZACIVSA-N 275.356 2.153 10 10 CECE C[C@@H](NCc1ccc(O)c(O)c1O)[C@@]1(C)CC1(F)F 2116106182 UXSRNUQDQLZWBX-JMCQJSRRSA-N 273.279 2.327 10 10 CECE CN[C@H](C(=O)N(C)[C@@H](C)c1ccccc1O)C(C)C 2118385377 LLZZXYSSZNGLFV-FZMZJTMJSA-N 264.369 2.156 10 10 CECE CC(C)(C)n1cc(C=C2SC(=S)NC2=O)cn1 2297323414 NSUWMMJMOKIACI-UHFFFAOYSA-N 267.379 2.127 10 10 CECE Cn1nc(C2CC2)cc1[C@@H](O)Cc1ccc(N)cc1 2121807470 VNYMNPVGRYPKBK-HNNXBMFYSA-N 257.337 2.156 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1Cc1ccc([N+](=O)[O-])cn1 2123017208 FNDCPMRPWXTOKK-SNVBAGLBSA-N 262.273 2.265 10 10 CECE CC[C@H](C)CCNC(=O)Cc1ccc(O)c(O)c1 1641042798 VDNWXWFYWWRRHE-JTQLQIEISA-N 251.326 2.193 10 10 CECE O=C(NCc1ccc(O)cc1O)c1scnc1Cl 1570462507 WDISPFMYEJXTRD-UHFFFAOYSA-N 284.724 2.138 10 10 CECE CCC[C@H](C)NC(=O)CN1CCC[C@@H](CN=[N+]=[N-])C1 1912198638 JBOGLOSSRSILCR-RYUDHWBXSA-N 267.377 2.314 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1coc(C(F)(F)F)n1 1912158792 ZFUMAEVGOGJRRB-UHFFFAOYSA-N 277.206 2.466 10 10 CECE CC1(C)CC(CS(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)C1 1912162382 VKCNOHGQCBEMCZ-JTQLQIEISA-N 272.374 2.137 10 10 CECE Cc1csc(C)c1S(=O)(=O)N(C)CCN=[N+]=[N-] 1912151678 KCWQRGIIYXEVPZ-UHFFFAOYSA-N 274.371 2.296 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@]12CCC[C@@H](C1)OC2 1912179200 QTICJGGKCYGQTD-JQWIXIFHSA-N 252.318 2.152 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2c(F)cccc2F)C1 1912158155 VYWZZZGSQSFSCQ-ZETCQYMHSA-N 252.224 2.490 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@@H]2CCC[C@H](C1)N2 2125907740 UAEIKZCTGUAGLI-RTXFEEFZSA-N 264.344 2.419 10 10 CECE CN[C@@H]1CCCc2cc(N3CCC[C@H]3CO)ccc21 2128278194 BTKKBVLBPXQHPA-GOEBONIOSA-N 260.381 2.245 10 10 CECE N[C@H]1CCc2cc(N3CC(OCC(F)F)C3)ccc21 2128329027 SGUQUVGJUJQWCV-ZDUSSCGKSA-N 268.307 2.103 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@]4(CCO4)C3)ccc21 2128308581 GOOTWWGDHDIMOT-JKSUJKDBSA-N 258.365 2.263 10 10 CECE N[C@H]1CCc2cc(N3CC[C@H]4OCC[C@H]4C3)ccc21 2128317278 CVHWGOVDYIFFIE-VBNZEHGJSA-N 258.365 2.248 10 10 CECE CCCN1N=C(C)/C(=C\c2ccc(OC)c(O)c2)C1=O 1865664193 FIIHYPKXIPXYQK-XYOKQWHBSA-N 274.320 2.412 10 10 CECE CCCC1=NN(C)C(=O)/C1=C/c1ccccc1C(=O)O 1865674104 OEHWFDDTSBWOMZ-FMIVXFBMSA-N 272.304 2.396 10 10 CECE C/C(Nc1ncccc1C)=C1\SC(=S)NC1=O 100999742 FITHRZQQQPYMJP-BQYQJAHWSA-N 265.363 2.181 10 10 CECE CN(C)c1ccc([C@]2(N)CO[C@H](C(F)(F)F)C2)cc1 2129079617 JHBKTVDAJLVNHL-NWDGAFQWSA-N 274.286 2.258 10 10 CECE Nc1ccc(CCN2CCCC3(CC(O)C3)C2)cc1 2129546538 CCLIDQAVRFLYBI-UHFFFAOYSA-N 260.381 2.048 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H]3COC[C@H]32)c1O 2129799901 SEVHGLDXFCFTQX-GXFFZTMASA-N 281.739 2.079 10 10 CECE Nc1ccc(CNC[C@H]2C[C@](O)(C(F)(F)F)C2)cc1 2131597584 KQCDBKSTLREQCE-KLPPZKSPSA-N 274.286 2.062 10 10 CECE C[C@H](O)c1ccc(N2CC[C@H](CO)C23CC3)c(F)c1 2133812534 WYXXYGXFTBGTBY-CMPLNLGQSA-N 265.328 2.230 10 10 CECE CC[C@@H]1CCOCCN1C(=O)Nc1ccc(N)cc1 1913592811 BUNANISPINWABG-CYBMUJFWSA-N 263.341 2.302 10 10 CECE CN1CCc2cc([C@H](N)C34CC(C)(CO3)C4)ccc21 2140272391 ZMRYXJQXUKOABV-FHERZECASA-N 258.365 2.248 10 10 CECE C[C@H](c1ccc(Cl)cc1O)N(C)[C@H]1CCCNC1=O 2138551409 ARFRZOHJEBGVLO-SKDRFNHKSA-N 282.771 2.317 10 10 CECE CC[C@@H]1C[C@@H]1[C@H](O)[C@@H](NC)c1ccc(N(C)C)cc1 2135154971 ZJTSUQLKPDQHNB-MEYUZBJRSA-N 262.397 2.420 10 10 CECE COCCNCc1ccc(N2CCC[C@H]3C[C@H]32)cc1 1916845558 CGPSOLSBDYILNH-GOEBONIOSA-N 260.381 2.411 10 10 CECE CCOc1cccc(-c2noc(-c3nnsc3N)n2)c1 1923203511 LOBNNSYPLRNLQJ-UHFFFAOYSA-N 289.320 2.236 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1ncccc1F 1925642451 FZRWEFXCVQDDQT-UHFFFAOYSA-N 259.284 2.075 10 10 CECE COc1ccc(O)c(CNC[C@H]2CCC(F)(F)CO2)c1 1967824311 HBRQSIDZHBHCPS-GFCCVEGCSA-N 287.306 2.305 10 10 CECE COc1cccc(O)c1CNC[C@@]12CC[C@@](C)(CO1)C2 1967892458 XSZQKQNGDVBWLP-CVEARBPZSA-N 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[N-]=[N+]=NC[C@@H]1CCCCN(C(=O)NC2CCOCC2)C1 2197928921 ROAQLFIZDQIZSL-NSHDSACASA-N 281.360 2.287 10 10 CECE CC[C@H](N)c1ccc(N2CCCC[C@@H]2CC(N)=O)cc1 2183265744 OCTXBWZDVSFGQA-CABCVRRESA-N 275.396 2.331 10 10 CECE Nc1ccc(OC[C@H](O)CS[C@@H]2CCC[C@H](O)C2)cc1 2189935948 ZEIFQIHTVMOWEG-KCQAQPDRSA-N 297.420 2.045 10 10 CECE CO[C@@H]1C[C@@H](C(=O)NCC2(CN=[N+]=[N-])CC2)C12CCC2 2190370007 HKWFNWXYSVJJHJ-WDEREUQCSA-N 278.356 2.398 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H](C)N(C)[C@H](C)C3)ccc21 2184719642 RHNNAIHHWLBGIG-IIYDPXPESA-N 273.424 2.422 10 10 CECE CN[C@@H]1CCc2cc(N(C)[C@@H](CCO)C(F)F)ccc21 2184727899 RYHZQFKAXCKLGS-KGLIPLIRSA-N 284.350 2.346 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@@H]2C[C@H](OC)C[C@H]21 2190526976 WGUZDAIJJZBMSF-CIQGVGRVSA-N 277.364 2.304 10 10 CECE COC[C@@]12C[C@@H]1CN(c1c(F)cc([C@@H](C)N)cc1F)C2 2194694918 PHWCZSWYPUBLIZ-OSQNNJELSA-N 282.334 2.457 10 10 CECE Cc1cc(OCc2ccc(N)cc2)cc(C(=O)O)c1N 2198907137 BURSALQDWJNXSB-UHFFFAOYSA-N 272.304 2.437 10 10 CECE c1cc2c(cc1N1CCO[C@H]3CCNC[C@@H]31)CCCC2 2185528680 IYISBYNRELRRNS-IRXDYDNUSA-N 272.392 2.133 10 10 CECE Cc1cc(CN(C)c2ccc(CN)c(F)c2)nnc1C 2185744193 LUNVCLCYCSHVHM-UHFFFAOYSA-N 274.343 2.328 10 10 CECE CN[C@H](C)c1cnc(Sc2nc(O)ncc2F)s1 2041813232 JHCDSQONJLMBEK-RXMQYKEDSA-N 286.357 2.209 10 10 CECE CN(C)CC1CC2(CCN2CCCCN=[N+]=[N-])C1 2042723384 ISTVRXWWUJLFRE-UHFFFAOYSA-N 251.378 2.493 10 10 CECE COc1ccc(O)c(CNC[C@H](C)n2ccnc2C)c1 2186043671 YITVIYXVJYQQKF-NSHDSACASA-N 275.352 2.257 10 10 CECE CN(Cc1ccc(N)cc1)c1ccc(N)c2nsnc12 2191599518 CGRHIDWBRDUFNM-UHFFFAOYSA-N 285.376 2.492 10 10 CECE CC(C)[C@@H](CCN)[C@H](O)c1ccc(N(C)C)cc1 2044711784 WRXUIZHJTMMDSC-HUUCEWRRSA-N 250.386 2.407 10 10 CECE CC(C)c1c[nH]nc1CNCc1ccc(O)cc1O 2100938512 YFCDFCXWLLZBGJ-UHFFFAOYSA-N 261.325 2.234 10 10 CECE CC[C@@H](N)CN(CC)c1ccc2c(c1)OCCO2 2053078223 QCUBCCFFDNGHDV-LLVKDONJSA-N 250.342 2.021 10 10 CECE C[C@H]1CCC[C@@H]1S(=O)(=O)N1CCC(N=[N+]=[N-])CC1 2055210912 SEJMPXWHGVBKHT-ONGXEEELSA-N 272.374 2.280 10 10 CECE CC[C@](C)(NC(=O)Cc1ccc(N)cc1)C(F)F 2059388313 MDHUZHGMLZKCGP-ZDUSSCGKSA-N 256.296 2.361 10 10 CECE Cc1cc(CNC2CC2)ccc1N1[C@H]2C[C@@H]1CN(C)C2 2187627052 RVFKZESJBWRMEJ-IYBDPMFKSA-N 271.408 2.140 10 10 CECE C[C@@H](NC(=O)C(C)(C)[C@H](N)C1CC1)c1ccccc1O 2192628598 YRUVMAWVYOCIBH-QMTHXVAHSA-N 276.380 2.333 10 10 CECE CCCN=c1[nH]ccc(=N[C@@H](C)c2ccccc2O)[nH]1 2192627979 WLZKOLJMTSCFCG-NSHDSACASA-N 272.352 2.021 10 10 CECE C[C@@H]1CCCN(S(=O)(=O)N[C@H](C)c2ccccc2O)C1 2192627625 UVKKLFWIHVCOEC-VXGBXAGGSA-N 298.408 2.020 10 10 CECE CC(C)(C)[C@@H]1C(=O)NCCN1c1ccc(CO)c(Cl)c1 2196518124 ZMZHLPTVAJULBO-ZDUSSCGKSA-N 296.798 2.183 10 10 CECE Cc1ncn(C)c1[C@H](O)c1ccc(N2CCCC2)cc1 2188542985 MJOKNYPURMNCGG-MRXNPFEDSA-N 271.364 2.410 10 10 CECE CNCc1ccc(N2CCC[C@H]2[C@H](C)O)cc1Cl 2073314669 IHTUUBDKIBNIPL-HZMBPMFUSA-N 268.788 2.409 10 10 CECE CP(C)(=O)Cc1noc(-c2ccc(O)c(O)c2)n1 2073682853 ZZMDQOLPGLQVGC-UHFFFAOYSA-N 268.209 2.271 10 10 CECE C[C@@H]1O[C@H](c2ccc(O)c(O)c2)N[C@@H]1C(F)(F)F 2074726927 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2096116760 YKJGHQCRERLGEX-IUODEOHRSA-N 265.353 2.479 10 10 CECE Nc1ccc(OCCNC(=O)[C@H]2C=CCCC2)cc1 2096830236 PEVQWUFZXPENHL-LBPRGKRZSA-N 260.337 2.120 10 10 CECE CNCc1ccc(N2CCCN(C(C)C)CC2)cc1 2113698292 WAQBQBFEDWTZIX-UHFFFAOYSA-N 261.413 2.327 10 10 CECE Cc1cccc(CNC[C@]2(O)CCOC(C)(C)C2)c1O 2203257113 GHVKBUHNEZBYPJ-INIZCTEOSA-N 279.380 2.110 10 10 CECE C[C@@H](c1ccc(Cl)cc1O)N1CCN2C(=O)CC[C@H]2C1 2203366764 YKYIDMZLFUTZSG-JQWIXIFHSA-N 294.782 2.413 10 10 CECE CN[C@@H](C)CC1CCN(Cc2ccc(O)c(O)c2)CC1 2203617538 ZPLZOTHFDOJLHJ-LBPRGKRZSA-N 278.396 2.308 10 10 CECE CO[C@H](CNCc1cc(C)ccc1O)CSC 2213592715 UMLIDDHWVCUWSH-GFCCVEGCSA-N 255.383 2.168 10 10 CECE Cc1cc(CN)ccc1N1CC[C@@H]2CC[C@@H](O)C[C@@H]2C1 2204091437 ZVFRHVCOTGHFRP-ARFHVFGLSA-N 274.408 2.441 10 10 CECE COc1cc(N2CC[C@H](n3cccc3)C2)ccc1CO 2204547305 JFJZFJGJCRDDTQ-HNNXBMFYSA-N 272.348 2.440 10 10 CECE CCNCc1ccc(N2CCC[C@@H](CO)C2)cc1OC 2204546567 BXMYSYPNEFNQOC-CYBMUJFWSA-N 278.396 2.013 10 10 CECE O=C(O)C[C@H]1CC[C@H](NCc2ccc(O)cc2O)CC1 2205441551 XMEAXZVFBZXRCT-UMSPYCQHSA-N 279.336 2.221 10 10 CECE Cc1ccc([C@H](C)N[C@H]2COC3(CCC3)[C@@H]2O)c(O)c1 2206470815 JWQBHKFWDYJEKG-CORIIIEPSA-N 277.364 2.034 10 10 CECE [N-]=[N+]=NCCN1CCC[C@@H](OC(F)(F)CF)C1 2216729766 OIDOIRMRRDPJFG-MRVPVSSYSA-N 252.240 2.340 10 10 CECE CO[C@H](CNCc1cnc(SC)s1)C1CC1 2208650314 JPZHVGGRCSKLQG-SNVBAGLBSA-N 258.412 2.380 10 10 CECE CO[C@H](C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-])C1CCC1 2218736911 CJYWQLNBKGGVRN-DCAQKATOSA-N 252.318 2.149 10 10 CECE COc1ccc(N2CCC=C[C@H]2CO)c(F)c1F 2219771181 LLVOCBOVPMPTOS-VIFPVBQESA-N 255.264 2.101 10 10 CECE Nc1cc(NS(=O)(=O)c2ccc(Cl)o2)ccc1O 2220568042 JUELUKSEOZHVLS-UHFFFAOYSA-N 288.712 2.022 10 10 CECE COC[C@@]12CCC[C@H]1CN(c1ccc(CO)cc1)C2 2231354163 CFLYCOUYZIOBPB-HOCLYGCPSA-N 261.365 2.432 10 10 CECE CN[C@H](C)c1ccc(N2CC(C[S@](C)=O)C2)c(C)c1 2232097020 XMUACSGSJGDUGC-BLVKFPJESA-N 280.437 2.090 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1CCCCC[C@H]1C(=O)O 2234165329 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CNc1ccccc1C(=O)NCc1ccc(O)cc1O 1142530133 MKMYMNUBNRLNGW-UHFFFAOYSA-N 272.304 2.070 10 10 CECE Nc1ccc(OCC(=O)NCCCC(F)(F)F)cc1 133919691 VAWNMKHUYBNPKR-UHFFFAOYSA-N 276.258 2.106 10 10 CECE CC(C)(C)OC(=O)N[C@@H](CC1CC1)C(=O)NCCN=[N+]=[N-] 1885562702 JPXDSIVBYLWBNR-JTQLQIEISA-N 297.359 2.106 10 10 CECE C[C@H](CN)c1nc2cc(N)ccc2n1-c1ccc(N)cc1 76038370 OLCYFYBPAQWIIX-SNVBAGLBSA-N 281.363 2.252 10 10 CECE COc1ccc(CN[C@@H]2CCC[C@H](C(N)=O)C2)cc1C 1964051446 ANEYBCCUVILMCH-UONOGXRCSA-N 276.380 2.137 10 10 CECE CC[C@@H](C)[C@@H](C(=O)O)N(C)Cc1cc(OC)ccc1O 1963158951 LCSRFBNOAQTZQO-YGRLFVJLSA-N 281.352 2.332 10 10 CECE CCN(CC)C(=O)CSCc1ccc(N)cc1 58236665 SNEYYQZVVXNEJN-UHFFFAOYSA-N 252.383 2.370 10 10 CECE COc1ccc2c(c1O)[C@@H](c1ccc(O)cc1)NCC2 83620613 JBGDCLMWFVYYMW-OAHLLOKOSA-N 271.316 2.342 10 10 CECE O=C(O)c1cc(NCc2ccccc2O)cc(C(=O)O)c1 84848009 KKENRDCCXXVWGL-UHFFFAOYSA-N 287.271 2.401 10 10 CECE C[C@]1(COC(=O)Cc2ccc(N)cc2)CC1(F)F 701831996 BALXGHUMYXIVPW-GFCCVEGCSA-N 255.264 2.400 10 10 CECE 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Cc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)s1 1630309430 PVSDUNRUUPJLHP-UHFFFAOYSA-N 277.345 2.327 10 10 CECE O=C(NCc1ccc(O)cc1O)c1cc2occc2[nH]1 1638352533 RSWSBBKUMSCEEY-UHFFFAOYSA-N 272.260 2.102 10 10 CECE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H](O)C1CC1 1587552811 ZYQUEDMYPWCNHV-MRXNPFEDSA-N 288.391 2.016 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NS(=O)(=O)c1ccsc1 2213591508 GZBLTMHDJDVLCH-DTWKUNHWSA-N 272.355 2.258 10 10 CECE COc1cccc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)n1 2125335775 FLPORKFAWFOLQI-SECBINFHSA-N 261.285 2.005 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)c2cnns2)C1 1912144256 QHYHQFVLRFJHFJ-MRVPVSSYSA-N 266.330 2.091 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])C[C@H]2CCC[C@H]21 1912167563 MIWVXXJCFKNDGC-FOGDFJRCSA-N 252.318 2.008 10 10 CECE CN1CC[C@H]2CCN(CCCCN=[N+]=[N-])C[C@H]2C1 1912187761 JKULMNIYDNHMSJ-QWHCGFSZSA-N 251.378 2.351 10 10 CECE CCOC1CC(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)C1 1912162693 ZHTDMKFGOZQHBE-UNXYVOJBSA-N 266.345 2.350 10 10 CECE Cc1nc(C=CC(=O)N(C)CCN=[N+]=[N-])cs1 1912199816 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273.424 2.281 10 10 CECE CCN[C@@H]1CCc2cc(N3CC(C)(C)[C@@H]3CO)ccc21 2184711325 QDKMMRHHACAIKH-CVEARBPZSA-N 274.408 2.491 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CC[C@H]3O)CCC1(F)F 2184739419 GQZSUHSKSCMOON-KGLIPLIRSA-N 283.318 2.263 10 10 CECE O[C@H]1C[C@H]2CC[C@@H]([C@@H]1F)N2c1ccc2c(c1)CC[C@H]2O 2190692745 OBKMBYOOJCNSRG-GAUGTXIDSA-N 277.339 2.106 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](CO)C23CC3)c(F)c1 2194697552 OTVSISAABDHINI-GXSJLCMTSA-N 282.334 2.336 10 10 CECE CC(C)(C)N(CC(=O)O)Cc1c(O)cccc1F 2042630495 CLLMUSPWBDSAQQ-UHFFFAOYSA-N 255.289 2.216 10 10 CECE COc1ccc(N2CCC[C@H](N)[C@H]2C)cc1OC 2044333108 XJFXCPMSCPYDJK-PWSUYJOCSA-N 250.342 2.020 10 10 CECE C[C@@H]1C[C@@](O)([C@H](N)c2ccc(N(C)C)cc2)CS1 2044747769 IDFNTHFOAABXGP-HONMWMINSA-N 266.410 2.009 10 10 CECE COc1ccc(N(C)[C@@H]2CNCC[C@H]2C)cc1F 2045214489 WJSWUISRJGOUEJ-ZWNOBZJWSA-N 252.333 2.269 10 10 CECE CC[C@@H](COC)N(C)Cc1ccc(OC)cc1O 2047295831 AUJNOYSJXUGAOT-LBPRGKRZSA-N 253.342 2.258 10 10 CECE 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293.088 2.276 10 10 CECE OCCN(Cc1cc(Cl)c(F)cc1O)C1CC1 295351122 NGCJTUMFDWWFIS-UHFFFAOYSA-N 259.708 2.141 10 10 CECE CN(C)CCN(C)Cc1cc(Cl)c(F)cc1O 293951950 PDFHSCQOXKWCCN-UHFFFAOYSA-N 260.740 2.178 10 10 CECE CCOC(=O)COCCN(C)c1ccc(OC(C)C)cc1 809989071 XEGUYEYPNABMMU-UHFFFAOYSA-N 295.379 2.490 10 10 CECE O[C@@]1(c2ccc(N3CCCCC3)cc2)CCNC12CC2 2163096706 JRGZAYIPTZRQOK-QGZVFWFLSA-N 272.392 2.390 10 10 CECE CCN(CC)c1ccc([C@@H](NN)[C@H]2CCCN2C)cc1 2163111191 PQQINBLYQKVABB-HZPDHXFCSA-N 276.428 2.131 10 10 CECE O=C(NCc1cc(Br)ccc1O)c1ccon1 804734570 RDSLBNMHNOPUBM-UHFFFAOYSA-N 297.108 2.073 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)CCCOc1ccc(N)cc1 724197597 KVUBXBJCDXAMPI-LSDHHAIUSA-N 264.369 2.147 10 10 CECE COC[C@]1(C)COCCN1[C@@H](C)c1cc(F)ccc1O 2168248925 OOMNJPSHPZHNKG-XHDPSFHLSA-N 283.343 2.330 10 10 CECE CC(C)C[C@@H](C(=O)O)[C@H](O)c1ccc2c(c1)CCN2C 2166980463 RHFHMBWDPJTCJX-UKRRQHHQSA-N 277.364 2.459 10 10 CECE Oc1cccc2c1[C@H](N1C[C@H]3[C@@H]4CC[C@@H](O4)[C@H]3C1)CC2 718226891 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CN(Cc1ccccc1O)c1ccnc2ccnn12 1877516900 AVRNPQIDLUFXLK-UHFFFAOYSA-N 254.293 2.071 10 10 CECE C[C@@H](N)c1cccc(N(C)Cc2ccccc2O)n1 1877523247 DPBDPJOZJOGVTE-LLVKDONJSA-N 257.337 2.443 10 10 CECE C[C@@H]1OC2(CN(C)c3ccc(CN)c(F)c3)CC1C2 1878423481 IITLLUITJPRSRA-VLRKGOCCSA-N 264.344 2.288 10 10 CECE O=C(c1cc(O)cs1)N1CC[C@@H]([C@H]2CCCO2)C1 899627251 GYLJIDHSLZWMNO-MWLCHTKSSA-N 267.350 2.095 10 10 CECE C/C(=C/c1cccnc1)C(=O)N1C[C@@H](C)Cn2nccc21 893880372 MAPHCXIWYOTHHZ-YFBAIUBQSA-N 282.347 2.364 10 10 CECE C[C@H](O)c1cc(F)c(N(C)CC(F)(F)CO)c(F)c1 1880478814 IOIAXROAFSHPHC-ZETCQYMHSA-N 281.249 2.082 10 10 CECE Cc1nnc(Sc2ncc([C@@H](C)N)s2)s1 1958551698 MKWFWISVBOOQFO-SCSAIBSYSA-N 258.397 2.474 10 10 CECE [N-]=[N+]=NCCOCCOCCOCc1ccc(CO)cc1 1083814961 SEGSGPCWJVPIGN-UHFFFAOYSA-N 295.339 2.039 10 10 CECE CCOc1cccc(CN[C@H]2CCN(C)C[C@@H]2C)c1O 134408659 DXIYRPOXPZTCCL-JSGCOSHPSA-N 278.396 2.221 10 10 CECE CCc1cccc(CN[C@@H]2CC[C@H]3CN(C)C[C@H]32)c1O 1462667909 LYJNYRZNWMYPIC-ARFHVFGLSA-N 274.408 2.384 10 10 CECE COc1ccc(N2CCCN(C)C(C)(C)C2)cc1N 84629701 NMLCRARIEQAQFQ-UHFFFAOYSA-N 263.385 2.198 10 10 CECE Nc1ccc2c(c1)[C@@H](c1c(O)cccc1F)NCC2 75750937 SXBNSLONYVQBAR-HNNXBMFYSA-N 258.296 2.349 10 10 CECE COc1cc2c(cc1OC)N(CCN)CC1(CCCC1)N2 76930846 CAXFFHXFNUDQSL-UHFFFAOYSA-N 291.395 2.207 10 10 CECE Cc1ccc(CN2CCC(C)(C)[C@@H]2C(=O)O)c(O)c1 1963050094 SGIZZLBFABFSJD-ZDUSSCGKSA-N 263.337 2.386 10 10 CECE O=C(NCc1cc(O)ccc1O)C1(F)CCCCC1 1176754267 ADNRDOOJENMUDJ-UHFFFAOYSA-N 267.300 2.386 10 10 CECE Nc1ccc(CCNC[C@H]2C[C@@]23CCCOC3)cc1 1894142801 SPOFDWXMQVVCPH-GDBMZVCRSA-N 260.381 2.218 10 10 CECE O=C1Nc2cc(N3CCC34CCCC4)c(F)cc2[C@H]1O 687864767 IAEAXZFSCRGVJT-CYBMUJFWSA-N 276.311 2.334 10 10 CECE Oc1cccc(F)c1CNC[C@H]1CC12CCOCC2 1894235124 LXCGZECWQPSMMV-LLVKDONJSA-N 265.328 2.438 10 10 CECE Oc1cccc(Cl)c1CNC1CN(CC(F)F)C1 1970963660 CNYHKLQYIKCALS-UHFFFAOYSA-N 276.714 2.085 10 10 CECE C[C@H](N)c1ccc(N2CCCC[C@@H]2C(N)=O)c(Cl)c1 688515306 YZPZQLKLNSNNEN-TVQRCGJNSA-N 281.787 2.204 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@](C)(CO)C2)cc1O 688605367 SFFPXBHJLQTPQS-ABAIWWIYSA-N 264.369 2.011 10 10 CECE CSC[C@H]1CCN(c2cc3c(cc2N)OCCO3)C1 706679265 LRNSSGGKVRHNJH-JTQLQIEISA-N 280.393 2.229 10 10 CECE Oc1cccc(Br)c1CN[C@H]1CCC[C@@H]1O 706804247 GMUASOBRVCPEHY-JQWIXIFHSA-N 286.169 2.158 10 10 CECE CN(C(=O)CN1C[C@@H]2CCCC[C@@H]21)c1ccc(N)cc1 706810050 JCSNFNKFGYGKAA-WFASDCNBSA-N 273.380 2.106 10 10 CECE CNCc1ccc(N2CCN(C)C[C@@H](C)C2)c(C)c1 707538301 FODKPYFJIAXSRK-CYBMUJFWSA-N 261.413 2.102 10 10 CECE CCc1cccc(CN2CCCN(C)C[C@@H]2C)c1O 692129992 QOCVYKKWOGNIOF-ZDUSSCGKSA-N 262.397 2.481 10 10 CECE CNCc1cc(F)c(N2CCO[C@@H]3CCC[C@@H]32)c(F)c1 62718568 CHUVUIPECLQQKH-UONOGXRCSA-N 282.334 2.442 10 10 CECE CC[C@@H]1[C@H](C(=O)O)CCN1[C@@H](C)c1cc(O)ccc1O 690639158 FUHGFYZAKHGJMU-UFGOTCBOSA-N 279.336 2.344 10 10 CECE COC[C@H](CN(C)c1ccc([C@@H](C)O)c(Cl)c1)OC 691382473 QSESSNHNOITSNB-PWSUYJOCSA-N 287.787 2.491 10 10 CECE C[C@H](NCC[C@@H]1CCCS1(=O)=O)c1ccccc1O 714383945 XBBBYUWWSPJBDU-RYUDHWBXSA-N 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C[C@H](CC(F)(F)F)NC(=O)c1ccc(O)c(O)c1 231901837 ZWHPISFZYAIOEM-ZCFIWIBFSA-N 263.215 2.169 10 10 CECE CN[C@H]1CCCc2nc(-c3ccc(O)c(O)c3)ncc21 234500251 AGVQWXNORQBIHE-NSHDSACASA-N 271.320 2.152 10 10 CECE NN[C@H](c1ccccc1O)c1ccncc1Br 1942390603 LFPZNSNSSMULTR-LBPRGKRZSA-N 294.152 2.102 10 10 CECE OC[C@@H](CNCc1cccc(Cl)c1O)C1CC1 1942317341 FTWBOTSLDHCXOH-LLVKDONJSA-N 255.745 2.154 10 10 CECE Nc1cccc(F)c1NC(=O)c1ccc(O)c(O)c1 236338511 BVPQHXWHZQUTAF-UHFFFAOYSA-N 262.240 2.071 10 10 CECE CC(=O)[C@@H](N)c1ccc(NC(=O)OC(C)(C)C)cc1O 1952508247 GVUJEIBOPORTHE-GFCCVEGCSA-N 280.324 2.328 10 10 CECE CCOC(=O)[C@H](OC)C1(COc2ccc(N)cc2)CC1 1952719170 QJUZJLJDAYPBGQ-ZDUSSCGKSA-N 279.336 2.006 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H]3C[C@H]2C[C@H]3OC)c1 1974113053 DWTAAUGJNRBHNO-KYXHQGGESA-N 277.364 2.304 10 10 CECE CO[C@H]1[C@H](NCc2ccc(F)cc2O)CC1(C)C 1974299832 PWXJJPHTMBELQC-YPMHNXCESA-N 253.317 2.434 10 10 CECE C[C@H]1CO[C@@H](CN(C)Cc2ccc(F)cc2O)C1 1974415519 QNXIWWRMHXNVCG-ZWNOBZJWSA-N 253.317 2.388 10 10 CECE Cc1c(O)c([C@@H](N)CC(=O)O)c(C)c2c1CCCC2 258375776 HVVIICGPZVAMOZ-LBPRGKRZSA-N 263.337 2.362 10 10 CECE Nc1ccc(OCC(=O)N2CCC[C@@H](C(F)F)C2)cc1 2149793939 RLSDIJQYVGFRGA-SNVBAGLBSA-N 284.306 2.151 10 10 CECE Nc1ccc(CC(=O)OCC2(Br)CC2)cc1 1980161862 MPXRWCIENXMHFF-UHFFFAOYSA-N 284.153 2.282 10 10 CECE Cc1cc(C(=O)O)c(Sc2nccs2)nn1 1981046875 JAYPZDPBNNNFTI-UHFFFAOYSA-N 253.308 2.091 10 10 CECE COC(=O)C1(c2cc(C)c(C)c(O)c2O)CCC1 260265663 RSEQKCAHTDFZMP-UHFFFAOYSA-N 250.294 2.309 10 10 CECE C[C@H](Nc1c(N)cccc1Br)[C@H]1CCNC1 1989345054 LNHCICAIOYCCPP-IUCAKERBSA-N 284.201 2.441 10 10 CECE CCOC(=O)c1cnc(SCCCNC)s1 1990278299 ZJTZOQLRPCOXPN-UHFFFAOYSA-N 260.384 2.021 10 10 CECE CC[C@@H]1CCCCN1C[C@H](O)COc1ccc(N)cc1 37082735 IIVAEFLYUZMNAC-CABCVRRESA-N 278.396 2.273 10 10 CECE CNCc1ccc(N2CC[C@@H](O)C(F)(F)CC2)c(F)c1 2150038695 HTFBMSAANYDFTG-CYBMUJFWSA-N 288.313 2.142 10 10 CECE Oc1ccc(Br)cc1CN1C[C@H]2CCO[C@H]2C1 2004629068 ISKFBWLNZPHBHY-RNCFNFMXSA-N 298.180 2.375 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](C(N)=O)CC[C@H]2C)cc1 42429211 BQKWSTVCTARYBR-BZPMIXESSA-N 275.396 2.057 10 10 CECE COc1ccc(CNC[C@H](CC(C)C)N(C)C)c(O)c1 40906035 IQIAKFQWVJINSR-AWEZNQCLSA-N 280.412 2.467 10 10 CECE CC(F)(F)C1CN(c2cc3c(cc2N)NC(=O)CC3)C1 2151459550 BCEZPGBBBAKTOM-UHFFFAOYSA-N 281.306 2.245 10 10 CECE C[C@H]1CC[C@H](CNC(=O)CCOc2ccc(N)cc2)S1 2151676864 YKDWRQLAARFWGK-SMDDNHRTSA-N 294.420 2.438 10 10 CECE COc1ccc([C@H](C)N[C@H](C(=O)O)C(C)C)c(O)c1 43430296 UIHLQUDZVOKYDA-ZANVPECISA-N 267.325 2.161 10 10 CECE Cn1nc(CN2CCC[C@@H]2CN=[N+]=[N-])cc1Br 2009445639 QJLZQPJMYXVUJQ-SECBINFHSA-N 299.176 2.457 10 10 CECE Cc1cc(N2CCS(=O)CC2)ccc1CNC(C)(C)C 50583963 JOGMPRIVJSJWLW-UHFFFAOYSA-N 294.464 2.452 10 10 CECE C[C@@H](NCc1c(O)cccc1F)c1nncs1 2020931421 LZLLTXBDTDGFJO-SSDOTTSWSA-N 253.302 2.234 10 10 CECE CCSC1CN(c2ccc(CN)c(OC)c2)C1 2024759643 CZFHTUOFQYMTLX-UHFFFAOYSA-N 252.383 2.096 10 10 CECE OCc1ccc(N2CC[C@@]3(CCCO3)C2)c(F)c1 2028406812 PVDIUGWEZPRTAL-AWEZNQCLSA-N 251.301 2.077 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C(CO)[C@H]3C2)c(Cl)c1 2030272737 LVDUCQQUJGOGGD-LSJOCFKGSA-N 267.756 2.068 10 10 CECE CC1([C@H](NCc2cc(Cl)ccc2O)C(=O)O)CC1 2032663818 OLELZJUNZDJLGF-LLVKDONJSA-N 269.728 2.389 10 10 CECE Nc1ccc(NS(=O)(=O)C2[C@H]3CCCC[C@H]23)cc1 2033541143 NABZGGOKIGQZKS-RYUDHWBXSA-N 266.366 2.199 10 10 CECE C[C@H](CC(=O)O)CC(=O)N(C)[C@@H](C)c1ccccc1O 61836794 QWBSGYGEYZYQGX-QWRGUYRKSA-N 279.336 2.413 10 10 CECE C[C@@H](O)c1ccc(N2CC(N3CCC3)C2)c(Cl)c1 2034794529 ADPTVUIQQPJEJS-SNVBAGLBSA-N 266.772 2.288 10 10 CECE Oc1ccc(CN[C@@H]2CCC[C@H](F)C2)c(O)c1O 2034890013 BRHZYOOMORZLKF-VHSXEESVSA-N 255.289 2.174 10 10 CECE Nc1ccc(NC(=O)N2CC(C(F)(F)F)C2)cc1 2034849157 JRSQHVDILARMHP-UHFFFAOYSA-N 259.231 2.295 10 10 CECE CC1(C)OCCC[C@@H]1NCc1ccc(O)cc1O 2036256758 KQRPPLNZSNUUHR-ZDUSSCGKSA-N 251.326 2.145 10 10 CECE CC(C)Cn1ncnc1[C@H](O)CCc1ccc(N)cc1 2159654475 ZCCYNWKZZUQMCU-CQSZACIVSA-N 274.368 2.183 10 10 CECE CC[C@H](C)[C@H](O)CNCc1ccc(N(C)C)cc1 304012584 BUGLGWCORZEKOK-SWLSCSKDSA-N 250.386 2.249 10 10 CECE C[C@H]1CN(C(=O)COc2ccc(N)cc2)C[C@H](C)S1 70381528 VLHLHSKHMWNILX-QWRGUYRKSA-N 280.393 2.000 10 10 CECE COc1ncccc1C(=O)N1CCC[C@H](N=[N+]=[N-])C1 403633611 FVHVIMFAJZYCRC-VIFPVBQESA-N 261.285 2.005 10 10 CECE Cc1cc(C)c(S(=O)(=O)NCCCN=[N+]=[N-])s1 310130308 AEEKYWIJPICQBE-UHFFFAOYSA-N 274.371 2.344 10 10 CECE CN(C[C@@H]1C[C@@H]1C(F)F)C(=O)COc1ccc(N)cc1 2159758966 NCHKHAGEKCIHRA-CABZTGNLSA-N 284.306 2.007 10 10 CECE COc1cccc(CN[C@@H]2CCC[C@H]3OCC[C@@H]23)c1O 2160440018 ZNNMFMFKJSYAKZ-BFHYXJOUSA-N 277.364 2.448 10 10 CECE O=C(O)c1cc(O)ccc1NS(=O)(=O)CCC1CCC1 312222943 AVGFCSFMIPMPPA-UHFFFAOYSA-N 299.348 2.022 10 10 CECE CN(C)CC[C@H]1CCN(c2c(F)cc(CO)cc2F)C1 700840527 KWOOWASEILTSCA-NSHDSACASA-N 284.350 2.235 10 10 CECE COCCO[C@H]1CCCN(c2ccc([C@H](C)O)cc2)C1 2158832667 IXYPSISTTSBWDW-BBRMVZONSA-N 279.380 2.372 10 10 CECE COC[C@@]1(OC)CCCN(Cc2c(O)cccc2F)C1 2160770712 QLEWBNNVIKNOHW-OAHLLOKOSA-N 283.343 2.159 10 10 CECE O=C(O)[C@@]12CCC[C@H]1CN(Cc1c(O)cccc1F)C2 2160794132 OEUBVYHWGZKSOM-ZUZCIYMTSA-N 279.311 2.218 10 10 CECE Cc1cccnc1[C@@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2161642949 QJVMDLNQIBMJPC-ZBFHGGJFSA-N 271.364 2.189 10 10 CECE CC[C@@H]1CC[C@@H]1N(C)c1cc2c(cc1N)OCC(=O)N2 2161958395 LMEGJSLPIJDXIG-SKDRFNHKSA-N 275.352 2.225 10 10 CECE CCOc1cccc(CN2CC[C@@H](OCC)C2)c1O 701661568 NNJSAJFJBMWYOG-CYBMUJFWSA-N 265.353 2.402 10 10 CECE CCNCc1ccc(N(C)C(COC)COC)c(F)c1 701748661 MQDDOEGGOAEKAC-UHFFFAOYSA-N 284.375 2.033 10 10 CECE CC[C@@H](c1ccccc1O)N1CC[C@](OC)(C(=O)O)C1 703782029 ATAOQPMGBIZVST-SWLSCSKDSA-N 279.336 2.019 10 10 CECE OCc1ccc(N2CC(O)(c3ccccc3)C2)c(F)c1 2177795057 YJJDUSNDHCXONG-UHFFFAOYSA-N 273.307 2.026 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2cnccn2)cc1O 704195405 BTFSAJJXSSWRPK-NSHDSACASA-N 272.352 2.099 10 10 CECE COC1CC(CN(C)c2ccc(CN)c(F)c2F)C1 705572177 MVXQMSKGJAYZMR-UHFFFAOYSA-N 270.323 2.285 10 10 CECE CCCOc1ccc(N2CCC(O)(CCN)CC2)cc1 2162667337 OOKNCGDGGCQTFU-UHFFFAOYSA-N 278.396 2.156 10 10 CECE CCOC(=O)CCCNCc1cc(F)cc(F)c1O 708216452 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381786257 MJDCPXLEBJMUSC-JTQLQIEISA-N 266.341 2.037 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@H]2CNC[C@@H]2C1 382421780 BTZVVSVEHLYULO-GRYCIOLGSA-N 264.344 2.134 10 10 CECE Cc1cccc(CN2C[C@H]3[C@H](N4CCCC4)[C@H]3C2)c1O 384557497 OMAYBFJKKAUWDS-ZSHCYNCHSA-N 272.392 2.227 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCNC[C@@H](C)C1 385299972 LHTOZCSYUSWQMO-MNOVXSKESA-N 252.333 2.134 10 10 CECE Cc1ncsc1CCNCCc1ccc(N)cc1 391279551 DZRBUAFQKZEZOF-UHFFFAOYSA-N 261.394 2.409 10 10 CECE CO[C@@H]1CCC[C@@H](Nc2c(N)cccc2C(N)=O)CC1 718328131 OQFIUNWIIQITON-GHMZBOCLSA-N 277.368 2.127 10 10 CECE Cc1ccc(O)c([C@@H](C)NC[C@@](C)(O)C(F)F)c1 698677042 JLOAHZSBDZMMOH-NOZJJQNGSA-N 259.296 2.367 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H]4C[C@H]4C3)c(Cl)cc21 699232035 RDTDQFXRNCKTMM-FZNYLWTLSA-N 291.782 2.399 10 10 CECE COc1ccc(N2[C@H](CN)C[C@H]3CCC[C@@H]32)cc1OC 2164799611 WQSRDDURKMFSIT-XBFCOCLRSA-N 276.380 2.410 10 10 CECE COCC(C)(C)c1noc(-c2sccc2O)n1 395453900 BLAKLIRPRYFGRH-UHFFFAOYSA-N 254.311 2.428 10 10 CECE 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313438807 AMWQGHIHJJOIHO-LBPRGKRZSA-N 279.336 2.129 10 10 CECE Cn1cc(NCc2ccc(N3CCCC3)cc2)nn1 701797082 COLGYYPVGCFFQY-UHFFFAOYSA-N 257.341 2.027 10 10 CECE COc1ccc([C@H](C)N[C@@H]2C[C@H]3C[C@H]2C[C@@H]3O)c(O)c1 2160695317 AKTPREQNTULAEG-LNNJMGJISA-N 277.364 2.211 10 10 CECE CC1(C)CCN(c2ccc(CN)c(F)c2)CC[S@@]1=O 321988200 KJKPYKXTWFSYMD-IBGZPJMESA-N 284.400 2.022 10 10 CECE CCN(C[C@@H](O)COc1ccc(N)cc1)[C@@H](C)C1CC1 324657038 ZDXVHNIEDBFTOQ-SWLSCSKDSA-N 278.396 2.129 10 10 CECE Cc1nc2n(c1C)CCN(Cc1c(O)cccc1F)C2 2171224958 BLZJJZIHPZJLKW-UHFFFAOYSA-N 275.327 2.360 10 10 CECE Oc1c(CN[C@H]2CCCC[C@H]2O)ccc(F)c1F 700765692 QYLNNRFWDYMEEK-WDEREUQCSA-N 257.280 2.064 10 10 CECE C[C@H](N)c1ccc(N2C[C@]3(F)CCC[C@]3(CO)C2)cc1 2176642135 XBWRKPAVLJDNLB-APHBMKBZSA-N 278.371 2.397 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCCC[C@H](C(=O)O)C1 2179012429 FIDVSHMFFWJVRA-MNOVXSKESA-N 279.336 2.346 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])c1cncc(Cl)c1 703665874 STCWJEOTIXWJTN-SNVBAGLBSA-N 283.719 2.239 10 10 CECE 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285.250 2.269 10 10 CECE COC(=O)CC(C)(C)N[C@@H](C)c1ccccc1O 2072479179 GFGAPKFZKOINCQ-JTQLQIEISA-N 251.326 2.385 10 10 CECE Nc1ccc(CN(CC(F)(F)F)C2COC2)cc1 2075882958 YFVQBVQNMOWRAP-UHFFFAOYSA-N 260.259 2.032 10 10 CECE CC[C@H]1CC[C@@H](CNCc2cc3c(cc2O)OCO3)O1 2201418920 HHKIVJQTNCSYFL-RYUDHWBXSA-N 279.336 2.168 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@H]2C[C@@H]2C2CCOCC2)CC1 2200144734 BFRPLTIOXZTVDX-CHWSQXEVSA-N 278.356 2.350 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1C[C@H]2NCc1ccc(O)cc1O 2102407890 BDEHJNLITNHZKH-OICBVUGWSA-N 263.337 2.001 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1C[C@@H]2NCc1cccc(O)c1O 2102412809 UXZLXTDRSBHLFJ-UHXUPSOCSA-N 263.337 2.001 10 10 CECE CC[C@@H](N)c1ccc(N(C)Cc2noc(C)n2)cc1 2104151408 WWIKFYYJKFHLEG-CYBMUJFWSA-N 260.341 2.424 10 10 CECE Cc1ccc(CN2CC[S@@](=O)C(C)(C)C2)c(O)c1 2084096066 CPCPAZHREXYZGI-GOSISDBHSA-N 267.394 2.044 10 10 CECE COC(=O)[C@@H](CC(C)C)NCc1c(C)cccc1O 2104483928 LXUNIAXJSDPYPU-CYBMUJFWSA-N 265.353 2.378 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4CNC[C@H]4C3)cc21 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2.366 10 10 CECE CCC1(F)CN([C@H](C)C(=O)Nc2ccc(N)cc2)C1 2093410380 DDGSJUSKVNWOER-SNVBAGLBSA-N 265.332 2.030 10 10 CECE COc1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)sn1 2099333013 LUTVFDIINNABNU-QMMMGPOBSA-N 281.341 2.457 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@H]2CCC23CCC3)c1 2266157866 MAZNKBSAZVUMHK-GFCCVEGCSA-N 260.337 2.171 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@@H]2CC[C@]21C(=O)O 2201102167 NMSQEXBOLXHFSG-HFBDOXOYSA-N 277.320 2.098 10 10 CECE Cc1cccc(CNC(=O)[C@H]2CCCC[C@@]2(C)N)c1O 2204621209 MNDADIXBAKZERX-CZUORRHYSA-N 276.380 2.224 10 10 CECE Cc1cccc(CNC(=O)[C@H](C)CCC[C@@H](C)N)c1O 2204608754 DGVBTIZTUHJDJO-CHWSQXEVSA-N 278.396 2.470 10 10 CECE CSc1ncc(CNC(=O)c2ncc(N)cc2C)s1 2269315390 NQSLCVVMUPXJRX-UHFFFAOYSA-N 294.405 2.081 10 10 CECE C[C@H]1[C@@H](O)CN1c1ccc(OCC(F)(F)F)cc1 2219563586 UQPWDWSPYFNQHW-KWQFWETISA-N 261.243 2.197 10 10 CECE COc1ccc(N2CCCC[C@H](O)C2)c(F)c1F 2219769423 AHVHTPRLEYJPMO-VIFPVBQESA-N 257.280 2.325 10 10 CECE CC[C@H](N)c1ccc(N2CC=C[C@H]2CN(C)C)cc1 2230472089 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CCCN(C[C@H](C)O)c1ccc(CO)c(Cl)c1 2250511689 QFJAHGRDQZXQIE-JTQLQIEISA-N 257.761 2.430 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@H]2CCN(C)C[C@H]2C1 2240830193 MIPPZJCTFCCWSC-BMFZPTHFSA-N 274.408 2.436 10 10 CECE COc1cc(CSc2nccs2)cc(NN)n1 2252940874 AJJVWZIVBCBAIX-UHFFFAOYSA-N 268.367 2.125 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@]3(O)C[C@H]3C2)cc1Cl 2254034235 FHOWEODSQNTHCV-PKFCDNJMSA-N 267.756 2.354 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H]4C[C@H](C3)[C@]4(C)O)ccc21 2286199090 HPYJDZCHYWGYHB-GFOFROLCSA-N 272.392 2.100 10 10 CECE CC[C@@]1(CO)C[C@@H]1CNCc1cnc(SC)s1 2248734508 CUFVKOOYQNFHHA-SKDRFNHKSA-N 272.439 2.363 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c(C)c1 2270689055 CSVCPZDRNMZCJU-UYHMYPTGSA-N 260.381 2.092 10 10 CECE C[C@@H](N)c1ccc(N2CC(F)(F)C[C@@H]2CO)c(F)c1 2271890716 ALYPNLILOSWQPV-PSASIEDQSA-N 274.286 2.052 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1c(F)cc([C@@H](C)N)cc1F 2273223580 BDVNILUDJHWYOD-WQHBLYJGSA-N 270.323 2.334 10 10 CECE 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CECE CCN(CC)c1ccc([C@H](O)[C@@H]2[C@H]3CN[C@@H]2C3)cc1 2333045651 TUDCJXYIIKCJQX-MIGQKNRLSA-N 260.381 2.174 10 10 CECE CC1(C)COC[C@H]1COC(=O)Nc1ccc(N)cc1 2339080860 FACUGYUWABGZMV-JTQLQIEISA-N 264.325 2.490 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC(C[S@](C)=O)C2)c1C 2340847718 HMLNDMCVBRCTJV-BUXKBTBVSA-N 280.437 2.138 10 10 CECE CC(C)[C@H]1C[C@@H](O)CN1c1ccc([C@@H](C)N)cc1F 2344614364 PRVLVGWAXUYKHX-IXPVHAAZSA-N 266.360 2.441 10 10 CECE CO[C@H]1CN(c2ccc([C@H](C)N)cc2Cl)[C@@H]2COC[C@@H]21 2354358506 JPLKOUGCQJPBFI-NDMCHQMPSA-N 296.798 2.210 10 10 CECE C[C@H](N[C@H]1C[C@@H]2CC[C@@]1(CO)C2)c1ccc(O)cc1O 2354526975 QFQUMRWNLAPMET-GREKMHCPSA-N 277.364 2.300 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@H](CO)[C@@H]3C[C@H]23)c(O)c1 2354931279 SOQRIAMGVHJKPV-BBYPGIKZSA-N 277.364 2.068 10 10 CECE CN[C@H]1CCCc2cc(N3C[C@@H](F)[C@H](OC)C3)ccc21 2356171161 VPPNAUMAQOFSGT-OWCLPIDISA-N 278.371 2.457 10 10 CECE Nc1ccc(N2CCN(CCc3ccccn3)C2=O)cc1 54405009 LJUOVDCAPFOGPY-UHFFFAOYSA-N 282.347 2.149 10 10 CECE CCN(CC)C(=O)CCNCc1ccc2c(c1)CCN2C 50286710 QJISXVWWDYDTAO-UHFFFAOYSA-N 289.423 2.027 10 10 CECE CC(C)CN1C(=O)CC[C@@H](N)[C@@H]1c1ccc(N(C)C)cc1 62212625 JBTHJWIZYXODQJ-WBVHZDCISA-N 289.423 2.399 10 10 CECE N#Cc1ccc(CNC(=O)c2cccc(O)c2O)cc1F 404574238 MUAZWXHMCPOIER-UHFFFAOYSA-N 286.262 2.039 10 10 CECE CC1(C)C[C@@H](NC(=O)CCOc2ccc(N)cc2)CCO1 215798191 QWXPGTSMDLLXTI-ZDUSSCGKSA-N 292.379 2.112 10 10 CECE CCOc1ccc(O)c(CN[C@H]2C[C@@H](O)C2(C)C)c1 189341631 GYKLGVOEWGYJOK-UONOGXRCSA-N 265.353 2.040 10 10 CECE [N-]=[N+]=NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl 34669721 KBPYIJDDSMOKSZ-UHFFFAOYSA-N 262.634 2.247 10 10 CECE Cc1cc(CNCCCC(N)=O)c(C)n1-c1ccccc1 37659307 QINUBLSIBGJYOA-UHFFFAOYSA-N 285.391 2.449 10 10 CECE COC[C@@H](NC(=O)c1cccc(O)c1O)c1ccccc1 193008556 HDQJAGFPNCCLHC-CYBMUJFWSA-N 287.315 2.215 10 10 CECE COc1ccc(N2CCN[C@@H](C(C)C)C2)c(OC)c1 83479372 AOMMSMFVSRVJRP-CYBMUJFWSA-N 264.369 2.138 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1C[C@@H](C)OC(C)(C)C1 45661695 RKLKJUBDLPBWKP-NEPJUHHUSA-N 291.395 2.095 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(CC(=O)O)C1CC1 86752034 CUGJLJHFOKOIKD-QMMMGPOBSA-N 253.273 2.141 10 10 CECE CCOC(=O)[C@](CN)(Cc1ccc(N)cc1)CC(C)C 233681514 BXVIVEYNANFCDX-INIZCTEOSA-N 278.396 2.366 10 10 CECE CNCc1ccc(N2CC[C@@](C)(O)C2)c(Br)c1 234374065 POFZXAAWRJHXLJ-CYBMUJFWSA-N 299.212 2.130 10 10 CECE CCNCc1ccc(OC)c(CN2CCOC[C@H]2C)c1 50124803 DQCZKVKGTYBOKC-CYBMUJFWSA-N 278.396 2.025 10 10 CECE Cc1cc(O)c([C@@H](N)CCCO)cc1Br 238473850 ATRGYTLCCBKAAI-JTQLQIEISA-N 274.158 2.235 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@](C)(O)C2)c(Cl)c1 235221693 JXMCJWGVBAVNJE-RNCFNFMXSA-N 254.761 2.321 10 10 CECE C[C@@H]1CN([C@H](CN)c2ccc(N(C)C)cc2)CC(C)(C)O1 251618805 HLYADJDRYGCOFF-CZUORRHYSA-N 291.439 2.252 10 10 CECE O=C(NC[C@@H]1CC[C@@H]2C[C@@H]2C1)c1c(F)ccc(O)c1O 530267041 VOKUUJBTFOWCOW-BBBLOLIVSA-N 279.311 2.403 10 10 CECE CC(=O)C(=O)COC(=O)/C=C\c1cc(C)c(C)cc1C 808503829 NGAROGCOTQUAIJ-WAYWQWQTSA-N 274.316 2.326 10 10 CECE CCN(CCn1c(C)csc1=O)c1ccc(N)cc1 700191063 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Nc1ccc(NC(=O)c2cccn3nccc23)cc1 723497379 NBAHQZWLSWPOKX-UHFFFAOYSA-N 252.277 2.169 10 10 CECE CN(C(=O)COc1ccc(N)cc1)C1(C(F)(F)F)CC1 720390876 SUTJQJSEHJZFMI-UHFFFAOYSA-N 288.269 2.201 10 10 CECE CCOC(=O)c1cc2c(O)csc2cc1CC(=O)O 725309007 RLVFHUPESDXSDS-UHFFFAOYSA-N 280.301 2.411 10 10 CECE CO[C@@H](CNCc1cc(Cl)cc(C)c1O)[C@H]1CCOC1 826822256 OKXMCBWLTSOWJQ-FZMZJTMJSA-N 299.798 2.495 10 10 CECE CC1(C)CCO[C@@H]1CN1CCc2cc(CN)ccc21 2133390695 ABBFULPRVDKZLW-OAHLLOKOSA-N 260.381 2.323 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@@H]3CC[C@]32CN)c1O 903853977 IDCUYGKVVHMFAO-LRDDRELGSA-N 292.354 2.047 10 10 CECE COc1ccc(CN[C@@H]2CCC[C@H]3OCC[C@H]23)c(O)c1 153887667 XSUCYFKVOSBJOO-IIAWOOMASA-N 277.364 2.448 10 10 CECE Oc1cc2c(cc1CN1C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C1)CCC2 840126832 AWVDMUYQDNSLNI-CYGHRXIMSA-N 283.371 2.266 10 10 CECE CN(C)c1ccc(/C=C\CN2CCNC[C@@](C)(F)C2)cc1 843124561 CAAHFYIPGMUTAH-VGOKWCNXSA-N 291.414 2.399 10 10 CECE C[C@H](N)C[C@H](C)NC/C=C/c1ccc(N(C)C)cc1 843130002 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C[C@H](O)c1cc(F)c(N2CCCC[C@@H]2CO)c(F)c1 1880479464 NQEOXWQJJFMFQX-GXSJLCMTSA-N 271.307 2.369 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC=CC[C@H]2CO)c(F)c1 1880962749 NWKBAVCUFOWEIO-KOLCDFICSA-N 268.307 2.112 10 10 CECE COc1nn(C)cc1CNCc1cc(Cl)ccc1O 898028048 HYFOJHQLTLWLTB-UHFFFAOYSA-N 281.743 2.078 10 10 CECE CCCCCCN(C)C(=O)c1cc(O)c(O)c(O)c1 1887150287 PLAQECFHYVAHNL-UHFFFAOYSA-N 267.325 2.456 10 10 CECE CCN(Cc1ccc(O)cc1O)[C@@H]1CCCC[C@H]1CN 249709831 MBBZMSXPPIUNPZ-SWLSCSKDSA-N 278.396 2.437 10 10 CECE COc1ccc([C@@H](C)NCCOC(C)C)c(O)c1 168878251 GTBDIPGGZNDECR-LLVKDONJSA-N 253.342 2.476 10 10 CECE CCOC(=O)[C@H]1CCCN(c2ccc3c(c2)OCO3)C1 82714348 QCXHNQUMUUSUQW-NSHDSACASA-N 277.320 2.195 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H](C(=O)O)CC2)cc1 1964726465 CRJVGXODUPOGOF-CQSZACIVSA-N 276.380 2.439 10 10 CECE C[C@H](CO)[C@@H](C)NCc1c(O)cccc1Br 706871968 UIGGEXIAPKYMGQ-RKDXNWHRSA-N 288.185 2.261 10 10 CECE CCOc1cccc(CN[C@H]2CC[C@@H](OC)C2)c1O 190943537 XLMGFYXJHWIIBU-QWHCGFSZSA-N 265.353 2.448 10 10 CECE CCC[C@@H]1C[C@@H](C(=O)NCc2c(O)cccc2O)CCO1 1178912900 YGYCCKGXDNNYOU-NWDGAFQWSA-N 293.363 2.309 10 10 CECE CCC(F)(F)CN(C)CC(=O)N(C)c1ccc(N)cc1 692344094 RJHXLHLGIHXQCK-UHFFFAOYSA-N 285.338 2.209 10 10 CECE CC(C)C1(O)CCN(CCOc2ccc(N)cc2)CC1 710235958 CCTVKWKRAKWMRG-UHFFFAOYSA-N 278.396 2.131 10 10 CECE O=C(NCc1c(O)cccc1F)C(=O)c1ccccc1 1184348347 MTKUWMMQCRXWRB-UHFFFAOYSA-N 273.263 2.030 10 10 CECE CN(Cc1cn(C)nc1Br)c1ccc(N)cc1 714088074 KQFJXWCWNVJHGH-UHFFFAOYSA-N 295.184 2.401 10 10 CECE C[C@@H](NCc1cccnc1O)c1cc(F)ccc1O 714963383 GVQMAECZGNITQR-SECBINFHSA-N 262.284 2.483 10 10 CECE C[C@H](N[C@H]1CCCC12OCCO2)c1c(O)cccc1O 715596028 LXNKGHMMEANCNJ-GWCFXTLKSA-N 279.336 2.044 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@H]2[C@H]3CC[C@@H](O3)[C@H]2C1 718153213 QSCQXKXNSDDHIM-ABNINFQISA-N 275.348 2.268 10 10 CECE NCc1cc(F)c(N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)c(F)c1 718263105 YPYZCHHIBOSMGP-DUBDDPSESA-N 280.318 2.037 10 10 CECE CC[C@@H](O)c1ccc(N2CCS[C@@H](CO)C2)cc1 720018172 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CCCOc1ccc(N2CCO[C@@H](CCN)C2)cc1 2119413347 QGNCHAZDVHMQEM-HNNXBMFYSA-N 264.369 2.029 10 10 CECE Cc1nc(Cl)c(N)c(N(C)Cc2ccc(N)cc2)n1 2121870667 QQRWKANYMWYDIT-UHFFFAOYSA-N 277.759 2.239 10 10 CECE COCc1ccnc(NCc2cc(N)ccc2O)c1 1909348869 OJFVXEHAMOYSIE-UHFFFAOYSA-N 259.309 2.128 10 10 CECE CCC(C)(C)NC(=O)[C@@H](C)N1CCC[C@@H]1CN=[N+]=[N-] 2123014792 HQEXOPPKKPQUGB-GHMZBOCLSA-N 267.377 2.454 10 10 CECE O=C(NCc1c(O)cccc1O)[C@H]1CCC(F)(F)C1 1639292405 AQFNEXFBYBBJAF-QMMMGPOBSA-N 271.263 2.149 10 10 CECE CCOC1(C)CN(c2ccc(C=CC(=O)O)cc2)C1 1911932253 SFDHMMLCDDWUKT-UHFFFAOYSA-N 261.321 2.400 10 10 CECE CC[C@]1(C(=O)N2CCC[C@H]2CN=[N+]=[N-])CCCO1 1912152060 OKRSPOUIXNJYTQ-CMPLNLGQSA-N 252.318 2.247 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2ccc(Br)cc2O)C1 1912195071 XIWWACNMOSBYCD-UHFFFAOYSA-N 297.112 2.289 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C[C@@H]2C[C@H]3COCC[C@@H]3O2)C1 1912157240 XFBKJHXUJXOZAW-XUXIUFHCSA-N 280.372 2.203 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cc(Br)c[nH]2)C1 1912178468 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10 10 CECE Cc1ccc(O)c(CNC(=O)/C=C/c2nccs2)c1 1629740299 DQZPJXZBTQPDLP-SNAWJCMRSA-N 274.345 2.487 10 10 CECE CC[C@@H](NC1CCCC1)[C@H](O)c1ccc(O)c(O)c1 2019483 FEYMRICSONQYOT-IUODEOHRSA-N 265.353 2.442 10 10 CECE CC(C)[C@H]1CN(C)[C@@H](c2cc(F)ccc2O)CN1 251380672 HOICMGNVZZMAMQ-CHWSQXEVSA-N 252.333 2.132 10 10 CECE Nc1ccc(NC(=O)CCCO[C@H]2CC2(F)F)cc1 2126306554 GJNSWCQTDZCSSU-NSHDSACASA-N 270.279 2.412 10 10 CECE COc1cc(Cl)cc(CNC2CC3(COC3)C2)c1O 2125760293 XGUJWUQLFXTZDD-UHFFFAOYSA-N 283.755 2.323 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@H]1Cc2cc(Cl)ccc2O1 1912184289 DLVARXHIMYHDPZ-LLVKDONJSA-N 280.715 2.412 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H]2CC[C@H]1C2 1912198876 LSXOHHSPSVLAPU-MDZLAQPJSA-N 266.345 2.398 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)c1cccc([N+](=O)[O-])c1 1912196479 VQOJESMPTHQHDE-SNVBAGLBSA-N 279.256 2.011 10 10 CECE Cc1nc(C=CC(=O)N2CC[C@@H](N=[N+]=[N-])C2)cs1 1912144279 QVDUUCQXAZGMPO-SECBINFHSA-N 263.326 2.376 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cs2)C1 1912175756 PQQHFJXNCONPQG-SSDOTTSWSA-N 281.297 2.429 10 10 CECE COc1ccncc1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1912168428 UIVXMGVHOZYBFV-SNVBAGLBSA-N 275.312 2.253 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2COC3CC2C3)c(F)c1 2126699206 VFRLRHUCTILJMG-HGOJYGERSA-N 264.344 2.459 10 10 CECE CC1(C)CC12CC(NCc1ccc(O)c(O)c1O)C2 2127610412 KKBOBYVEGVVWBE-UHFFFAOYSA-N 263.337 2.472 10 10 CECE C[C@@H]1CCC[C@@H]1S(=O)(=O)NCc1ccccc1O 1965758475 KPCBSBJKUUMOHF-MFKMUULPSA-N 269.366 2.000 10 10 CECE CC(C)(O)C1CN(c2ccc3c(c2)CCC[C@H]3N)C1 2128276168 ZPZOFEKQBOKCKY-OAHLLOKOSA-N 260.381 2.230 10 10 CECE Cc1nnc(CN(C)c2ccc3c(c2)CC[C@@H]3N)s1 2128324510 GHMLSIXRALEGSQ-ZDUSSCGKSA-N 274.393 2.429 10 10 CECE CN(C[C@H]1CCCN1C)c1ccc2c(c1)CC[C@H]2O 2128322579 RRSQMEMSITXZLL-GDBMZVCRSA-N 260.381 2.197 10 10 CECE CN[C@@H]1CCc2cc(N3CCC[C@H](CO)C3)ccc21 2128314420 GHCUEYKMRWBUNL-BLLLJJGKSA-N 260.381 2.102 10 10 CECE CN1CCCc2cc([C@@H](O)CC(F)(F)CN)ccc21 2128359275 JZHIGHRYJOWLJZ-ZDUSSCGKSA-N 270.323 2.087 10 10 CECE O[C@H]1CC[C@@H]2C[C@@H]1CN2c1ccc2c(c1)CC[C@H]2O 2128320363 BTQIVNGACWSSNS-XABYNWHXSA-N 259.349 2.016 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCO[C@H]2C)c(F)c1 160074326 JNWTXSYBSYPBRK-GXFFZTMASA-N 252.333 2.159 10 10 CECE CCN(CCCO)c1ccc([C@@H](C)NC)cc1F 165214540 ZNHPROCZNBPADZ-LLVKDONJSA-N 254.349 2.315 10 10 CECE NCc1ccc(N2CCC[C@]3(CC[C@H]3O)C2)c(F)c1 2129554221 DOTOSCGMMFVVRK-CABCVRRESA-N 264.344 2.026 10 10 CECE CO[C@H]1CC(N2CCC(CN=[N+]=[N-])CC2)C[C@@H]1OC 2130571522 KZZZRFHKVPPXBU-STQMWFEESA-N 268.361 2.201 10 10 CECE CCN(C[C@H](C)N1CCCC1)c1ccc(CN)cc1 2132192339 JDOHIKIPBIIELY-AWEZNQCLSA-N 261.413 2.456 10 10 CECE FC(F)(F)Oc1ccc(N2CC[C@@H]3CNC[C@H]32)cc1 2132371586 RZLPPGAGTSMCGN-BXKDBHETSA-N 272.270 2.383 10 10 CECE CO[C@@H]1CCN(c2ccc([C@H](C)N)c(O)c2)C1(C)C 1914305743 ZSACLIHUROACMZ-IINYFYTJSA-N 264.369 2.416 10 10 CECE Cc1nc[nH]c1CN1CCc2cc([C@@H](C)N)ccc21 1912978401 ROPYOWSLRMHUJA-SNVBAGLBSA-N 256.353 2.301 10 10 CECE C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCN3C)CCO1 219883851 DHEOBSCUXLNUEZ-DOMZBBRYSA-N 260.381 2.336 10 10 CECE CCC[C@H]1C[C@H]1CNC(=O)COc1ccc(N)cc1 2135350745 TVUZUQZUINYDSZ-RYUDHWBXSA-N 262.353 2.200 10 10 CECE Cc1cc(CN(C)c2ccc(CO)cc2F)ncn1 2141577639 QSEIMSXWNCVZEE-UHFFFAOYSA-N 261.300 2.053 10 10 CECE CCc1c(CNCc2ccc(C)cc2O)cnn1C 2139770536 KJHKAARYACAPCJ-UHFFFAOYSA-N 259.353 2.286 10 10 CECE Cc1cccc(CNCc2ccoc2C(=O)O)c1O 2139761775 ZWSXTIFCKSRJGB-UHFFFAOYSA-N 261.277 2.282 10 10 CECE O=C(O)[C@]1(Sc2nccs2)CCCOCC1 1904813716 HPNXTLQSMILRPP-JTQLQIEISA-N 259.352 2.259 10 10 CECE COCCSCCN[C@@H](C)c1ccc(OC)cc1O 2139800680 RVHUHZQTIXXJIW-NSHDSACASA-N 285.409 2.431 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](O)C2(C)C)c(F)c1 2136631361 UFGQPIMGXCUSOH-GFCCVEGCSA-N 270.323 2.034 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N(C)C3CCC3)ccc21 143833599 UIYWKYNUEHLLEG-AWEZNQCLSA-N 259.353 2.278 10 10 CECE COc1ccc(N2CCNCC3(CC3)C2)c(F)c1F 2136987993 VWIRVWNTTLRXLD-UHFFFAOYSA-N 268.307 2.163 10 10 CECE CN[C@@H](c1ccccc1O)[C@](C)(O)c1ccc(C)o1 1920590697 XJQGTJKMQWKDCN-LSDHHAIUSA-N 261.321 2.462 10 10 CECE NCc1cc(F)c(N2CCC[C@@H](CCO)C2)c(F)c1 227388747 CGPNUKCVZNSKOM-JTQLQIEISA-N 270.323 2.022 10 10 CECE Nc1ccc(CCOCC23COC(CF)(C2)C3)cc1 2138022069 KGGYIKRAHFZKRX-UHFFFAOYSA-N 265.328 2.347 10 10 CECE CC[C@H]1CN(c2ccc(CNC)cc2C)C[C@@H]1CO 2140880517 FIZFYHNMJURCJP-LSDHHAIUSA-N 262.397 2.169 10 10 CECE CCN(C[C@H]1CCCNC1)[C@@H](C)c1c(O)cccc1O 233502618 ZDGNWTHIWQYPAD-STQMWFEESA-N 278.396 2.480 10 10 CECE CNCc1ccc(N2CC[C@](C)(O)C2)cc1C(F)(F)F 234377288 WEWYUTIZZOQYPY-ZDUSSCGKSA-N 288.313 2.386 10 10 CECE CC[C@H](O)c1ccc(N(C)C[C@@H]2OCCO[C@@H]2C)cc1 2143685629 XSZOPBDLUYHABD-KCXAZCMYSA-N 279.380 2.370 10 10 CECE O=[N+]([O-])c1cccc([C@H]2CC(F)(F)CCN2)c1O 1952304116 GTKPMKIOSIPYAI-MRVPVSSYSA-N 258.224 2.360 10 10 CECE CN(C)Cc1cc(CC2(C(=O)O)CCC2)ccc1O 1952392556 ADYOYXNEJSQLAF-UHFFFAOYSA-N 263.337 2.251 10 10 CECE Oc1c(CNC[C@H](O)CC(F)(F)F)ccc(F)c1F 1970818510 XWPKHZAJDQZADH-SSDOTTSWSA-N 285.212 2.073 10 10 CECE CSCC[C@@H](C)N(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 253072297 NXUHWMPMHHHTGJ-YGRLFVJLSA-N 293.436 2.241 10 10 CECE C[C@@H]1CN(c2cc3c(cc2N)OCC(=O)N3)CC[C@H]1C 253076738 RMZYFBIEDXTSMH-NXEZZACHSA-N 275.352 2.082 10 10 CECE Oc1c(F)cc(F)cc1CNC[C@@H]1[C@@H]2CCOC[C@@H]21 1972264234 YLMDZLWBIRXWRX-TUAOUCFPSA-N 269.291 2.043 10 10 CECE Cc1ccc(Sc2ncc([C@@H](C)N)s2)nn1 1976521614 XTVMXTNBDBEBGB-SSDOTTSWSA-N 252.368 2.412 10 10 CECE COC(=O)c1cc(-c2cc(O)c(O)c(C)c2C)no1 260950529 WWCVOLHIONHJHT-UHFFFAOYSA-N 263.249 2.156 10 10 CECE Oc1cc(Br)ccc1CNCc1ncco1 1987049537 DJOTVQYRTDKWHC-UHFFFAOYSA-N 283.125 2.433 10 10 CECE COc1cc([C@H](O)[C@@H](N)c2ccccc2O)ccc1C 2149635439 VENOBJUGFKVEEI-HOTGVXAUSA-N 273.332 2.443 10 10 CECE NCc1ccc(N2CC[C@@H]([C@@H]3CCOC3)C2)c(F)c1F 2153023218 DJOAPQUDARHJGL-VXGBXAGGSA-N 282.334 2.286 10 10 CECE CCNCc1ccc(N2C[C@@H](O)[C@H](C3CC3)C2)c(C)c1 2146824061 BUBCATSHEKGIKO-DOTOQJQBSA-N 274.408 2.312 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCCN2CC[C@H](C)O 162239794 FLDKCIXUNJQFAO-QWHCGFSZSA-N 262.397 2.491 10 10 CECE c1nc(CNCc2ccc(N3CCCCC3)cc2)n[nH]1 37919550 PVPZNSGGZLVRKT-UHFFFAOYSA-N 271.368 2.085 10 10 CECE CN[C@@H](C)c1cnc(Sc2nnc(C)n2C)s1 1997410799 JTUYAABVSHMEKF-LURJTMIESA-N 269.399 2.012 10 10 CECE CN(C)c1ccc(CN(C)[C@@H]2CCC(F)(F)[C@@H]2O)cc1 2160090497 FOWHWZLELHEZMB-ZIAGYGMSSA-N 284.350 2.343 10 10 CECE CNCC[C@@H](C)N(C)Cc1c(O)cccc1Cl 2002735409 ZLBDOHJUSYOCFQ-SNVBAGLBSA-N 256.777 2.475 10 10 CECE Cc1cc([C@H](NN)c2ccc(N(C)C)cc2)c(C)cn1 2153756910 TWDFURSCWZUVQM-MRXNPFEDSA-N 270.380 2.317 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)Cc2cccs2)CC1 2006018501 LUYOFTNWUWYXPN-UHFFFAOYSA-N 250.327 2.497 10 10 CECE C[C@H](c1cncs1)N(C)C(=O)COc1ccc(N)cc1 2155706645 FKSGGAGAMFEMBZ-SNVBAGLBSA-N 291.376 2.324 10 10 CECE C[C@@H]1CCC[C@]1(O)CNCc1ccc(F)cc1O 293957447 JEHGOFGARBQPCK-YGRLFVJLSA-N 253.317 2.172 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H](F)C2)cc1 2027985274 FAZHYKSVPQRLPV-MGPQQGTHSA-N 253.317 2.039 10 10 CECE COC[C@H](C)CCNCc1cc(OC)ccc1O 2031864827 OZEAWLAQLASAAW-LLVKDONJSA-N 253.342 2.163 10 10 CECE C[C@H]1C[C@@H](O)[C@H](C)CN1c1ccc(CN)cc1Cl 2032208218 OOLBEUAKOKPYFL-ISTVAULSSA-N 268.788 2.394 10 10 CECE O=C(O)[C@@H]1C[C@@H](F)CN1Cc1c(O)cccc1Cl 2034481324 JTJDIYRBJXRREJ-XCBNKYQSSA-N 273.691 2.043 10 10 CECE COc1ccc(O)c(CNCc2ncsc2C)c1 2035319636 DATIFEOUCDVHMF-UHFFFAOYSA-N 264.350 2.456 10 10 CECE CCCCCOC(=O)NCc1cc(N)ccc1O 2036349178 MUIHGUVYYSXVLS-UHFFFAOYSA-N 252.314 2.391 10 10 CECE CC[C@@H](c1ccccc1O)N1CC[C@](C)(C(=O)NC)C1 300713835 YKJYPUQUOYZBCG-BBRMVZONSA-N 276.380 2.301 10 10 CECE Cc1nc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)cs1 403651970 OWCSNVRXROSOJT-QMMMGPOBSA-N 251.315 2.366 10 10 CECE COc1cc(C(=O)Cc2ccc(N)cc2)c(F)cn1 311530799 LBTXXGJXESTFKM-UHFFFAOYSA-N 260.268 2.237 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@H]2CN3CCC2CC3)cc1 312467630 WTOZBLSWNNAABG-SUMWQHHRSA-N 273.424 2.497 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H]2CS3)cc1Cl 321955602 MJOBINVPXUOJHO-WDEREUQCSA-N 254.786 2.493 10 10 CECE CCC(CC)(CO)Sc1ncc(C(=O)O)s1 322112340 LOHGYYZPDYFEJN-UHFFFAOYSA-N 261.368 2.485 10 10 CECE Cc1ccc(C[C@@](C)(NCCCN=[N+]=[N-])C(N)=O)cc1 2159831224 YTBGZEKAFULFMY-CQSZACIVSA-N 275.356 2.072 10 10 CECE CCN(CC)c1ccc(C2(O)C[C@H]3CNC[C@@H]3C2)cc1 2163093033 YFFLYTBXHBATBE-KBPBESRZSA-N 274.408 2.350 10 10 CECE CC[C@H]1CC[C@](O)(c2ccc3c(c2)CCN3CC)CN1 2163070561 XFXBEKIXPFTVPW-DOTOQJQBSA-N 274.408 2.419 10 10 CECE COC1(OC)CC[C@H]1CN[C@H]1CCc2cccc(O)c21 2173378579 FDIWLHJHKWNKSI-STQMWFEESA-N 277.364 2.368 10 10 CECE Cn1ccc([C@H](N)c2ccc(N3CCCCC3)cc2)n1 2163104602 FGQXNVOIXBIEKM-MRXNPFEDSA-N 270.380 2.459 10 10 CECE C[C@H](NC1CC(N(C)C)C1)c1ccc(F)cc1O 701424902 NVUPCQCJBIKINX-GCVQQVDUSA-N 252.333 2.275 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@@H](F)C3)c(Cl)cc21 701831115 YHSPKBFAMXUHTC-OQPBUACISA-N 297.761 2.491 10 10 CECE C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)N(C)c1ccc(N)cc1 702055940 OHURDLSJHFCFJV-XQQFMLRXSA-N 275.396 2.493 10 10 CECE CCCNCc1ccc(N2CC[C@H](N3CCC3)C2)cc1 702253132 CLEZEIBMDWIPJK-KRWDZBQOSA-N 273.424 2.471 10 10 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CC[C@@H](N[C@@H]1CCN(C)C1=O)c1ccc(N(C)C)cc1 90074912 YCXFYKUFEBLDHS-HUUCEWRRSA-N 275.396 2.024 10 10 CECE CONCc1c(O)c(Br)cc(F)c1F 258501592 IRYUZPOVTKZLAJ-UHFFFAOYSA-N 268.057 2.084 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3C)C2)c1 368331503 KALPXDXSFBDPDC-QVHKTLOISA-N 288.391 2.361 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H](C)[C@@H](O)C2)cc1 388016622 DRAAOODCNPABFX-CJNGLKHVSA-N 262.397 2.249 10 10 CECE C[C@@H](NS(=O)(=O)Cc1ccc(N)cc1)[C@@H]1CC1(C)C 397669530 FIOMWLXYKBYOHY-MFKMUULPSA-N 282.409 2.123 10 10 CECE C[C@@H](NCCSc1nccn1C)c1c(O)cccc1O 2165083892 YBTFUBRHKLFJDL-SNVBAGLBSA-N 293.392 2.274 10 10 CECE COc1ccc(N2CCNC(C)(C)C2)c(OC)c1C 2278032510 BPXCGNGLUXLHLN-UHFFFAOYSA-N 264.369 2.200 10 10 CECE Cc1cc(CN(C)CC(=O)NC(C)(C)C)ccc1N(C)C 815012996 OZUKEKVGRKXBCD-UHFFFAOYSA-N 291.439 2.408 10 10 CECE CCOc1ccc(CN2[C@H]3CC[C@H]2[C@H](CO)C3)c(O)c1 811519438 XMLLOZDQIDGHQY-YDHLFZDLSA-N 277.364 2.136 10 10 CECE C[C@@H]1CC(CNCc2cccc(O)c2O)C[C@@H](C)O1 724292848 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CC(=O)C(=O)COC(=O)[C@]1(c2ccc(F)cc2)CC1(C)C 873438340 JHEUPQUZUHJVEG-MRXNPFEDSA-N 292.306 2.195 10 10 CECE Cc1nscc1[C@H](N)[C@@H](O)c1ccc(N(C)C)cc1 1877617209 YVCAARQKOKJEED-KBPBESRZSA-N 277.393 2.251 10 10 CECE COC[C@H](C)CNC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1877612745 JHUPJOLFNZJFFO-GHMZBOCLSA-N 269.349 2.001 10 10 CECE Cc1cc(N(C)CC23CC(C)(CO2)C3)ccc1CN 1879888308 OKISXIYDWLXUKA-UHFFFAOYSA-N 260.381 2.459 10 10 CECE C[C@@H](O)c1ccc(N(CC2CC2)C2COC2)cc1O 1879148610 ATLBVYQTOXGPGS-SNVBAGLBSA-N 263.337 2.061 10 10 CECE C[C@]12CCO[C@](CNCc3ccc(O)cc3O)(C1)C2 1879288496 DMPKVUHBDKPUHY-GASCZTMLSA-N 263.337 2.147 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](CO)[C@H]2C)c(F)c1 1880488238 VAGIIXYUKNJDTG-KXUCPTDWSA-N 271.307 2.225 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)Cc2ncon2)c(F)c1 1880480132 SXCNWVAZKFINEA-SSDOTTSWSA-N 269.251 2.038 10 10 CECE C[C@H](O)c1cc(F)c(N(C)CCCN(C)C)c(F)c1 1880479520 ODGVPJJZYVWWMJ-JTQLQIEISA-N 272.339 2.406 10 10 CECE C[C@H](O)c1cc(F)c(N(C)C[C@@H](O)C2CC2)c(F)c1 1880480583 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CC[C@@H]1CC[C@@H](C)N1C[C@H](O)COc1ccc(N)cc1 135989157 DESPNXQSTVHTMT-YUELXQCFSA-N 278.396 2.271 10 10 CECE CS[C@@H]1CC[C@@H](N(C)c2ccc3c(c2)NC(=O)[C@H]3N)C1 687890331 XCILQLZLLHPSNI-UDZFHETQSA-N 291.420 2.359 10 10 CECE COc1ncccc1CNCc1ccc(F)c(F)c1O 703294445 HYBZGFFIKOKYPR-UHFFFAOYSA-N 280.274 2.364 10 10 CECE CNCc1ccc(N(C)C[C@@]23COC[C@@H]2C3)cc1C 689284589 SUJLGGVWSOOROY-HOCLYGCPSA-N 260.381 2.187 10 10 CECE C[C@H]1[C@@H](N)CCN1Cc1c(O)cccc1Br 706852058 KEBJUEVEQMCORL-KWQFWETISA-N 285.185 2.076 10 10 CECE CS[C@@H]1CCC[C@H]1N(C)C(=O)c1cccc(O)c1O 707282280 NAIFECGNGZLVQF-ZYHUDNBSSA-N 281.377 2.454 10 10 CECE C[C@H](O)c1ccc(N(C)CCn2cnnc2)cc1Cl 707626894 JITNTKGMPBAATC-JTQLQIEISA-N 280.759 2.121 10 10 CECE CC(C)N(CCC(=O)O)Cc1cc(F)cc(F)c1O 708216901 VOCKPLBPXWZKCI-UHFFFAOYSA-N 273.279 2.356 10 10 CECE CON(CCN)Cc1cc(Cl)cc(Cl)c1O 708845222 PGMWPGCOGREDIK-UHFFFAOYSA-N 265.140 2.021 10 10 CECE CN1C(=O)[C@H](N)c2ccc(N3CC(C)(C)C3(C)C)cc21 690128113 SKGFDBSIXMLBKY-CYBMUJFWSA-N 273.380 2.288 10 10 CECE O=C(N[C@@H]1C[C@H]2CCCC[C@H]21)c1cccc(O)c1O 712571529 KNHPOPNKWJWCHU-CKYFFXLPSA-N 261.321 2.406 10 10 CECE Oc1ccc(CNCC2C[C@H]3[C@H](C2)C3(F)F)c(O)c1O 693305257 OZBKUMAYDAMVOO-UWVGGRQHSA-N 285.290 2.184 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@H]2CNCC[C@@H]21 715019829 OCORZFRSJRFXBJ-AGIUHOORSA-N 276.380 2.233 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)CC2(C)CC2)cc1 693834535 ACQQDPRCEJKBPR-OAHLLOKOSA-N 261.413 2.484 10 10 CECE COc1ccc(O)c(CNCCCOC2CC2)c1 717372388 NOCUSHSTYFUFMS-UHFFFAOYSA-N 251.326 2.060 10 10 CECE Cc1cccc(CNCC[C@H](O)C(F)(F)F)c1O 717349644 OPDWYVSQHLNXPS-JTQLQIEISA-N 263.259 2.104 10 10 CECE CN(Cc1ccccc1O)C(=O)C1CC2(CSC2)C1 718390555 HSQHFCJRFLDUTE-UHFFFAOYSA-N 277.389 2.494 10 10 CECE C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(CO)c2)C[C@@H](C)O1 694914658 QDYQSDLSFYHOQC-GHMZBOCLSA-N 280.324 2.091 10 10 CECE CCCN([C@@H](C)c1ccc(O)cc1O)[C@@H]1CCNC1 71314534 VHHPOCWGQFQNRX-NWDGAFQWSA-N 264.369 2.233 10 10 CECE Nc1ccc(O)c(CN2CCO[C@H](CC(F)(F)F)C2)c1 699188007 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Cc1ccc(O)c([C@H](C(N)=S)N2CCCC2)c1 211946551 VIXRTAZQGIYPLV-GFCCVEGCSA-N 250.367 2.124 10 10 CECE CC(C)(NC(=O)Cc1ccc(O)c(O)c1)c1nccs1 1628961931 VSNAGBCKQPPTFQ-UHFFFAOYSA-N 292.360 2.148 10 10 CECE CC[C@@H]1CN(CC)[C@@H](c2cccc(F)c2O)CN1 251584713 CLVIZULEDGWCDP-ZWNOBZJWSA-N 252.333 2.276 10 10 CECE C[C@@H]1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CCO1 1566426584 ROEORBWVTKRRPA-BXKDBHETSA-N 290.323 2.146 10 10 CECE COc1ccc(CNCC[C@@H]2CCN(C(C)=O)C2)cc1C 1733632695 BJOMUOWOVFBQSQ-OAHLLOKOSA-N 290.407 2.352 10 10 CECE Nc1c(Cl)cccc1C(=O)NCc1cc(O)ccc1O 1644757085 SYZFTYBSSXOFHK-UHFFFAOYSA-N 292.722 2.263 10 10 CECE COC(=O)[C@@H](CN1CC[C@H](N=[N+]=[N-])C1)c1ccccc1 1912191461 RUSKYXJIESMKHB-STQMWFEESA-N 274.324 2.328 10 10 CECE Cc1cc([N+](=O)[O-])cc(C(=O)N(C)CCN=[N+]=[N-])c1F 1912158296 WKNDOWGJPLANDU-UHFFFAOYSA-N 281.247 2.425 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@]12CCC[C@@H](C1)OC2 1912190322 BXDHITPMQUTCIE-JQWIXIFHSA-N 252.318 2.104 10 10 CECE N[C@@H](c1ccccc1O)[C@@]1(O)CCCc2ccoc21 2126528569 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CC[C@@H](C)NCc1ccc(N2CCNC(=O)C2)c(Cl)c1 2240084179 SUFJUCOOFPSNQD-LLVKDONJSA-N 295.814 2.164 10 10 CECE CSc1ncc(CNCc2cc(C(N)=O)cs2)s1 2257102880 HEKDLFFDBCWCBW-UHFFFAOYSA-N 299.446 2.315 10 10 CECE CSc1ncc(CNCc2ccc(O)cn2)s1 2248709764 BNYKOUWTPJMTGH-UHFFFAOYSA-N 267.379 2.255 10 10 CECE Nc1ccc(CCN2CCC(CO)(C(F)F)CC2)cc1 2289869897 MFLLAUUKWAONLC-UHFFFAOYSA-N 284.350 2.151 10 10 CECE OC[C@@H](F)C1CN(c2ccc(OC(F)F)cc2)C1 2263852512 FPOVEDNDABBXRP-LLVKDONJSA-N 261.243 2.055 10 10 CECE OC[C@H]1CC2(CC2)CN1c1ccc(OCF)cc1 2263947075 BXXPKNKDVSIHOB-GFCCVEGCSA-N 251.301 2.344 10 10 CECE CC(C)C[C@@H](N[C@H](C)c1ccc(F)cc1O)C(N)=O 2264456410 ZSMVIOBWXKLBLY-BXKDBHETSA-N 268.332 2.082 10 10 CECE O=C(O)[C@]1(F)CCCN(Cc2ccc(Cl)cc2O)C1 2265825113 LTSOTGCSSYXUGD-ZDUSSCGKSA-N 287.718 2.434 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@@]3(CCO3)CC[C@@H]2N)cc1 2279053737 JEEREORIAJPVRE-XHSDSOJGSA-N 276.380 2.170 10 10 CECE Cc1cc(N(C)Cc2ccn(C)n2)ccc1[C@@H](C)N 2269658534 RPLUJXYFGSPAAR-GFCCVEGCSA-N 258.369 2.385 10 10 CECE COc1cc(C)c(N2C[C@H](C)O[C@H](CCO)C2)c(C)c1 2285088612 JBPTXIKVGPZLAO-UONOGXRCSA-N 279.380 2.288 10 10 CECE COc1ccc(N2C[C@@]3(C)C[C@@]3(CO)C2)c(OC)c1C 2295356399 AJBAHEQIUBDIPM-CVEARBPZSA-N 277.364 2.221 10 10 CECE Cc1ccc(F)c(CNCCc2ccc(O)c(O)c2)n1 2287157894 QHIYSKMBHBDFCS-UHFFFAOYSA-N 276.311 2.273 10 10 CECE CN(C)c1ccc(C=Cc2nc(O)c3cnn(C)c3n2)cc1 2297353733 RWZODXCRPUWJQR-UHFFFAOYSA-N 295.346 2.305 10 10 CECE NCc1cc(F)c(N2CCN(C3CCC3)CC2)c(F)c1 378692168 BCCUYUIBQDRYLM-UHFFFAOYSA-N 281.350 2.098 10 10 CECE COc1ccc(N(C)C(=O)/C=C/c2cnccn2)cc1F 492158380 AQRSYCVEEPBIAY-ZZXKWVIFSA-N 287.294 2.301 10 10 CECE C[C@@H]1[C@H](O)CCN(c2ccc(CO)c(Cl)c2)[C@@H]1C 2321290525 AZPCNTYGGFUNNN-IMSIIYSGSA-N 269.772 2.428 10 10 CECE COc1ccc(CNC[C@@H]2C[C@@H]3CC[C@H]2O3)c(O)c1 2330009564 PUGPZZZQXKVMOK-CORIIIEPSA-N 263.337 2.058 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)[C@H]1CC[C@@H]2C[C@@H]2C1 2330225365 VSLDGMCHARJMGI-UPBMQRFZSA-N 261.365 2.450 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1C[C@H]2C=C[C@@H]1C2 2330998128 PJULNQXNYREBIM-OPQQBVKSSA-N 258.321 2.432 10 10 CECE C[C@@H](N[C@@H]1CCC[C@H](CO)C1)c1c(O)cccc1O 2331470610 XXGLWLNEVOBTQJ-GRYCIOLGSA-N 265.353 2.300 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1 2333103975 JLHUSPHDFAHYQB-IMJJTQAJSA-N 260.381 2.002 10 10 CECE Nc1ccc(CN2CC[C@H](O)C[C@@H]2C(F)(F)F)cc1 2336401790 DSUFLWMXGNATTF-NWDGAFQWSA-N 274.286 2.156 10 10 CECE CN(CCC[C@@H]1C[C@H]1C(=O)O)Cc1ccccc1O 2337482462 IEDBEYVAZVAXFT-DGCLKSJQSA-N 263.337 2.325 10 10 CECE C[C@@H]1C[C@@H](CO)CN1c1ccc(CN)c(C2CC2)c1 2339144594 ZKNBUSDFJGBJJE-VXGBXAGGSA-N 260.381 2.230 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@H]2C[C@H]1[C@](C)(O)C2 2339654530 APTCZYWXUPQMBH-GUYJKWIASA-N 261.365 2.398 10 10 CECE CC(C)[C@@H](O)C(C)(C)CNCc1ccc(O)cc1O 2340318286 JBXPKKDWZAQSBU-CQSZACIVSA-N 267.369 2.231 10 10 CECE CO[C@H]1COCCN([C@@H](C)c2ccc(Cl)cc2O)C1 2351633718 YYRSULUBJKLWJX-CMPLNLGQSA-N 285.771 2.454 10 10 CECE COc1ccc([C@H](C)N[C@H]2C[C@@H](CO)[C@@H]3C[C@H]23)c(O)c1 2354931280 SOQRIAMGVHJKPV-PJDGIUQASA-N 277.364 2.068 10 10 CECE CCNCc1ccc(N2CCC(C(=O)NC)CC2)c(C)c1 50561516 QNZIQXAHOHJYNX-UHFFFAOYSA-N 289.423 2.067 10 10 CECE Cn1cnnc1CCNCc1c(O)ccc2ccccc12 109421258 WSVUYUAFAZUPBU-UHFFFAOYSA-N 282.347 2.006 10 10 CECE CN1[C@@H]2CC[C@@H]1CC(CNCc1cccc(O)c1O)C2 104420414 MAHZAMNFPKRRSA-ZIAGYGMSSA-N 276.380 2.060 10 10 CECE Nc1ccc(NC(=O)c2ccccc2N2CCOCC2)cc1 178353858 ZKPPBYLJOMVQDV-UHFFFAOYSA-N 297.358 2.358 10 10 CECE COc1ccc(N2CCC[C@@](C)(C(=O)O)C2)c([N+](=O)[O-])c1 62874693 YLHFIAPYJVMEPM-CQSZACIVSA-N 294.307 2.295 10 10 CECE CCN(CC)c1ccc([C@@H](NN)[C@@H]2C[C@H]2COC)cc1 2357002995 JKUYKTMAFQSBNN-NUEKZKHPSA-N 277.412 2.320 10 10 CECE CN(Cc1cc([N+](=O)[O-])ccc1O)CC1(O)CCCC1 179057045 OQXCSCJZFVUWSA-UHFFFAOYSA-N 280.324 2.037 10 10 CECE C[C@@H]1COCCN1c1c(F)cc(/C=C/C(=O)O)cc1F 62723217 PIHISHSDHZQTAU-GKQMSVHHSA-N 283.274 2.288 10 10 CECE CC(C)[C@@](C)(N[C@H](C)c1cc(F)ccc1O)C(N)=O 311699856 QBOVPUQJFWVTEI-YMTOWFKASA-N 268.332 2.082 10 10 CECE Cc1cc([C@H](N)CCO)c(O)c(Br)c1C 212711988 FDRHHCVAONTNJA-SECBINFHSA-N 274.158 2.154 10 10 CECE Nc1ccc(OCC(=O)O[C@H]2C[C@H]3CC[C@H]2C3)cc1 311373857 HHWWDSFCQCKSAE-MJVIPROJSA-N 261.321 2.379 10 10 CECE CCOC[C@H](C)N[C@H](C)c1ccc(OC)cc1O 44690533 USQJAXIKDSQNSK-WDEREUQCSA-N 253.342 2.476 10 10 CECE CCCCN(CCO)CCCC(=O)Nc1ccc(N)cc1 49009091 PIGLHSSEGJFPEM-UHFFFAOYSA-N 293.411 2.082 10 10 CECE Cc1cc(Br)c(O)c(CN[C@@H](C)CCO)c1 134750668 DGDDZJICMDCNSG-VIFPVBQESA-N 288.185 2.324 10 10 CECE NC(=O)c1ccc([N+](=O)[O-])c(NCc2ccccc2O)c1 228427288 QFUAWJYKWGNPFH-UHFFFAOYSA-N 287.275 2.011 10 10 CECE Oc1c(Cl)cc(Cl)cc1CNc1ncn[nH]1 83431169 HRKVYIKISKAJLN-UHFFFAOYSA-N 259.096 2.429 10 10 CECE C[C@@H](O)[C@@H](N)c1ccc(OCc2ccccc2)cc1O 95667884 HFNKLKHQVHJLGE-BDJLRTHQSA-N 273.332 2.352 10 10 CECE C[C@H]1C[C@@H](C)CN(C[C@@H](O)COc2ccc(N)cc2)[C@H]1C 253092234 GZELZYFLSAPZDP-ORIJERBGSA-N 292.423 2.375 10 10 CECE C[C@H](N[C@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)O)c1ccc(O)cc1O 251546511 PQBHZXFUJLUJLO-NPKNSRMISA-N 291.347 2.248 10 10 CECE CP(C)(=O)[C@@H]1CCCN1CC(=O)c1ccc(O)c(O)c1 2164536921 SLFIHAZAKRVKMY-CQSZACIVSA-N 297.291 2.325 10 10 CECE Cc1ncn(C[C@@H](N)c2ccc3c(c2)CCN3C)c1C 2163074634 UTOWRAYHGXQKFH-OAHLLOKOSA-N 270.380 2.192 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N(C)[C@H](C)C[S@@](C)=O 398881524 UWNFHZBPBACOIY-IDLZMACWSA-N 295.404 2.296 10 10 CECE C[C@H]1CN(C)CC[C@]1(N)c1ccc2c(c1)CCCN2C 2163099566 JKJNCBREALJHRR-SUMWQHHRSA-N 273.424 2.195 10 10 CECE C[C@H]1c2c(cnn2C)CN1c1c(F)cc(CO)cc1F 2168501812 CTYWZMGOSWJTDI-QMMMGPOBSA-N 279.290 2.272 10 10 CECE CO[C@@H]1CCCC[C@@]1(O)[C@H](N)c1ccc(N(C)C)cc1 2163146832 JGLSQUANMJGMQE-OAGGEKHMSA-N 278.396 2.073 10 10 CECE CCC[C@@H](COC)N(C)CC(=O)c1ccc(O)c(O)c1 2165968206 IWGMTXVPSCHMNQ-LBPRGKRZSA-N 281.352 2.027 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3C[C@H]2CO3)c(Cl)c1 718346110 BIMXBRQTUVOVIF-LSJOCFKGSA-N 252.745 2.337 10 10 CECE Oc1cc2c(cc1CNCC1CC3(CSC3)C1)OCO2 717911872 XAENERWTSAJYHG-UHFFFAOYSA-N 293.388 2.354 10 10 CECE CC[C@]1(C)C[C@](O)(c2ccc3c(c2)CCN3C)CO1 2132903945 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BRRYLKNMLDRPBR-LBPRGKRZSA-N 271.263 2.276 10 10 CECE CCn1ncc(CN[C@@H](C)c2cc(F)cc(F)c2O)n1 858443008 ALKOWCDOZACDTM-QMMMGPOBSA-N 282.294 2.133 10 10 CECE CNC[C@H]1CCN1c1ccc(OC)c(Br)c1 696337331 HWSRZLANAGSEOK-SNVBAGLBSA-N 285.185 2.256 10 10 CECE Cc1nnccc1NC(=O)NCc1ccc(N(C)C)cc1 763253959 NLNVEXZNPBRRNM-UHFFFAOYSA-N 285.351 2.173 10 10 CECE CCC(F)(F)CNC(=O)c1c(F)ccc(O)c1O 863939407 XUMNYNCEXNQINK-UHFFFAOYSA-N 263.215 2.012 10 10 CECE CC(=O)C(C)(C)CCC(=O)NCc1ccc(O)c(O)c1 778924639 BRAKUBOUBJKVNB-UHFFFAOYSA-N 279.336 2.109 10 10 CECE Cc1nc(NC(=O)Nc2ccc(N)cc2)n(C)c1C 1876148473 GNFAVYSPJTWYDM-UHFFFAOYSA-N 259.313 2.263 10 10 CECE CNCCC[C@H](C)N(C)C(=O)Nc1ccc(N)cc1 1876165559 PANMOOXYZXSDMD-NSHDSACASA-N 264.373 2.121 10 10 CECE O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CCCC[C@@H]2C1 789991140 ARGYZJWOLHEPHF-NXEZZACHSA-N 279.311 2.499 10 10 CECE Cc1oc(N(C)Cc2ccccc2O)nc1C(=O)O 1877526028 WAPWRQYKJNTXLI-UHFFFAOYSA-N 262.265 2.023 10 10 CECE C[C@H](NC(=O)[C@]1(N)CCC[C@H]1C)c1ccccc1O 1877587382 OEXAOTIDUAGBFJ-ZETOZRRWSA-N 262.353 2.087 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1CNC(=O)c1cc(O)cs1 899411326 HHQCSDSHTCYDRN-YKDSUIRESA-N 251.351 2.476 10 10 CECE Cc1cccc(O)c1C(=O)NCc1ccc(O)c(O)c1 1137443580 VBNLTKZAVYJUCX-UHFFFAOYSA-N 273.288 2.042 10 10 CECE CCOCCN(C)C(=O)c1cc2cc(O)c(O)cc2s1 897303834 XDWBXHMMPUFKPK-UHFFFAOYSA-N 295.360 2.421 10 10 CECE C[C@H](O)c1cc(F)c(N(C)[C@H]2CCC[C@H]2O)c(F)c1 1880487019 QDHDVVMGQZZKAG-AQUOVQTQSA-N 271.307 2.368 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@@](C)(O)C2)c(F)c1 1880929659 VZNAABHDKQFEMD-LKFCYVNXSA-N 270.323 2.336 10 10 CECE Cc1cc(N2CC[C@@H]3COC[C@H]32)ccc1C[C@@H](C)N 1899110410 IGMVDSSBWMKBJT-XNRPHZJLSA-N 260.381 2.110 10 10 CECE Cc1ccc(CC(=O)NCc2ccc(O)cc2O)cc1 1162271414 DLQUXHOZXMRPCA-UHFFFAOYSA-N 271.316 2.265 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@H]1CNCC12CCC2 1886902503 YACPKJMGTBTJTJ-ZFWWWQNUSA-N 260.381 2.433 10 10 CECE CCOc1cccc(CN[C@@H](C(=O)O)[C@@H](C)CC)c1O 75436188 BGKARMSZGMDJAY-GXFFZTMASA-N 281.352 2.380 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2COCC2(F)F)c(F)c1 1888249665 PAIWJIWLASFRPE-PRHODGIISA-N 274.286 2.316 10 10 CECE Oc1ccc(O)c([C@@H]2NCCc3cc(F)ccc32)c1 83622189 SOSFGZGSFWROAX-OAHLLOKOSA-N 259.280 2.472 10 10 CECE C[C@@H]1CC[C@@H]1NCc1ccc(N2CCN(C)CC2)c(F)c1 1323700372 OAGXEFZVCAGQRM-CJNGLKHVSA-N 291.414 2.466 10 10 CECE CN(C)[C@@H]1CCCCN(Cc2c(O)cccc2F)C1 1964584413 JLESSTZJVTWUIF-GFCCVEGCSA-N 266.360 2.447 10 10 CECE Oc1cc(F)ccc1CNC[C@H](O)c1ccsc1 1964567826 CDASFXXYLGAGDH-ZDUSSCGKSA-N 267.325 2.416 10 10 CECE CCOc1cccc(CN2CCC(C)(CN)CC2)c1O 1964654291 RWPVGXNPDLMHHZ-UHFFFAOYSA-N 278.396 2.352 10 10 CECE C[C@H](CO)[C@@H]1CCCCN1CCc1ccc(N)cc1 711259343 UIXXHSORUPCCJR-CJNGLKHVSA-N 262.397 2.294 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC(F)(F)C[C@H]1C(=O)O 713602564 XIRICQKUJSVUGZ-XVKPBYJWSA-N 289.253 2.387 10 10 CECE CCNCc1ccc(N2C[C@@H]3[C@@H](C2)C3(F)F)cc1 715472292 JONQRRFGQHFFDB-CHWSQXEVSA-N 252.308 2.497 10 10 CECE Oc1cccc(Cl)c1CNCC[C@@H](O)C(F)(F)F 717403761 ACYNWGWKYXSODN-SNVBAGLBSA-N 283.677 2.449 10 10 CECE CN(Cc1cnc2n1CCC2)c1ccc(CN)c(F)c1 719381394 LEROANXMHVZXQP-UHFFFAOYSA-N 274.343 2.064 10 10 CECE Nc1ccc(CCCN2CCO[C@@H](C(F)(F)F)C2)cc1 698858844 CIVATSPSXNPTMH-CYBMUJFWSA-N 288.313 2.465 10 10 CECE CN1CCc2cc(CN(C)C3CCC(N)CC3)ccc21 91844722 OPUHOGZWZGOMPA-UHFFFAOYSA-N 273.424 2.381 10 10 CECE CC[C@]1(CO)C[C@@H]1CNCc1cnc(SC)s1 2248734505 CUFVKOOYQNFHHA-BXKDBHETSA-N 272.439 2.363 10 10 CECE Cc1cncc(/C=C/C(=O)N(C)c2cccnc2)c1 178590546 PIESUSUNKIWVEW-AATRIKPKSA-N 253.305 2.461 10 10 CECE CCC(=O)NC[C@H](CC)NCc1ccc(OC)c(C)c1 1269360430 AQQGWMUKBFQHFX-AWEZNQCLSA-N 278.396 2.398 10 10 CECE CN(C)c1ccccc1CNC(=O)c1cc(O)cs1 1292308007 BBXGYFHVHGXGES-UHFFFAOYSA-N 276.361 2.450 10 10 CECE COc1ccc(/C=C/C(=O)NCc2ccc(O)cc2O)cc1 1299575088 XQXIXCHVVXMKEN-RUDMXATFSA-N 299.326 2.436 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3C[C@@H](CO)[C@@H]3C2)cc1 2117687510 AXJRRKHBNGRBKB-AOLWHUPESA-N 260.381 2.032 10 10 CECE Cc1cccc(CN[C@@H](C)Cc2ccnn2C)c1O 2117691905 OCAMSKNFYAAFKM-LBPRGKRZSA-N 259.353 2.155 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@H]2[C@@H]3COC[C@@H]32)c(F)c1 2118055419 RGGWXLIREOCUKU-JHEVNIALSA-N 265.328 2.208 10 10 CECE CCO[C@@H]1CC[C@@H](C(=O)NCc2ccc(N)cc2)C1 2118296527 QSHJHGOJZWKEFR-TZMCWYRMSA-N 262.353 2.090 10 10 CECE COCC1CCN(c2cc(OC)c(OC)cc2N)CC1 213470338 ZNWYPILMQZKAGV-UHFFFAOYSA-N 280.368 2.149 10 10 CECE CCN(CC)C1CN(c2cc(Cl)c(CN)cc2F)C1 2120880684 CKHNQMLRYIAGPT-UHFFFAOYSA-N 285.794 2.468 10 10 CECE C[C@@H](Sc1ccncn1)C(=O)Nc1ccc(N)cc1 104236555 YBEZTOFWPGJRMK-SECBINFHSA-N 274.349 2.178 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1cnc2cccnn12 2123006409 XOQWPQMIFPHNKD-JTQLQIEISA-N 257.301 2.004 10 10 CECE O=C(/C=C/c1ccc(O)cc1)NCc1cc(O)ccc1O 1558175605 XHBOXMVWPIJEFV-FPYGCLRLSA-N 285.299 2.133 10 10 CECE Cc1nc2cc(C(=O)NCc3c(O)cccc3O)ccc2o1 1647268683 AWTJOONHQFOLMJ-UHFFFAOYSA-N 298.298 2.477 10 10 CECE C[C@H](C(=O)NC1CCCCC1)N1CC[C@@H](N=[N+]=[N-])C1 1912155488 QIKFFAOIZGMTRJ-ZYHUDNBSSA-N 265.361 2.208 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)Cc2ccc(F)cc2F)C1 1912150818 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CCc1cccc(CN[C@H]2C[C@H]3C[C@H]2C[C@H]3O)c1O 1967760473 UJRWQXXSJKIYAR-LJISPDSOSA-N 261.365 2.204 10 10 CECE CC(C)[C@H](N)c1noc(C2=S=Nc3ccccc32)n1 1968006180 VBPLDKQLGZFBNX-JTQLQIEISA-N 274.349 2.206 10 10 CECE CCN(CCCOc1ccc(N)cc1)[C@@H](C)CN(C)C 232247846 MLENXWMBRGTAOR-AWEZNQCLSA-N 279.428 2.310 10 10 CECE COc1cc(N2CC[C@H](OC)[C@@H](C)C2)ccc1CN 2139682046 BISSOYHNBWZKAJ-FZMZJTMJSA-N 264.369 2.015 10 10 CECE Cc1ccc(CN2CC[C@H]3CCNC[C@H]3C2)c(O)c1 2139755997 NCJRKPQBKBZZOH-HIFRSBDPSA-N 260.381 2.132 10 10 CECE COc1cc(N2C[C@H]3C[C@H]2C(F)(F)C3)ccc1CN 2139700955 QDNLKCJWLATUBN-ZANVPECISA-N 268.307 2.388 10 10 CECE CCCOc1ccc(CN2CC[C@@H](OC)C2)c(O)c1 233250837 ASPZFZFUHZSSLB-CQSZACIVSA-N 265.353 2.402 10 10 CECE COc1ccc(N2CCC(C3CNC3)CC2)cc1C 2141620203 GDIOCMZUHSGXGB-UHFFFAOYSA-N 260.381 2.439 10 10 CECE C[C@H]1CCN[C@@H](c2nc(-c3ccc(O)c(O)c3)no2)C1 235698225 GNVZKIOFMGBCGC-WCBMZHEXSA-N 275.308 2.208 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@@H](C)[C@@H]2C(=O)NC)cc1 2146447685 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C[C@@H](c1ccc(O)cc1O)N1CC[C@@H](C)[C@H](CN)C1 253193725 PAVCTECQIULZDW-GRYCIOLGSA-N 264.369 2.076 10 10 CECE C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CCC1(F)F 1972332455 UANLLFWEBLZSSS-SNVBAGLBSA-N 268.307 2.315 10 10 CECE CCOc1cccc(CN[C@H]2C[C@H](COC)C2)c1O 1973131024 BKOPARBKNPBSNA-AULYBMBSSA-N 265.353 2.306 10 10 CECE CO[C@@H]1[C@@H](NCc2cccc(F)c2O)CC1(C)C 1974253217 RPQAPTPTSANEPZ-WCQYABFASA-N 253.317 2.434 10 10 CECE O=C1CCCCN1C1CN(c2ccc(CO)cc2Cl)C1 2143661612 QQHWCBBCUWZASA-UHFFFAOYSA-N 294.782 2.033 10 10 CECE CCCOc1cc(N(C)C[C@H]2CCN2)ccc1[N+](=O)[O-] 2143807362 YKJZTIAUQBDRSC-LLVKDONJSA-N 279.340 2.182 10 10 CECE NC1(c2cc3c(c(F)c2O)OCCO3)CCCCC1 258541441 LMXZRQGBZUDHNA-UHFFFAOYSA-N 267.300 2.421 10 10 CECE CCOC(=O)C[C@H]1CC[C@@H](c2ccccc2O)NC1 260142555 FAHXLNGDFIUITD-YPMHNXCESA-N 263.337 2.386 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(C)cc(F)c1O 260174311 QGXYKVUOYWISPT-LLVKDONJSA-N 255.289 2.183 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@]1(N)CCC[C@H]1C 2149449609 MWIMHBZXTQBRAB-HSMVNMDESA-N 276.380 2.429 10 10 CECE Nc1ccc(CCCN2CCN3CCCC[C@@H]3C2)cc1 158233654 FDBOYIGKZGBNTI-QGZVFWFLSA-N 273.424 2.372 10 10 CECE Nc1ccc(O)c(CNC(=O)Nc2ccc(F)cc2)c1 36743739 ZYFBHZDLBJNZBY-UHFFFAOYSA-N 275.283 2.435 10 10 CECE Nc1ccc(O)c(CNC(=O)Nc2cccc(F)c2)c1 38076217 WWWNTUWLAXCASW-UHFFFAOYSA-N 275.283 2.435 10 10 CECE CN[C@](CO)(CSc1nccs1)C(C)(C)C 1995404540 YGHNOATXSHQXCU-LLVKDONJSA-N 260.428 2.232 10 10 CECE CN(C)c1ccc([C@](C)(CO)NCC(F)(F)F)cc1 38111477 FZBJWRLNSCRPNM-LBPRGKRZSA-N 276.302 2.112 10 10 CECE CCOCC1CN(c2ccc(CO)cc2Cl)C1 2001343069 PKWALUQMVNFFAO-UHFFFAOYSA-N 255.745 2.305 10 10 CECE Nc1ccc(NC(=O)CCCO[C@H]2CCCOC2)cc1 2152504056 UKDBFZYVHOWUFP-AWEZNQCLSA-N 278.352 2.183 10 10 CECE Nc1ccc(NC(=O)N2CC[C@H]([C@H]3CCOC3)C2)cc1 2153039012 POLVMANCHXHFCA-RYUDHWBXSA-N 275.352 2.159 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3COC[C@H]32)cc1Cl 2013415009 PAYGFQDXMIRUGA-MWODSPESSA-N 253.729 2.228 10 10 CECE CN1CCc2cc([C@H](N)C[C@@H]3[C@H]4CCOC[C@@H]43)ccc21 2154705073 ABVYBAMZNPJMRS-LVQVYYBASA-N 272.392 2.351 10 10 CECE Cc1cccc(CN=c2cc(Br)nc[nH]2)c1O 2024803954 FMRVDHLCUVMMGE-UHFFFAOYSA-N 294.152 2.287 10 10 CECE CC[C@@H](CNC(=O)Nc1ccc(N)cc1)COC 2027336480 RZHDTCQCGQBNDB-JTQLQIEISA-N 251.330 2.063 10 10 CECE CCc1cnc(NC(=O)c2ccc(O)c(O)c2)s1 2029700993 DIICRVHEZLLNGD-UHFFFAOYSA-N 264.306 2.369 10 10 CECE CC[C@H](NCc1ccc(O)c(O)c1O)[C@H]1C[C@H]1C 2029900094 RKIPVXSFKXAFCJ-MIMYLULJSA-N 251.326 2.328 10 10 CECE NCc1ccc(N2CC[C@H](O)C3(CC3)C2)c(Cl)c1 2032261512 FBFDCZMANNUSNT-ZDUSSCGKSA-N 266.772 2.150 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@H](O)CF 2032850105 AXJVYOSZPCVJEL-VWYCJHECSA-N 253.317 2.169 10 10 CECE CS(=O)(=O)[C@H]1CCCC[C@H]1Nc1ccccc1N 2035394933 BISNCPFULKANEN-OLZOCXBDSA-N 268.382 2.037 10 10 CECE C[C@H]1CCN([C@H](C)c2ccc(F)cc2O)CCN1 2035745903 ASCGQCMGVJTWLZ-WDEREUQCSA-N 252.333 2.276 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@]2(C)CO)c(F)c1 2035997048 VZFHJCYLBOBGGV-IINYFYTJSA-N 252.333 2.067 10 10 CECE C[C@@H](c1c(O)cccc1O)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2 300443056 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[N-]=[N+]=NC[C@H]1CCCCN(C(=O)[C@H]2[C@@H]3CCCO[C@@H]32)C1 2355552571 PPQVNZDAASBVKH-VOAKCMCISA-N 278.356 2.350 10 10 CECE COc1ccc(N2CCN([C@H]3CCCC[C@@H]3N)CC2)cc1 54320358 CTTUYDRQBDHBRJ-IRXDYDNUSA-N 289.423 2.087 10 10 CECE CCON(CCCN=[N+]=[N-])CCNC(=O)OC(C)(C)C 1954206729 LGIQGYNMQZIGGI-UHFFFAOYSA-N 287.364 2.465 10 10 CECE Cc1ccc(N2CCCN(Cc3ccccc3O)CC2)nn1 179575280 CPXVOAMEXDZQMH-UHFFFAOYSA-N 298.390 2.203 10 10 CECE CC(C)(C)OC(=O)Nc1cc(C=O)c(O)c(O)c1F 218469124 KMDFNZJXIZHJBN-UHFFFAOYSA-N 271.244 2.396 10 10 CECE CCCCCN(CCO)Cc1cc([N+](=O)[O-])ccc1O 173404513 LMDHGLPKYUNXDG-UHFFFAOYSA-N 282.340 2.285 10 10 CECE CO[C@@H]1CCN(c2ccc(/C=C/C(=O)O)c(C)c2)C1 300098160 PWWHOTRRJLXNBA-YVARQFDVSA-N 261.321 2.318 10 10 CECE Nc1ccc(NC(=O)NCOc2ccccc2)cc1 217305303 IYPYZMVOFYRKBB-UHFFFAOYSA-N 257.293 2.427 10 10 CECE Cc1cc(N2CCNC(=O)[C@@H]2C)ccc1CNC(C)(C)C 110662095 VWOPEDIPBPGJAK-ZDUSSCGKSA-N 289.423 2.208 10 10 CECE CO[C@H]1C[C@@H]2C[C@@](O)(c3ccc4c(c3)CCN4C)[C@@H]2C1 2357064859 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10 10 CECE C[C@H](N[C@H]1C[C@H](C)n2ncnc21)c1ccccc1O 850499518 QXXCSQYRNQXEQB-NHCYSSNCSA-N 258.325 2.340 10 10 CECE Cc1nc(CN(C)C(=O)c2cccc(O)c2O)sc1C 697528271 LEMITAFDWSYIAR-UHFFFAOYSA-N 292.360 2.443 10 10 CECE CN(C)c1ccc(OCCOC2CCOCC2)cc1 863469571 DALWZCCZIZXREP-UHFFFAOYSA-N 265.353 2.327 10 10 CECE Nc1ccc(NC(=O)C(=O)N2[C@H]3CC[C@H]2CC2(CC2)C3)cc1 861508713 WODOXFUEWHZLST-KBPBESRZSA-N 299.374 2.141 10 10 CECE CNCc1ccc(N2CC[C@@H](C)[C@@](C)(O)C2)cc1C 1876952723 YZRWMUWVEJVTLM-CJNGLKHVSA-N 262.397 2.312 10 10 CECE CC[C@H](C(=O)N(C)[C@@H](C)c1ccccc1O)C(N)=S 1877529919 XKLHTXFCAQFAAP-UWVGGRQHSA-N 280.393 2.224 10 10 CECE COc1cc(C)cc(CN2CC3(CCCOC3)C2)c1O 894975662 DISPBEPZXPYNLP-UHFFFAOYSA-N 277.364 2.322 10 10 CECE Oc1cccc(Cl)c1CN1CCC2(CC1)COCCO2 895696551 VAVCSCGBLDIXFR-UHFFFAOYSA-N 297.782 2.427 10 10 CECE COc1cc(C)cc(CNCC2=CCOCC2)c1O 894872990 DWWSPAALRASXEW-UHFFFAOYSA-N 263.337 2.146 10 10 CECE O=C(NCCC[C@@H]1CCCC[C@H]1O)c1cccc(O)c1O 790898095 UTCRJTFWVIYGDX-WCQYABFASA-N 293.363 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C[C@@H](N)c1cnc(Sc2ncc3n2CCC3)s1 2007875115 OGRABKZNKIMKDZ-SSDOTTSWSA-N 266.395 2.457 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC[C@@]2(C)CO)cc1O 2153560585 OHHAYSHHIMBXPX-LRDDRELGSA-N 278.396 2.414 10 10 CECE CNCc1ccc(OCC(=O)N2CCCCC2)c(C)c1 2155018192 BVIRXMLAQBKOJB-UHFFFAOYSA-N 276.380 2.106 10 10 CECE Cc1cnc(S[C@@H](C)C(=O)Nc2ccc(N)cc2)nc1 48771493 CHJBMTHBMRLDFO-JTQLQIEISA-N 288.376 2.487 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CCN[C@@H]2CC[C@H]21 2016999917 OUKRUEINVWKLKK-GGZOMVNGSA-N 251.761 2.475 10 10 CECE CNCc1ccc(OC)c(CN2CCC(OC)CC2)c1 50124786 LKCMFKSGAGJLJK-UHFFFAOYSA-N 278.396 2.025 10 10 CECE CNCc1ccc(N2CCN(CC3CC3)CC2)c(C)c1 50561542 KSHRTIWZQGYLCM-UHFFFAOYSA-N 273.424 2.246 10 10 CECE COCc1nc(CNCc2ccc(F)cc2O)cs1 294026466 VHNXNGIOQNFNRB-UHFFFAOYSA-N 282.340 2.424 10 10 CECE C[C@]12CSC[C@H]1CN(CCc1ccc(N)cc1)C2 2028144401 VGMFETFFWMKCKC-HIFRSBDPSA-N 262.422 2.496 10 10 CECE Cc1scnc1C(=O)NCCc1ccc(N)cc1 2030143907 GLVFHFNSSCFHFW-UHFFFAOYSA-N 261.350 2.006 10 10 CECE CC[C@H](C)N(CCO)CCCc1ccc(N)cc1 2030157352 NUTPMWQTVMKVMJ-ZDUSSCGKSA-N 250.386 2.294 10 10 CECE CC1(C)COCC[C@@H]1NCc1ccc(O)c(O)c1 2031925921 WUMSAUHGKRUDJF-ZDUSSCGKSA-N 251.326 2.003 10 10 CECE C[C@H](N[C@@H]1[C@@H]2CCOC[C@H]21)c1cc(F)ccc1O 2032744277 KESGZWCVHIRPDB-NVBBAKCQSA-N 251.301 2.217 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CC[C@H](C(=O)O)C1(C)C 2160046437 RFPZOLDZVPIFMD-BXKDBHETSA-N 279.336 2.344 10 10 CECE C[C@@H]1NC[C@H](C)N([C@@H](C)c2c(O)cccc2O)[C@@H]1C 401432228 VCFMCNMIIVLIHD-YFKTTZPYSA-N 264.369 2.230 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1ccc(O)cc1F 404118479 LCMVHGCXGCWFLJ-NSHDSACASA-N 282.275 2.035 10 10 CECE NCc1ccc(N2CCC[C@H]2CCO)cc1Cl 310306245 PANMREQXIQOZFC-NSHDSACASA-N 254.761 2.150 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CCC3)c(Cl)cc21 310768339 LXFTUAQTQNARRI-LBPRGKRZSA-N 265.744 2.153 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](N(C)C)[C@@H]2C)c(F)c1 311706462 MZLJEXFPSYXUCE-MJVIPROJSA-N 265.376 2.374 10 10 CECE Cc1ccc([C@@H](C)N[C@H](C)CC(=O)N(C)C)c(O)c1 312097058 FRMKFRMQPKEXNA-VXGBXAGGSA-N 264.369 2.218 10 10 CECE CN1CCCc2cc(CN[C@@](C)(CO)C(F)F)ccc21 2161378118 WTFQPEZCFYULFD-HNNXBMFYSA-N 284.350 2.175 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@]1(C)CNC[C@@H]1C 702046535 VAYCUOBSGDRFQA-OZVIIMIRSA-N 276.380 2.157 10 10 CECE CC(C)[C@@H](CCO)NCc1ccc(F)c(F)c1O 703366458 VLDPZTOFETYTLD-LLVKDONJSA-N 259.296 2.167 10 10 CECE C[C@@H](N)c1ccc(N2CCN([C@@H]3CCSC3)CC2)cc1 2171550657 IUYPHRYXXSRWRU-CZUORRHYSA-N 291.464 2.334 10 10 CECE CCCNCc1ccc(N2C[C@H](C)[C@@H](CO)C2)c(F)c1 708179028 XZWWCZPOBRFPAB-GXTWGEPZSA-N 280.387 2.390 10 10 CECE Oc1c(F)cc(F)cc1CN1CCC[C@H]2COC[C@H]21 708442579 NFVMNUXKWRVKRX-TVQRCGJNSA-N 269.291 2.281 10 10 CECE C[C@H]1CN(Cc2c(O)ccc3ccccc23)CC[S@]1=O 2171993827 QJOYZMQOXQQKJH-FKIZINRSSA-N 289.400 2.498 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H]2CNCC2(F)F)cc1 2163097678 QCGJSJACQSCQMO-KBPBESRZSA-N 284.350 2.421 10 10 CECE CCN1CCc2cc([C@@H](CCOC(C)C)NN)ccc21 2163133383 MMLYALXOBKTTBH-OAHLLOKOSA-N 277.412 2.389 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1CC12CCOCC2 692875945 DSRSKAAHUIKZNK-QWRGUYRKSA-N 264.329 2.104 10 10 CECE CN(C[C@@]12CCC[C@@H]1C2)C(=O)COc1ccc(N)cc1 693854445 WWRWQGZDMZHUSD-WBMJQRKESA-N 274.364 2.296 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H]3CNC[C@@H](C3)C2)c1 719049000 HRLQTTXEZUTASU-YNEHKIRRSA-N 276.380 2.003 10 10 CECE COCC(COC)NCc1c(O)ccc2ccccc12 388513240 SKEAJDYDSHPEBQ-UHFFFAOYSA-N 275.348 2.296 10 10 CECE CC[C@H](COc1ccc(N2CCC(N)CC2)cc1)OC 397033094 POGNYIVTFWCFDE-OAHLLOKOSA-N 278.396 2.418 10 10 CECE COc1ccc([C@H](C)N(C)[C@@H](C)C[S@@](C)=O)c(O)c1 399860752 LQUFEGIQHJLDFJ-ZHYXMNDGSA-N 285.409 2.161 10 10 CECE CC(C)(C)[C@@]1(O)CCN(c2c(F)cc(CN)cc2F)C1 2177587528 OIUDWVRFALJUGB-OAHLLOKOSA-N 284.350 2.411 10 10 CECE CCN[C@H](c1ccccc1O)[C@@](C)(O)[C@@H]1CCCOC1 2168332184 AXGKABWBBCFQMZ-WQVCFCJDSA-N 279.380 2.220 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H](F)CC3CNC3)ccc21 2178560125 ZBUZEHRKHRXJQZ-GDBMZVCRSA-N 278.371 2.050 10 10 CECE CCN(CC)c1ccc([C@H](N)c2ccc(=N)[nH]c2)cc1 2169166686 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CECE CNCc1ccc(N2CC(N(C)CC(C)C)C2)c(F)c1 2192540577 FJQPVJFNBXHHFI-UHFFFAOYSA-N 279.403 2.322 10 10 CECE C[C@H](NC(=O)[C@@H]1C[C@@H]2CCC[C@H]2N1)c1ccccc1O 2192621560 DGZBEWUTDJWUGP-VTPLQMEGSA-N 274.364 2.100 10 10 CECE Nc1ccc(NC(=O)CCN2CC[C@H]3CC[C@H]3C2)cc1 2188537502 UYFRSVHCIQBHMF-OLZOCXBDSA-N 273.380 2.329 10 10 CECE C[C@@H]1OCC[C@@H]1CCOC(=O)COc1ccc(N)cc1 2196505498 VJBXKWAFBWJTEV-NWDGAFQWSA-N 279.336 2.006 10 10 CECE FC(F)COc1ccc(N2CC([C@@H]3CCNC3)C2)cc1 2196642535 XBPHEYOIVCROOQ-LLVKDONJSA-N 282.334 2.376 10 10 CECE Oc1c(CN[C@@H]2C[C@@H]3[C@@H]2[C@H]2CC[C@H]3O2)ccc(F)c1F 2188742043 UCSYEZSXJIIGAO-ODSNKANHSA-N 281.302 2.326 10 10 CECE Cc1ncn(CCNCc2cc(F)cc(F)c2O)c1C 2193295596 POWJXXZYSPXHRX-UHFFFAOYSA-N 281.306 2.274 10 10 CECE N[C@H]1CCC2(CCC2)N(c2ccc3c(c2)OCCO3)C1 2193434598 HRWGVIMEXGBAAR-LBPRGKRZSA-N 274.364 2.308 10 10 CECE CC[C@@H](COC)[C@H](NN)c1ccc(N2CCCC2)cc1 2193476073 UYBHBATXFULPAT-BBRMVZONSA-N 277.412 2.464 10 10 CECE CCCN(c1ccc(CN)cc1)[C@@H](COC)C(C)(C)O 2197241697 NSMHUBWYGZDEAK-HNNXBMFYSA-N 280.412 2.148 10 10 CECE C[C@@H]1[C@H](NCc2cc(F)cc(F)c2O)CCN(C)[C@@H]1C 2193652640 QBKKNJQIBKUIOH-IMSIIYSGSA-N 284.350 2.489 10 10 CECE C[C@@H](CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N)C(F)F 2183946108 JFGSRQNAFIXHQV-QPUJVOFHSA-N 283.322 2.000 10 10 CECE O[C@H]1C[C@@H]2C[C@H](C1)CN2c1ccc2c(c1)CCC[C@H]2O 2184689811 TWCCECKRKPWUJX-HVDRQEDPSA-N 273.376 2.406 10 10 CECE CCCN[C@@H]1CCc2cc(N3C[C@H](C)[C@@H](O)C3)ccc21 2184743355 JGMPUYMSRGPMPW-VUCTXSBTSA-N 274.408 2.491 10 10 CECE O[C@H]1CCc2cc(N3CCCN4CCC[C@H]4C3)ccc21 2184741313 HVUIBYCIUCAJQY-RDJZCZTQSA-N 272.392 2.341 10 10 CECE N[C@@H]1CCc2cc(N3CCCN(C4CC4)CC3)ccc21 2184726327 OFKRHLVNIRKGOP-QGZVFWFLSA-N 271.408 2.307 10 10 CECE CN1CC[C@H]2CC[C@@H](C1)N2c1ccc2c(c1)CC[C@H]2N 2184722350 XPIONHREZKUCHN-UKPHBRMFSA-N 271.408 2.306 10 10 CECE CN(Cc1ccnc(Cl)n1)c1ccc(CN)cc1 2043031432 HGGFARYMVCPYDZ-UHFFFAOYSA-N 262.744 2.225 10 10 CECE CC[C@@H]1CNCCCN1c1ccc(OC)cc1F 2044305392 QXQZZTNROPMTLR-LLVKDONJSA-N 252.333 2.413 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(Cl)c2)CC[C@@H]1CO 2046692023 ZAMWRNOQXQORLK-ZYHUDNBSSA-N 268.788 2.253 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)Cc2ccnn2C)c(F)c1 2194515255 FZVQGCSRDDYACV-SECBINFHSA-N 281.306 2.388 10 10 CECE C[C@@H](O)c1ccc(N2CCN(C)[C@@H]3C[C@H]32)cc1Cl 2049407858 JQOXJYANYJEZAW-OWYVNGRQSA-N 266.772 2.286 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H](O)[C@H](C3CC3)C2)c(F)c1 2194692631 VWNDWJXNBYIMST-YLGCSUCGSA-N 282.334 2.192 10 10 CECE Cc1ccc(O)c([C@@H](C)NCC[C@@H]2CCN(C)C2=O)c1 2194699047 DAFUVRHCFBHEPY-CHWSQXEVSA-N 276.380 2.220 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@H](C)[C@@H](N(C)C)C2)c(F)c1 2194699289 GGTSHECCBOZRQQ-BHDSKKPTSA-N 283.366 2.371 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@](C)(O)[C@](C)(O)C2)c(Cl)c1 2194617640 HBDQSOSAQXLTMM-VCTAVGKDSA-N 299.798 2.105 10 10 CECE CC[C@@]1(C)CC(=O)N1Cc1cc(CNC)ccc1OC 2191159209 WMUPYHRIWPATFP-INIZCTEOSA-N 276.380 2.316 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H]3COC[C@@H]32)cc1O 2198564538 KODQBPFEVSZGMZ-JMSVASOKSA-N 276.380 2.288 10 10 CECE 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CC(C)CCS(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1 2227882350 LZRYEZRHZWCRBG-UHFFFAOYSA-N 288.325 2.088 10 10 CECE Nc1ccc(N2CCN(CC3CC(F)C3)C2=O)cc1 2228418571 AKLMWTPWAAXDOC-UHFFFAOYSA-N 263.316 2.259 10 10 CECE Nc1ccc(C[C@H](O)c2cnc(C3CC3)nc2)cc1 2229449582 YZCKXRBZOGUGPV-AWEZNQCLSA-N 255.321 2.212 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)[C@H]1CCCC[C@@H]1O 2239635092 BOFYMRXUDKABTB-STQMWFEESA-N 299.392 2.054 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC3(CN(C)C3)C2)cc1 2240031581 RBKJKUFMHOFUFE-CQSZACIVSA-N 273.424 2.327 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC(CO)C2)cc1OC 2240060028 YCOZRXKOEIOFKI-GFCCVEGCSA-N 278.396 2.012 10 10 CECE CN(c1ccc(CNC2CCC2)cc1)C(C)(C)C(N)=O 2240075629 IAXPCZJILMQDFK-UHFFFAOYSA-N 275.396 2.029 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)N2CC(F)(F)C2)CC1 2254207367 YUSNEABFSPVQTQ-MRVPVSSYSA-N 259.260 2.222 10 10 CECE Cc1cc(N(C)C[C@@H]2COCCCO2)ccc1[C@H](C)N 2285139197 NJVQCESMCYHUDU-DZGCQCFKSA-N 278.396 2.256 10 10 CECE CSc1ncc(CNC[C@]2(N)CCC[C@@H]3C[C@H]32)s1 2257109331 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IVNNGPSCDRTYEM-SOUVJXGZSA-N 274.408 2.436 10 10 CECE C[C@H](N=c1[nH]c(C2CC2)ncc1N)c1ccccc1O 2286673437 FHXJVCBWKXPIDF-VIFPVBQESA-N 270.336 2.237 10 10 CECE CC(C)(C)c1ncc(N)c(=NCc2ccccc2O)[nH]1 2286753401 PGQAIENKPLSYGB-UHFFFAOYSA-N 272.352 2.096 10 10 CECE Cc1ccc(CN(C)C2CC(N)C2)c(O)c1Br 2307473566 IBHMVKHEXXCNDX-UHFFFAOYSA-N 299.212 2.385 10 10 CECE C[C@@H]1CC2CC(C(=O)N(C)CCCN=[N+]=[N-])(C2)O1 2319518657 GCYXZPNXUSYAIR-GRZMOONWSA-N 252.318 2.103 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H]3CO)cc1C 2329062459 PPRAFDOIOFAHGC-BMFZPTHFSA-N 260.381 2.064 10 10 CECE CN(C)c1ccc([C@@H](N)[C@]2(O)CC[C@@H]3CC[C@@H]32)cc1 2329488753 GCIBXUPCAWYCNI-KSYCFECVSA-N 260.381 2.304 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3CC[C@H](O)[C@H]2C3)cc1 2330958393 RBYWFGWQBXTSIG-RKLWJJNISA-N 260.381 2.446 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]3CO)cc1 2333105179 QQSCAAVFMOZKDT-UKMLZYKCSA-N 260.381 2.174 10 10 CECE CCCc1nnsc1CNCc1ccc(O)c(O)c1 2336017339 BNVQMNOBWGPTJJ-UHFFFAOYSA-N 279.365 2.192 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@H]2COC3(CCC3)CO2)C1 2338093485 SFXBLCBJARCVMF-NEPJUHHUSA-N 266.345 2.099 10 10 CECE C[C@@H](c1ccccc1O)N(C)[C@H]1CCNCC1(F)F 2338736808 YFHQGBXVMKZWBN-GWCFXTLKSA-N 270.323 2.382 10 10 CECE CNCc1ccc(N2CC[C@@H](O)[C@H]2C)cc1C1CC1 2339155827 OUXYWWKNEZUZIW-BDJLRTHQSA-N 260.381 2.243 10 10 CECE CCN(CCN(C)C)c1ccc(CN)c(C2CC2)c1 2339158252 SZAZJBNEDJHZLB-UHFFFAOYSA-N 261.413 2.411 10 10 CECE CN[C@H]1CCCN(c2ccc3c(c2)COCC3)CC1 2340084483 IOUXIMOGHNKRTK-HNNXBMFYSA-N 260.381 2.338 10 10 CECE COc1cc(Cl)c(N2C[C@H]3CC[C@H]2[C@H]3N)c(OC)c1 2342306178 HKPPLKSWTXUTJG-WLTAIBSBSA-N 282.771 2.283 10 10 CECE Cc1cccc(O)c1CNC[C@@]1(O)C[C@H]1C(F)(F)F 2344249132 FQCPYCNLAXERLJ-NEPJUHHUSA-N 275.270 2.104 10 10 CECE CCNCc1ccc(N2CC[C@H](O)[C@H](C)[C@H]2C)cc1 2344574186 KSEDRFLWNMXCAQ-IOASZLSFSA-N 262.397 2.392 10 10 CECE CCN(CC)c1ccc([C@@H](NN)[C@@H]2OCC[C@@H]2C)cc1 2354609867 QPDYNSGMGVSYQZ-APHBMKBZSA-N 277.412 2.462 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3[C@@H](N)[C@H]4CCC[C@@H]43)ccc21 2355385404 LPBLDQCKBXUIOM-PTTAZLHSSA-N 272.392 2.086 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3CCO[C@@H]32)ccc1C[C@@H](C)N 2355551085 RHUCXJDMZHIYJB-ZCPGHIKRSA-N 274.408 2.356 10 10 CECE CC(C)CN1C(=O)CC[C@H](N)[C@H]1c1ccc(N(C)C)cc1 62212626 JBTHJWIZYXODQJ-DOTOQJQBSA-N 289.423 2.399 10 10 CECE CCN[C@H](C)c1ccc(N2CCNC(=O)[C@H]2CC)c(F)c1 110680256 RELLTGYWQCKRSU-BXUZGUMPSA-N 293.386 2.211 10 10 CECE CC[C@H]1COCCN1c1c(F)cc(CN)cc1F 62711239 UHCGIXYMFPBEDK-JTQLQIEISA-N 256.296 2.039 10 10 CECE CCN(CCO)c1ccc([C@H](C)N)cc1Br 61695965 VLAHIUXQRGREGI-VIFPVBQESA-N 287.201 2.287 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@H]2C[C@@H](OC)C[C@H]21 2357080068 WGUZDAIJJZBMSF-HKUMRIAESA-N 277.364 2.304 10 10 CECE CCN1CCCN(c2ccc(CNC)cc2C)CC1 307875160 ZHXRIVCUSSHZSH-UHFFFAOYSA-N 261.413 2.246 10 10 CECE NCc1ccc(N(CC(=O)NC2CCCC2)C2CC2)cc1 34655574 JTYYWWRYICTKGM-UHFFFAOYSA-N 287.407 2.173 10 10 CECE CC(C)[C@@H]1C[C@H]1[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2357850383 ZIMDZQJUEJJOKO-HDEZJCGLSA-N 274.408 2.332 10 10 CECE CCN1CCN(c2ccc(/C=C\C(=O)O)cc2)C[C@@H]1C 215409788 YSCNYMNCQRWUML-XURPKSDJSA-N 274.364 2.315 10 10 CECE Nc1ccc(OCCSCC(=O)N2CCCC2)cc1 311370230 FURRMERXPAITIH-UHFFFAOYSA-N 280.393 2.003 10 10 CECE COC(=O)c1cccc(N)c1N[C@H](C)[C@@H]1CCCO1 130112076 VURWJSXHFAZFHC-SKDRFNHKSA-N 264.325 2.035 10 10 CECE CNCc1cc(F)c(F)c(Br)c1O 214504341 KBLMMUHWCXUAON-UHFFFAOYSA-N 252.058 2.152 10 10 CECE CN[C@@](C)(CCCCN(C)c1ccc(OC)cc1)C(=O)O 49972141 LXVSOVVEAZEKGF-INIZCTEOSA-N 294.395 2.364 10 10 CECE O=C1C[C@H](c2ccccc2)C(=O)N1Cc1ccccc1O 228430235 KCNGWCZQNVSNBN-CQSZACIVSA-N 281.311 2.435 10 10 CECE Cc1ncnc(COCCc2ccc(N)cc2)c1C 2141579500 LNRCQESAEXRHNB-UHFFFAOYSA-N 257.337 2.435 10 10 CECE CN(Cc1cccc(F)c1O)C[C@@H]1CCCN1C 160248439 CJXPEDWATPABOR-LBPRGKRZSA-N 252.333 2.057 10 10 CECE COCCN(CC(C)C)[C@H](CN)c1ccc(N(C)C)cc1 42368595 IKWSGXVXRZYGGE-QGZVFWFLSA-N 293.455 2.357 10 10 CECE COc1ccc(N2CCN(C(=O)N(C)C(C)C)CC2)cc1 190631381 GUMVHHFTQTYBHG-UHFFFAOYSA-N 291.395 2.277 10 10 CECE CCC[C@@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 195171756 FIOSBEFKSQOWGW-OAHLLOKOSA-N 275.396 2.030 10 10 CECE Nc1cc(O)ccc1NS(=O)(=O)C1CCCCC1 236348688 HLHXLDCBQWYTEK-UHFFFAOYSA-N 270.354 2.049 10 10 CECE COc1ccc([C@@H](NCCCN=[N+]=[N-])C(=O)O)cc1OC 90259157 KSZSZMZJBFJDQY-GFCCVEGCSA-N 294.311 2.120 10 10 CECE COc1ccc(Br)c([C@@H](N)C(F)F)c1O 238432230 PXGHJAGFVBUUSA-SSDOTTSWSA-N 282.084 2.428 10 10 CECE CNCc1ccc(N2CCC[C@H]2CO)cc1Cl 234445633 JEXNVRMYKOCDHW-LBPRGKRZSA-N 254.761 2.021 10 10 CECE Oc1cc(Cl)c(Br)cc1[C@@H]1CNCCN1 238688125 STKBHLKTIAXZGQ-VIFPVBQESA-N 291.576 2.042 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1c(Cl)cccc1Cl 90258133 CRVKVGMLBGNSGD-SECBINFHSA-N 288.138 2.420 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCc2ccccc21 90258832 RRFUUSCDYUGNCB-ZDUSSCGKSA-N 260.297 2.203 10 10 CECE Nc1ccc(NC(=S)NCc2ccc(CO)cc2)cc1 243291335 LDMOPBWDOLMFHE-UHFFFAOYSA-N 287.388 2.248 10 10 CECE CCOc1cccc(CN2C[C@@H]3CNC[C@@H]3[C@H]2CC)c1O 251471999 BNFDGJVWNYYWSP-SOUVJXGZSA-N 290.407 2.221 10 10 CECE C[C@H](N)c1c(F)cc(O)c(O)c1Br 258249843 AVALKPQMUWKTRB-VKHMYHEASA-N 250.067 2.019 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1C(=O)O 252504903 RYCPNGGUOHYRTE-DTWKUNHWSA-N 269.728 2.198 10 10 CECE CCOCC1CN(c2ccc([C@H](C)O)cc2[N+](=O)[O-])C1 2165851489 NTPZPOIHYOUPLZ-JTQLQIEISA-N 280.324 2.121 10 10 CECE CN(C[C@H]1CC12CC2)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2165874078 GFRLUAXKRXXLKB-AMIZOPFISA-N 276.311 2.048 10 10 CECE C[C@@H]1C[C@@H]1CS(=O)(=O)N(Cc1ccc(N)cc1)C1CC1 2164637068 MEPDINJQWNBQQN-DGCLKSJQSA-N 294.420 2.219 10 10 CECE CN(c1ccc2c(c1)OCCCO2)[C@H]1CCC[C@H]1CN 2162633351 XRFQOFIAPIUCGW-JSGCOSHPSA-N 276.380 2.412 10 10 CECE C[C@H](N[C@@H]1CCn2nccc2C1)c1ccc(F)cc1O 2165193480 IYVJEWJEWNCHQA-CMPLNLGQSA-N 275.327 2.393 10 10 CECE CCN1CCc2cc([C@@]3(N)CCN4CCC[C@H]43)ccc21 2163061302 HDNUPZVYKGQEQL-IRXDYDNUSA-N 271.408 2.091 10 10 CECE Cn1cc(NC(=O)c2cc(O)cs2)c(C2CC2)n1 812688433 OIEGAGNUKLWHEU-UHFFFAOYSA-N 263.322 2.317 10 10 CECE C[C@@H]1CN([C@@H](C)c2c(O)cccc2O)C[C@H]1CC(=O)O 722652949 KLSPGUNFXLTKNH-OUAUKWLOSA-N 279.336 2.201 10 10 CECE CC(=O)[C-]1NC(c2sc#cc2Cl)=S=C1C 725456370 PSJGGTHIVWIZAY-UHFFFAOYSA-N 256.759 2.130 10 10 CECE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]3C[C@@H]32)cc1 822856060 FCBAEEHXYSEJIP-PWSUYJOCSA-N 272.308 2.474 10 10 CECE CC[C@H](NC)c1ccc(N(CC(N)=O)CC(C)C)cc1 723157603 CSRXURUVPLBHGX-HNNXBMFYSA-N 277.412 2.305 10 10 CECE Nc1ccc(O)c(CNC(=O)C2(CC3CC3)CC2)c1 2133305962 LFVQPHANVWJNRD-UHFFFAOYSA-N 260.337 2.171 10 10 CECE COc1ccc(O)c(CNC[C@H](C)[C@@H]2CCCO2)c1 720547921 NCICBTPFGPMFII-NHYWBVRUSA-N 265.353 2.306 10 10 CECE CC[C@H](N)c1ccc(N(CC(N)=O)C2CCCC2)cc1 723174227 AAEWVHUNKJHAAQ-HNNXBMFYSA-N 275.396 2.331 10 10 CECE C[C@@H](NCC[C@@H]1CC(=O)N(C)C1)c1c(O)cccc1F 903210709 MNWAIQFEWWKDFZ-GHMZBOCLSA-N 280.343 2.050 10 10 CECE CC(C)(C)c1cnc(SC[C@@]2(C)NC(=O)NC2=O)s1 917216690 CBUNEFWGKCXATN-GFCCVEGCSA-N 299.421 2.131 10 10 CECE CN(C)c1ccc(/C=C\CN[C@H](CN)C2CC2)cc1 841027937 GSPMMPFOQQDGGV-MJSXRHKHSA-N 259.397 2.093 10 10 CECE Cc1cc(O)c(CNC[C@@H](O)C2CCOCC2)c(Cl)c1 840897557 BCMHPJMPRIFTBT-OAHLLOKOSA-N 299.798 2.231 10 10 CECE Cc1cc(Br)cc(CN2CC[C@H](N)[C@@H]2C)c1O 841024172 JFLDMNQMILCIHJ-CABZTGNLSA-N 299.212 2.385 10 10 CECE C[C@H](NCC[S@](=O)CC(F)(F)F)c1ccccc1O 850495682 HFRMVJJJXVXNOC-UGZDLDLSSA-N 295.326 2.354 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2ccc(N)nc2)c1 930216438 HWAUSRIDDHCYEI-SNVBAGLBSA-N 273.336 2.229 10 10 CECE CO[C@H](CNC(=O)N[C@@H](C)c1ccccc1O)C(C)C 868381504 SWTQWQWSDKBDLO-SMDDNHRTSA-N 280.368 2.423 10 10 CECE CC[C@@H]1NCC[C@H]1N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 863543521 PTYOBEVAMGLGDW-TVYUQYBPSA-N 279.340 2.092 10 10 CECE C[C@H](NC(=O)[C@@]1(C)CCCO1)c1ccc(N(C)C)cc1 773022225 GIVHIEGLMBXBDL-BLLLJJGKSA-N 276.380 2.499 10 10 CECE C/C(=C/C(=O)N(C)c1cnccc1C)c1cnccn1 1127824339 AUTPTEQFKDRIAO-WQLSENKSSA-N 268.320 2.246 10 10 CECE CO[C@@H](CCNC(=O)c1cc(O)cs1)C(F)(F)F 788006803 BJLPRCDSLKGEEL-QMMMGPOBSA-N 283.271 2.151 10 10 CECE Cc1cc(N(C)Cc2nnccc2C)ccc1CO 1877920262 UOGBXFOQSGPIIT-UHFFFAOYSA-N 257.337 2.222 10 10 CECE CC[C@H](CNCc1cc(Cl)c(F)cc1O)C(=O)OC 895126623 BZGZWYKRRILWJF-MRVPVSSYSA-N 289.734 2.474 10 10 CECE CCNCc1ccc(N(C)C2CC(CO)C2)c(F)c1 1879171203 DGKSWAWNEGKKNJ-UHFFFAOYSA-N 266.360 2.142 10 10 CECE CN(CCN(c1ccc(CN)cc1)C1CC1)C1CC1 1879258571 LNTKKBFMMVMHBO-UHFFFAOYSA-N 259.397 2.208 10 10 CECE COC(=O)[C@@H]1CCC[C@@H]1NCc1cc(F)cc(F)c1O 895349431 GFQJLURSGSEMCZ-PWSUYJOCSA-N 285.290 2.102 10 10 CECE Cc1cc(Cl)nc(C(=O)NCc2ccc(O)c(O)c2)c1 1137443129 CTLFLZJWZJQCCI-UHFFFAOYSA-N 292.722 2.385 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCC[C@](C)(O)C2)c(F)c1 1880480037 SHXDEBDJMIKEHT-OTYXRUKQSA-N 271.307 2.369 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CCCn2ncnc21 1883185165 SDQDVALVVCNLKT-LLVKDONJSA-N 278.743 2.262 10 10 CECE CCC(=O)[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(O)c1 1151230012 KOWXTCWWXLLRRA-LBPRGKRZSA-N 291.347 2.001 10 10 CECE CN1CC[C@H](NCc2ccc(F)cc2O)C(C)(C)C1 1964592632 WXUZDEWZDAQHBB-AWEZNQCLSA-N 266.360 2.351 10 10 CECE CC(C)CC1(NS(=O)(=O)Cc2ccc(N)cc2)CC1 701468959 UTYHAMFCHXQDRT-UHFFFAOYSA-N 282.409 2.267 10 10 CECE CSc1cc(Cl)nn(-c2ccc(N)cc2)c1=O 82317873 IQMSXBADHBPMPR-UHFFFAOYSA-N 267.741 2.190 10 10 CECE Cc1ccc(O)c([C@H]2NCCc3cc(O)c(O)cc32)c1 83621030 RBDLTALDZKGHAU-INIZCTEOSA-N 271.316 2.347 10 10 CECE COc1ccc(N2CCCC[C@H]2C(=O)O)cc1OC 84640164 REQMQFRQQFCMQU-NSHDSACASA-N 265.309 2.147 10 10 CECE CN(C)c1ccc(CN(C)[C@H]2C[C@H]3CN[C@@H](C3)C2)cc1 709028385 ZTCTUAAIANBLKG-ZOBUZTSGSA-N 273.424 2.325 10 10 CECE C[C@H]1CN[C@@H](C2CC2)CN1c1ccc(CN(C)C)cc1 689492760 QUXWCDYUWOTEKI-SUMWQHHRSA-N 273.424 2.325 10 10 CECE CN1CCc2cc(CN[C@@H]3CN(C)C(C)(C)C3)ccc21 694129330 XQFKLQODEDRPDM-HNNXBMFYSA-N 273.424 2.251 10 10 CECE C[C@@H]1CCN(c2ccc(CN)c(F)c2F)C[C@@H](C)O1 694854297 AAPFHRIKGXJBGX-NXEZZACHSA-N 270.323 2.427 10 10 CECE Cc1cncc(C(=O)Nc2ccc(O)cc2C(=O)O)c1 88448873 SVPXUXRYGFENOI-UHFFFAOYSA-N 272.260 2.046 10 10 CECE CC(C)(C(=O)NCCc1ccc(N)cc1)C(F)F 698466142 HIOVKEPASJPCPW-UHFFFAOYSA-N 256.296 2.219 10 10 CECE CC[C@](O)(C(=O)C(C)=O)c1ccc(Br)cc1 1919083642 JJGXTOKWMBFCDO-GFCCVEGCSA-N 285.137 2.205 10 10 CECE Cc1cc(N(CC(F)(F)F)C2COC2)ccc1CCN 2196632650 VJIDOHMIGGANFH-UHFFFAOYSA-N 288.313 2.264 10 10 CECE CS[C@@H]1CCC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1444074600 BNOBYCBVQULRGE-NWDGAFQWSA-N 295.404 2.431 10 10 CECE O=C(CCc1cscn1)NCc1c(O)cccc1F 1456083148 DBCUMTGWXOFGBU-UHFFFAOYSA-N 280.324 2.237 10 10 CECE COC[C@H]1CN(c2c(F)cc(CN)cc2F)C[C@@H]1C 2118637485 RYKISFRQCUIBFS-GXSJLCMTSA-N 270.323 2.142 10 10 CECE COc1cc(N2CC(=O)CC[C@@H]2C)cc(OC)c1OC 1542992614 XAJDXLYMTWWAPF-JTQLQIEISA-N 279.336 2.270 10 10 CECE CN(C[C@H]1[C@H]2OCCC[C@H]12)c1ccc(CN)cc1F 2119943263 RFNXRLFSOULHSV-JMSVASOKSA-N 264.344 2.146 10 10 CECE CC(C)[C@H]1CNCCN1Cc1ccc(N(C)C)cc1 107092243 IYPJHSBCUWOLCJ-MRXNPFEDSA-N 261.413 2.182 10 10 CECE Cc1ccc(O)c(CN2CC(C)(CCC(=O)O)C2)c1 2123260211 FNSMHRKNTKOEQA-UHFFFAOYSA-N 263.337 2.387 10 10 CECE COc1ccc(N2CCC[C@H]2CCO)cc1OC 259159622 FYNYOFAEZUFVOO-NSHDSACASA-N 251.326 2.055 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1Cc2ccccc21 1630573003 IGCIHGGAVJNNEU-CYBMUJFWSA-N 283.327 2.096 10 10 CECE O=C(NCc1cccc(Cl)c1O)c1coc(CO)c1 1640404552 CKYYSRYSVXRZHM-UHFFFAOYSA-N 281.695 2.061 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)c1ccon1 2124234073 YICXTMVSCHSORT-HNNXBMFYSA-N 257.337 2.366 10 10 CECE COc1ccc(C(=O)N2Cc3cccc(O)c3C2)c(O)c1 1644088357 QVBKHQTVITWDKA-UHFFFAOYSA-N 285.299 2.262 10 10 CECE C[C@@H](NC(=O)CCN1CC[C@H](F)C1)c1ccccc1O 1642827654 NTPJSPISLVSADB-NEPJUHHUSA-N 280.343 2.003 10 10 CECE C[C@H]1CN(c2ccc(C=CC(=O)O)cc2)C[C@@H](C)N1C 1911815304 YHBSUCHVDYPSPM-BETUJISGSA-N 274.364 2.313 10 10 CECE CN(c1c(F)cc(C=CC(=O)O)cc1F)[C@@H]1CCOC1 1911930301 LRXDZBFNQRFOJH-SNVBAGLBSA-N 283.274 2.288 10 10 CECE Cc1ccc(S(=O)(=O)N2CC[C@@H](N=[N+]=[N-])C2)cc1C 1912183419 OYZBQSVNHABCTD-LLVKDONJSA-N 280.353 2.377 10 10 CECE C[C@]1(C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)CCCO1 1912179283 RHQIQDIYDTVLQE-ZYHUDNBSSA-N 252.318 2.104 10 10 CECE Cc1nc([C@H](NCCCN=[N+]=[N-])C(=O)O)sc1C 1912166926 DMXUZVPDCNRULC-QMMMGPOBSA-N 269.330 2.176 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)Cc1cn2ccccc2n1 1912210508 KLTJYSAFVLSYPC-UHFFFAOYSA-N 272.312 2.036 10 10 CECE CN1CCCc2cc([C@]3(N)COC4CC3C4)ccc21 2126724953 DDZRVNDEZTZGQJ-ZBCRRDGASA-N 258.365 2.032 10 10 CECE CCOC(=O)/C(=C\c1ccc(F)nc1C)c1nccn1C 1772961414 QFZVWLXZVUNOGY-XFXZXTDPSA-N 289.310 2.366 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H]3OCC[C@@H]3O2)cc1 1966144187 NHKSDWDDJBSVHS-KKUMJFAQSA-N 263.337 2.078 10 10 CECE COc1cc(O)c2c(c1)C(=O)c1c(O)cc(C)cc1C2=O 14814149 LLZYZGMVXFGQAY-UHFFFAOYSA-N 284.267 2.190 10 10 CECE COC[C@@H]1C[C@H]1CN[C@@H](C)c1ccc(OC)cc1O 2133504715 OFLJMNLICIYBQS-SRVKXCTJSA-N 265.353 2.334 10 10 CECE CCCN[C@H](C)c1ccc2c(c1)CCCN2CC(=O)NC 162278099 NQBQGEABIPURKL-CYBMUJFWSA-N 289.423 2.246 10 10 CECE CC(C)C[C@H](CNC(=O)CCc1ccc(N)cc1)C(=O)O 158183739 QBXXOSNTPWGPNJ-CYBMUJFWSA-N 292.379 2.065 10 10 CECE CC1(C)CN(CCOc2ccc(N)cc2)CCS1 158618891 GIYYEDCQIURVAP-UHFFFAOYSA-N 266.410 2.475 10 10 CECE CCNCc1ccc(N(C)[C@@H]2CCOC2)c(F)c1 160115164 QYCHEJDBXRTUAQ-GFCCVEGCSA-N 252.333 2.160 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCNC(=O)N(C)C 160800235 QBGSJCDOYYXJBP-RYUDHWBXSA-N 291.395 2.110 10 10 CECE C[C@@H]1C[C@H]1N(CCO)c1ccc2c(c1)CCC[C@@H]2O 2128275163 SGUHVOCGLUYIEY-LYRGGWFBSA-N 261.365 2.263 10 10 CECE CN(Cc1cncnc1)c1ccc2c(c1)CC[C@@H]2N 2128324488 GBEMVXXXVJKKPP-HNNXBMFYSA-N 254.337 2.059 10 10 CECE CCCN1CCN(c2ccc(/C=C\C(=O)O)cc2)CC1 207455558 YGSVUNOQYXBFBB-YVMONPNESA-N 274.364 2.316 10 10 CECE CCOc1ccc(N(C)C[C@H]2CCNC2)cc1F 258973888 UHBDKVVFHQVHFM-NSHDSACASA-N 252.333 2.270 10 10 CECE Cc1cc2c(cc1N(C)CCNC(C)C)OCCO2 258785394 BRMDJSCNBVZRHF-UHFFFAOYSA-N 264.369 2.200 10 10 CECE COc1ccc(N(C)[C@H]2CNC(C)(C)C2)cc1F 258927981 XHSAKRYZOYJRCO-LLVKDONJSA-N 252.333 2.411 10 10 CECE Nc1ccc(OCCNC(=O)c2ccccc2F)cc1 32120870 UIBKOFLEGCLNRI-UHFFFAOYSA-N 274.295 2.217 10 10 CECE CC(C)CC(=O)N[C@H]1CCCN(Cc2ccc(N)cc2)C1 586064894 MINXKYGGZOYENK-INIZCTEOSA-N 289.423 2.396 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H](C(F)F)C1CCC1 1893266260 BZKLUACTZHDONE-SNVBAGLBSA-N 269.295 2.213 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@]3(CC[C@H]3O)C2)cc1 2129551994 JGCGQVKIHIVSLB-WQVCFCJDSA-N 261.365 2.481 10 10 CECE COc1ccc(O)c([C@H](C)N(C)C[C@H]2C[C@@H]2OC)c1 2131631024 PGJJWBGXTHNFRE-RWSFTLGLSA-N 265.353 2.429 10 10 CECE CCN[C@@H](c1ccccc1O)[C@@](O)(C(F)F)C1CC1 1893276386 DDBXMFUWOSVSNK-GXTWGEPZSA-N 271.307 2.449 10 10 CECE CC1(C)OCCC[C@H]1CNCc1ccc(O)cc1O 2130457070 HCZSZYLMTUIZAR-LBPRGKRZSA-N 265.353 2.393 10 10 CECE Nc1ccc(CCNC(=O)[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 109174016 ORYMQWHVYQVIET-KCQAQPDRSA-N 256.349 2.140 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1Cl 1914423115 HCHWFNUZPIOOPW-VYUIOLGVSA-N 255.745 2.353 10 10 CECE CCC(CC)[C@H](O)CNCc1ccc(OC)cc1O 111404454 YQOVGGRTPVURLX-OAHLLOKOSA-N 267.369 2.288 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cnn2c1CCCC2 1969838036 ZYUMCFOZSJZWKB-UHFFFAOYSA-N 262.317 2.040 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)c1ncccc1F 1919799218 CBYNMMRJAUVCGO-UHFFFAOYSA-N 273.311 2.399 10 10 CECE Oc1ccccc1CNc1nc2ccc(F)cn2n1 228428569 TWWCXFXGOGWORM-UHFFFAOYSA-N 258.256 2.186 10 10 CECE CC[C@H](C(=O)O)[C@@](C)(N)c1ccc(N(C)C)cc1 1927651821 HWWZXQQCJJXUJC-OCCSQVGLSA-N 250.342 2.037 10 10 CECE CC(C)[C@@H]1CCN(C(=O)[C@H]2CNc3ccccc3N2)C1 229884610 USACUWXRRATTNT-IUODEOHRSA-N 273.380 2.397 10 10 CECE C[C@@H]1CC[C@](O)(CN[C@H](C)c2cc(O)ccc2O)C1 2136913414 AKDDWYRPMMLOFO-UEKVPHQBSA-N 265.353 2.300 10 10 CECE CCCS(=O)(=O)CCN[C@H](CC)c1ccccc1O 1969539614 RFLZRORWDGTXTM-CYBMUJFWSA-N 285.409 2.258 10 10 CECE Cc1ccc(CN2C[C@H](C)[C@@H](CC(=O)O)C2)c(O)c1 2139771317 XQZFNHSRMKCRSE-AAEUAGOBSA-N 263.337 2.243 10 10 CECE COc1cc(N2C[C@H]3C[C@H]3C2)ccc1C=CC(=O)O 2139705217 WJMLCHVDROHAKF-TXEJJXNPSA-N 259.305 2.249 10 10 CECE Oc1cc(F)ccc1CN1CC[C@@H]([C@H]2CCCN2)C1 2139766098 QHKMNXLCTOFOAU-BXUZGUMPSA-N 264.344 2.105 10 10 CECE CCOc1ccc(NC(=O)c2cccc(O)c2O)cn1 126487277 JUTDHJBPYFGKQO-UHFFFAOYSA-N 274.276 2.144 10 10 CECE COc1cc(Cl)cc(CN2CC=CC[C@H]2C(=O)O)c1O 1970665679 OVWJAAPENFQDHR-NSHDSACASA-N 297.738 2.269 10 10 CECE Cc1nnc(CN(C)c2ccc([C@@H](C)O)c(Cl)c2)n1C 2146930378 WCMIZXIVAALETL-SECBINFHSA-N 294.786 2.467 10 10 CECE CN(C)CCOc1ccc(N(C)C[C@H]2CCCO2)cc1 2143414608 PRFDMGKPHHTLPV-MRXNPFEDSA-N 278.396 2.242 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@H]2C(=O)N(C)C)c(Cl)c1 2143658687 ODVIZVWHOMWEBO-YGRLFVJLSA-N 296.798 2.450 10 10 CECE O=C(O)[C@]12C[C@@H]1CCCN2Cc1cc(F)cc(F)c1O 2143924498 ZKMHUXBNGAADTP-XPTSAGLGSA-N 283.274 2.110 10 10 CECE CN(C(=O)Cc1ccc(O)c(O)c1)c1cccc(O)c1 2144022599 DBJGMKABHYWJIY-UHFFFAOYSA-N 273.288 2.009 10 10 CECE CCOC(=O)CCCc1cc(C)c(O)c(O)c1F 260575039 ZHUSQUQORCULMF-UHFFFAOYSA-N 256.273 2.431 10 10 CECE CN(C)[C@@H]1CCC[C@H](NCCc2ccc(O)c(O)c2)C1 2148002728 DCHDQZUBWUDBSH-UONOGXRCSA-N 278.396 2.103 10 10 CECE c1csc(SC[C@@H]2CCC3(CNC3)CO2)n1 1992099641 OWHIVQOBXFHGDX-VIFPVBQESA-N 256.396 2.004 10 10 CECE C[C@@H](N[C@H](C)c1nnc2n1CCC2)c1ccccc1O 37149571 NDOIKUJSIZDPSL-GHMZBOCLSA-N 272.352 2.342 10 10 CECE Nc1ccc(OCCC[S@](=O)C[C@@H]2CCCOC2)cc1 2145513283 JMIDQSGCGJIPKG-XCLFUZPHSA-N 297.420 2.213 10 10 CECE CNCc1ccc(N2C[C@H](CO)OC(C)(C)C2)c(Cl)c1 163286698 XXDGTBDLTAQSSO-GFCCVEGCSA-N 298.814 2.036 10 10 CECE C[C@H]1C[C@H](C)N(C(=O)CCOc2ccc(N)cc2)C1 163843548 LXNKYYKQEVCWER-RYUDHWBXSA-N 262.353 2.295 10 10 CECE CC1(C)CC2(CC([C@H](NCCCN=[N+]=[N-])C(N)=O)C2)C1 2158877387 UMHSLBFLZTYNGI-NSHDSACASA-N 279.388 2.347 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1nn(C)cc1Cl 2150741731 OMBFFJRBHGQTDM-UHFFFAOYSA-N 292.770 2.318 10 10 CECE C[C@H](NC[C@H]1CN2CCC1CC2)c1c(O)cccc1O 2150797748 MPHLNFRYLJGGOE-AAEUAGOBSA-N 276.380 2.090 10 10 CECE Cc1nc(CN(C)c2cc3c(cc2N)OCCO3)cs1 44609085 AHSSLJQXBJVQLF-UHFFFAOYSA-N 291.376 2.441 10 10 CECE CCC1CC(N(C)c2cc3c(cc2F)[C@H](O)C(=O)N3)C1 2153243201 QKILXJZYLFIRBN-CTCYHXBNSA-N 278.327 2.436 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H]2C[C@H]3COCC[C@@H]3O2)CC1 2155567816 RAHFXTQCTNYENG-CRWXNKLISA-N 280.372 2.345 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC[C@@H](N)CC1 2027960069 RURNQQYDTMVVGR-CMPLNLGQSA-N 252.333 2.406 10 10 CECE C[C@H](N(C)CCCc1ccc(N)cc1)C(C)(C)O 2030158218 SRZZFOUUNXVDOO-LBPRGKRZSA-N 250.386 2.293 10 10 CECE CC1(C)C[C@@H](CO)N(c2ccc(CO)c(Cl)c2)C1 2033711872 MYJNEAGNCYYTBJ-LBPRGKRZSA-N 269.772 2.430 10 10 CECE OCc1ccc(N2[C@H]3CC[C@H]2[C@@H](CO)C3)cc1Cl 2039489325 APTUYWJHTNFPPJ-SUNKGSAMSA-N 267.756 2.182 10 10 CECE CC(=O)c1cc(F)cc(CN(C)[C@H]2CO[C@@H](C)C2)c1O 401371990 BZRQCEYUCCBGOR-TVQRCGJNSA-N 281.327 2.343 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@@H]1CCC[C@H]1N 405212478 LVJNRSOSQSISRE-MBNYWOFBSA-N 276.380 2.429 10 10 CECE CN(Cc1ccc(N)cc1)S(=O)(=O)CCC1CCC1 311757913 AFKKXUYPADWBBP-UHFFFAOYSA-N 282.409 2.221 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c([N+](=O)[O-])c1 2159466176 LDXCMUIVIAKEHU-CGUBKOMSSA-N 274.320 2.493 10 10 CECE CC(C)NCc1ncc(-c2ccn(C)c(=O)c2)s1 315259716 BYSCUHFSEBEBST-UHFFFAOYSA-N 263.366 2.007 10 10 CECE N[C@H]1CCCN(c2ccc(OCCC3COC3)cc2)C1 2160958707 WAZXQEPLUKTOBJ-AWEZNQCLSA-N 276.380 2.029 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1ccccc1OC 90257554 KLNPIMSMGMPTSM-LBPRGKRZSA-N 278.312 2.199 10 10 CECE C[C@@H]1CCC[C@@H]1[C@@H](N)[C@@H](O)c1ccc2c(c1)CCN2C 2175525755 HBUZJAJPGOTYLY-HWHUXHBOSA-N 274.408 2.476 10 10 CECE CC[C@H]1CN(Cc2ccc(OC)cc2O)C[C@H]1N(C)C 2170460842 BTFYHPLISPICDB-SWLSCSKDSA-N 278.396 2.173 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2CCCN(C)C2)cc1O 705134978 HHTHOMMIFNNECU-QWHCGFSZSA-N 278.396 2.224 10 10 CECE Oc1cccc(Cl)c1CNC[C@H]1[C@@H]2COC[C@H]12 367602102 IJVQTKYKSZPEOJ-UIKWRGBMSA-N 253.729 2.028 10 10 CECE CC[C@H]1C[C@H](N(C)c2c(F)cc(CN)cc2F)CO1 688463798 OUGITLOGLZTGGL-QWRGUYRKSA-N 270.323 2.427 10 10 CECE CC(C)(C)N(CCO)c1c(F)cc(CN)cc1F 690035277 AEVNPKSKERZPHN-UHFFFAOYSA-N 258.312 2.021 10 10 CECE COC1CC2(C1)CN(c1ccc(C=CC(=O)O)cc1)C2 2162245687 LKYBQTCJQSRCTM-UHFFFAOYSA-N 273.332 2.400 10 10 CECE Nc1ccc(CCNC(=O)[C@H]2CCC(F)(F)C2)cc1 381005892 QRHVVTSACDZXGD-NSHDSACASA-N 268.307 2.363 10 10 CECE Oc1cc2c(cc1CN[C@@H]1CCCSCC1)OCO2 692466115 VKLQJCBLPYJABD-LLVKDONJSA-N 281.377 2.496 10 10 CECE CN(C[C@H]1CCSC1)C(=O)Cc1ccc(N)cc1 718390704 JIJUCBYVQMFPKR-GFCCVEGCSA-N 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2.395 10 10 CECE CCN[C@H](C)c1ccc(N(CCOC)C[C@@H](C)O)cc1 2288053124 CLWDWLXYVAGKBL-ZIAGYGMSSA-N 280.412 2.191 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@H]2[C@H]1C2(F)F 2315986773 IFJSTTLUNMCKPP-VGMNWLOBSA-N 258.272 2.437 10 10 CECE C[C@H]1CCO[C@@H]1CC(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333254 FFEMVDCPTKKPAV-ZRUFSTJUSA-N 252.318 2.149 10 10 CECE COc1cc(Cl)c(N2CCC[C@@H]2CN)c(OC)c1 2319558918 DSZLLQRORQEJRJ-SECBINFHSA-N 270.760 2.285 10 10 CECE Cc1cccc(O)c1CNC[C@@]1(O)CCCSC1 2320599395 MNMZZBPJFCSHQN-AWEZNQCLSA-N 267.394 2.048 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)[C@H]2C[C@@H](C(F)(F)F)C2)C1 2327657067 IDOBHNPRXKBPOI-RNJXMRFFSA-N 262.235 2.486 10 10 CECE COc1cccc(CN[C@H]2CC[C@@H]3C[C@H]2CO3)c1O 2334120235 NPDLPWBXHRPRMR-XQQFMLRXSA-N 263.337 2.058 10 10 CECE CC[C@H](O)CN(C[C@H](O)CC)c1ccc(OC)cc1 2335558682 UZVCPAQIDGOLSC-OKILXGFUSA-N 267.369 2.043 10 10 CECE Cc1cnc(C(=O)c2cccc3c2NCC3)c(C)n1 2336035747 NDLUBPHDOKGPGS-UHFFFAOYSA-N 253.305 2.292 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@]12CCCCN1CCC2 2337776879 PDSYEXSWIBQCHN-ZDUSSCGKSA-N 265.361 2.164 10 10 CECE COc1cc(Cl)c(N2C[C@@H](F)[C@H](CO)C2)c(OC)c1 2342282836 JCNKSLLNLBCVGK-GZMMTYOYSA-N 289.734 2.124 10 10 CECE COc1cc(Cl)c(N2C[C@H](F)C[C@H]2CN)c(OC)c1 2342300201 NZEMUBCBJDNJES-BDAKNGLRSA-N 288.750 2.233 10 10 CECE C[C@]1(CN)CN(c2ccc(OCF)cc2)CC1(F)F 2351676423 SILAOLXZFKOBLO-LBPRGKRZSA-N 274.286 2.413 10 10 CECE O=C(O)[C@@]1(Sc2nccs2)C2CCN(CC2)C12CC2 2351879151 ZCBKFJULJNBKRO-ZDUSSCGKSA-N 296.417 2.317 10 10 CECE CSc1cc(N2CC[C@H](CO)C[C@H]2C)ccc1CN 2353855196 HAXWQLSVMRMTDF-NEPJUHHUSA-N 280.437 2.464 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@@]12COC[C@@H]1C2 2354608165 JUBVIJWUEHOGSS-XIRDDKMYSA-N 272.392 2.366 10 10 CECE OC[C@H]1C[C@@H]2CC[C@H]1N2c1ccc2c(c1)CCC[C@H]2O 2356170337 AVGUIKDQDNGREF-JWZBEHFJSA-N 273.376 2.406 10 10 CECE CC[C@H]1CN(c2c(F)cc(CN)cc2F)CCO1 62710834 BIOUGGHSOLTPLU-JTQLQIEISA-N 256.296 2.039 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2C[C@@H]3[C@H]4CC[C@H](C4)[C@@H]23)cc1 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Cn1ccnc1[C@@H](NCc1ccc(N)cc1)C1CC1 1963362334 MSGPMSCTCVUQGC-AWEZNQCLSA-N 256.353 2.243 10 10 CECE Cc1ccc(O)c([C@@H](N)c2nnc(CC3CC3)o2)c1 83432229 YVNJHQCJQXMYCP-CYBMUJFWSA-N 259.309 2.084 10 10 CECE CC[C@@]1(c2cc(F)cc(F)c2O)CO[C@@H](C)CN1 83419683 KYZAUEVQWVAMHK-SDBXPKJASA-N 257.280 2.284 10 10 CECE CO[C@@](C)(CO)CNCc1cc(Cl)cc(Cl)c1O 702532559 RGEXHPZWCPPYQR-GFCCVEGCSA-N 294.178 2.186 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H](CO)C(C)(C)C 689706744 QCCRUSLJPYAURT-ZDUSSCGKSA-N 254.349 2.128 10 10 CECE CC(C)[C@H]1CCCN1CC(=O)c1ccc(O)c(O)c1 88844872 UXVGVWUGXBFLMB-GFCCVEGCSA-N 263.337 2.401 10 10 CECE Oc1ccc(CNCC[C@@H]2CCSC2)c(O)c1 704921631 FBDSYBHXHJZINR-SNVBAGLBSA-N 253.367 2.331 10 10 CECE Cc1ccc([C@H](C)N2C[C@H]3CN(C)C[C@@H]3C2)c(O)c1 706246823 YNBWNDUGTUNHKI-BFHYXJOUSA-N 260.381 2.255 10 10 CECE CCO[C@@H]1CCN(c2ccc([C@H](C)NC)c(O)c2)C1 706561168 UQBUHDMVTUEYCZ-WCQYABFASA-N 264.369 2.288 10 10 CECE CCN(CC)C(=O)[C@H](C)NCc1c(O)cccc1Cl 83552263 JUHGZBANCTXGQO-JTQLQIEISA-N 284.787 2.392 10 10 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Cc1ccc(S(=O)(=O)N(C)Cc2ccc(N)cc2)s1 35360295 IHRHHZVYWWZBKA-UHFFFAOYSA-N 296.417 2.459 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2C[C@@H]2C2CCCC2)cc1 2145110615 CQKUZXBFZFPFBV-CABCVRRESA-N 274.364 2.343 10 10 CECE CCCN[C@@H](CC)c1ccc(N2CC[C@@H]2C(N)=O)cc1 2145611789 CIJFMGFCPQPNND-LSDHHAIUSA-N 275.396 2.201 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H](N)C(C)(C)C 40468790 LVWJBOBBLZEBQC-GXFFZTMASA-N 264.369 2.285 10 10 CECE C[C@H](O)c1ccc(N2CC=C[C@H]2CO)cc1Cl 2007531357 LORUTBLKWXNRBJ-ONGXEEELSA-N 253.729 2.130 10 10 CECE C[C@@H](O)c1ccc(N2CC=C[C@@H]2CO)cc1Br 2007532133 SQUMXUMUNMBGSE-MWLCHTKSSA-N 298.180 2.240 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H](C)C(F)(F)F)ccc21 2151716479 QUIWATJQOLUTKU-HQJQHLMTSA-N 287.285 2.286 10 10 CECE COC[C@@]1(O)CCCN(c2ccc([C@@H](C)O)c(Cl)c2)C1 2151837729 NDOLJJYSEZZQBV-IAQYHMDHSA-N 299.798 2.371 10 10 CECE COC[C@@]1(O)CCCN(c2ccc(CN)cc2Cl)CC1 2151895939 YBLHJJILYSRREX-OAHLLOKOSA-N 298.814 2.167 10 10 CECE C[C@H]1CN(C(=O)CCc2ccc(N)cc2)CC(C)(C)O1 45661361 QAKQIBNYZYGNGD-LBPRGKRZSA-N 276.380 2.227 10 10 CECE CC[C@@H]1CO[C@@H](C)CN1C(=O)Nc1ccc(N)cc1 48916599 ZDSHMJXCFOWYIX-GXFFZTMASA-N 263.341 2.300 10 10 CECE CNCc1ccc(N2CCN3CCCC[C@H]2C3)c(C)c1 2154261712 RBAQXTJNEZECPZ-INIZCTEOSA-N 273.424 2.389 10 10 CECE COc1cccc(CN2CCC[C@H]2[C@@H]2CCCN2)c1O 51356991 BAIZTARQELWOJB-KBPBESRZSA-N 276.380 2.117 10 10 CECE CC[C@@H](C)C[S@@](=O)CC(=O)c1ccc(O)c(O)c1 2029188780 RHQTWRWVLQIGGG-DYBLOJMWSA-N 270.350 2.075 10 10 CECE Cc1nn(C)c(C)c1C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2155558542 QJGDYHFABOTLIE-LLVKDONJSA-N 276.344 2.342 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@]3(CCO3)C2)c(F)c1 2035802263 XDORRNWJRLZUPM-QMTHXVAHSA-N 250.317 2.215 10 10 CECE CCN(CCCCO)c1ccc(CNC)cc1F 2041181645 BAQBBBPDARGFMF-UHFFFAOYSA-N 254.349 2.144 10 10 CECE CNCc1ccc(N2CC[C@@H]3CCN(C)[C@@H]3C2)c(F)c1 2158538220 QSXKMJLJRWQMCS-XJKSGUPXSA-N 277.387 2.076 10 10 CECE C[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc(N)cc2)CO1 402050727 PIDLNAWFTYLGAE-MFKMUULPSA-N 263.341 2.300 10 10 CECE CC[C@@H](N)c1ccc(N(CCOCCO)C(C)C)cc1 312273248 BRKIBJIZSZJGIP-MRXNPFEDSA-N 280.412 2.320 10 10 CECE COc1ccc(N2CC[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1 700458791 OBGVTJNGDUOQQC-QWRGUYRKSA-N 280.324 2.058 10 10 CECE Oc1c(CNC2CC(O)(C(F)(F)F)C2)ccc(F)c1F 2158822643 HVKWYRFEYIKYMF-UHFFFAOYSA-N 297.223 2.216 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H]1CCOC1(C)C 328262019 RZWNADZKPNKWIZ-LBPRGKRZSA-N 278.352 2.425 10 10 CECE CC[C@H](C)NC(=O)CNCc1ccc2c(c1)CCCO2 2160556388 HIUMZFGCZUHAIY-LBPRGKRZSA-N 276.380 2.016 10 10 CECE COCCOC[C@@H]1CCCN1Cc1c(O)cccc1F 2160773927 HOFXDWAEVZKQMG-LBPRGKRZSA-N 283.343 2.159 10 10 CECE COc1cccc(O)c1CN1CCC[C@@H](C(=O)O)[C@@H]1C 2160710907 AUFNNXILELOVOM-WDEREUQCSA-N 279.336 2.086 10 10 CECE CN1CCc2cc(CN[C@@](C)(CO)C(F)(F)F)ccc21 2161387639 GGHBJENCMMUWGG-ZDUSSCGKSA-N 288.313 2.082 10 10 CECE CNCc1ccc(N2CCC[C@@H](OCCO)C2)c(Cl)c1 2170220184 DQSODGQKKPNNCF-CYBMUJFWSA-N 298.814 2.037 10 10 CECE CCOC(=O)C(F)(F)CCOCCc1ccc(N)cc1 2178552644 PZOYJTDMFHPJJG-UHFFFAOYSA-N 287.306 2.416 10 10 CECE Oc1c(F)cc(F)cc1CN1CC[C@@H]2CNC[C@@H]2CC1 708494364 HFNVHNLWLOHXPO-PHIMTYICSA-N 282.334 2.102 10 10 CECE NC(=O)c1ccc(COCCc2ccc(N)cc2)cc1 2176291044 VSYMPMLLHJKMDX-UHFFFAOYSA-N 270.332 2.127 10 10 CECE CN1CCc2cc([C@H](CN)N3C[C@H]4CC[C@@H]4C3)ccc21 711223059 DLOMOTAQKDCPQW-INMHGKMJSA-N 271.408 2.021 10 10 CECE Nc1ccc(CCOc2nnc3ccccc3n2)cc1 2176327141 YXYXQKUFUUSADT-UHFFFAOYSA-N 266.304 2.229 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@H](O)C2(C)C)c1O 380284726 CUHCGNORBLRFRS-ZDUSSCGKSA-N 281.327 2.079 10 10 CECE Cc1nc[nH]c1CNCc1ccc(Br)cc1O 691490559 YGSOOGUBNWWRGG-UHFFFAOYSA-N 296.168 2.476 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@H]1CC[C@H](N)C1 380890800 LNEAVSQMCROFQT-AGIUHOORSA-N 276.380 2.429 10 10 CECE CCN(CCOC[C@@H]1CCCO1)c1ccc(N)cc1 693048541 UPIJBEKCXOOJEI-HNNXBMFYSA-N 264.369 2.291 10 10 CECE Cc1ccc([C@@H](C)NCCCn2cnnc2)c(O)c1 381946554 VKMJIPIZIPHCAH-GFCCVEGCSA-N 260.341 2.033 10 10 CECE Cc1nnsc1CN[C@H](C)c1ccc(O)cc1O 384296163 XHUXPWRBIDMBHC-SSDOTTSWSA-N 265.338 2.109 10 10 CECE CCCNCc1ccc(N2CCS[C@H](CO)C2)c(F)c1 720003197 OMVYYPCMSVUUMY-ZDUSSCGKSA-N 298.427 2.239 10 10 CECE C[C@@H](O)c1ccc(N(C)CCCN2CCCC2=O)cc1 2171706663 LFSJAINBVRGUCT-CYBMUJFWSA-N 276.380 2.189 10 10 CECE Cc1ncn(CCCc2ccc(N)cc2)c(=O)c1C 395502017 RFDCHDRKYWZCDT-UHFFFAOYSA-N 257.337 2.075 10 10 CECE CN(C)c1ccc(N)c(OCCC2(O)CCC2)c1 396909477 IFKMYCJPFYPJCF-UHFFFAOYSA-N 250.342 2.019 10 10 CECE CCC[C@@](NCCCN=[N+]=[N-])(C(N)=O)[C@@H]1CC1(C)C 397635805 WDTHZHUDHVSZFZ-MFKMUULPSA-N 267.377 2.347 10 10 CECE C[C@@H]1COCCN(c2ccc(CN)c(Cl)c2)C1 399060175 LIBGGQMUWHLEPB-JTQLQIEISA-N 254.761 2.271 10 10 CECE CN[C@@H](C)c1ccc(N2CC(CCN(C)C)C2)cc1O 2176678927 OIAPQPVSWJOORH-LBPRGKRZSA-N 277.412 2.061 10 10 CECE CN(C[C@H]1C[C@@]12CC2(F)F)C(=O)c1ccc(O)c(O)c1 2172120462 GCFOYLXORNNNMU-NOZJJQNGSA-N 283.274 2.215 10 10 CECE CN(C(=O)CCOc1ccc(N)cc1)[C@@H]1CC[C@H]2C[C@@H]21 2165549534 UVVBJAXVSKRBLU-TUKIKUTGSA-N 274.364 2.295 10 10 CECE CC(C)NCc1ccc(N2C[C@H](F)[C@@H](CO)C2)c(F)c1 2177142688 FPOYYJHPIWPAQG-OCCSQVGLSA-N 284.350 2.090 10 10 CECE CC(=O)NC1CCN(c2cc(Cl)c(CN)cc2F)CC1 2177386209 XWRGUIMABPDGHI-UHFFFAOYSA-N 299.777 2.043 10 10 CECE C[C@H](NCc1cnn2c1CCC2)c1ccc(O)cc1O 2167661491 RILLZIKAYQYBIF-JTQLQIEISA-N 273.336 2.091 10 10 CECE CN1CCCc2cc(CNC[C@@H]3[C@@H]4COC[C@@H]43)ccc21 2174621798 LGJQRCGYLDHBDI-MUJYYYPQSA-N 272.392 2.051 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)Cc1ccc2c(c1)CCO2 2168660246 LRUFEUDDCFXDBY-UHFFFAOYSA-N 274.324 2.323 10 10 CECE CCNCc1cc(F)c(N2CCCC[C@@H](O)C2)c(F)c1 2169219139 UEEBSRUVJWEZSG-GFCCVEGCSA-N 284.350 2.426 10 10 CECE CCCNC(=O)[C@H]1CCCN1c1ccc(CO)c(Cl)c1 2169598236 GHMNHAOGZPXDBK-CQSZACIVSA-N 296.798 2.327 10 10 CECE CCc1cccc([C@@](C)(O)[C@@H](N)c2ccccc2O)n1 2178445332 XWLRBGBMHGTAPC-JKSUJKDBSA-N 272.348 2.257 10 10 CECE C[C@@H]1CCc2cc(N3CC[C@@H](S(C)(=O)=O)C3)ccc2N1 2179912830 CJJVSDYACTZTPE-BXUZGUMPSA-N 294.420 2.057 10 10 CECE COC[C@@]1(CN(C)[C@H](C)c2ccccc2O)CCNC1 2192605932 SBJZVTLMPUBMTK-CJNGLKHVSA-N 278.396 2.011 10 10 CECE C[C@@H](NCc1ccc(C(=O)O)cn1)c1ccccc1O 2192601574 BJUJBCPIVZPZEU-SNVBAGLBSA-N 272.304 2.336 10 10 CECE C[C@@H](NC(=O)C(C)(C)[C@@H]1CCCN1)c1ccccc1O 2192631120 DXCTXKWGLUQIJV-RISCZKNCSA-N 276.380 2.348 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2CC(=O)N(C)C2)cc1Cl 2188482128 CFFDOQJECSVFJB-ZYHUDNBSSA-N 295.814 2.287 10 10 CECE Cc1ccc([C@@H](C)N(C)[C@H]2CCC(=O)N(C)C2)c(O)c1 2188464357 QZZWIUCCDQTOGD-OLZOCXBDSA-N 276.380 2.314 10 10 CECE COCCNCc1ccc(N2CC[C@@H]2[C@@H](C)O)cc1Cl 2182242699 VUMJOSZTAVNZJI-IAQYHMDHSA-N 298.814 2.036 10 10 CECE CN[C@@H](C(C)C)[C@H](O)c1ccc2c(c1)CCCN2C 2092182811 BJFVBSATVFFUNE-JKSUJKDBSA-N 262.397 2.346 10 10 CECE Cc1ccoc1-c1noc(-c2cc(O)c(O)c(O)c2)n1 2188915965 MBPDJPWTLXIFNJ-UHFFFAOYSA-N 274.232 2.422 10 10 CECE CCC(=O)N1CCN(c2ccc([C@@H](C)N)c(Cl)c2)CC1 2182601759 JADBMEWQPFOAAL-LLVKDONJSA-N 295.814 2.418 10 10 CECE C[C@H](O)c1ccc(N2[C@@H]3COC[C@H]2C3)c(Cl)c1 1910353417 XAUFMWQBZKDZFJ-INTQDDNPSA-N 253.729 2.371 10 10 CECE CCC[C@H]1C[C@@H](NCc2ccc(O)c(O)c2O)CCO1 2182901392 LMBNIDBLNYHIGN-RYUDHWBXSA-N 281.352 2.241 10 10 CECE [N-]=[N+]=NC1CCN(CCN2CCC(F)(F)C2)CC1 2041999614 FIUCZVUUOCWNGW-UHFFFAOYSA-N 259.304 2.102 10 10 CECE Oc1cccc(F)c1CN1CC[C@H]2COCC[C@@H]21 2042608767 UQFHQMJSGYXYHQ-GWCFXTLKSA-N 251.301 2.142 10 10 CECE CCCC[C@@H](C(=O)O)N(C)c1ccc(CN)cc1 2044358629 DBHGXVSWFBGCGI-ZDUSSCGKSA-N 250.342 2.225 10 10 CECE CCCc1nc(C(=O)Cc2ccc(N)cc2)ns1 2045047770 WXWOHAUYLIOKJW-UHFFFAOYSA-N 261.350 2.498 10 10 CECE CN(C[C@]12COC[C@@H]1C2)c1ccc2c(c1)CCC[C@@H]2N 2184686191 FFQRJBUEJQTMCI-RRQGHBQHSA-N 272.392 2.495 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3N)C[C@]1(C)CO 2184692685 GDPQZKSWFDEUAT-CSMYWGQOSA-N 274.408 2.477 10 10 CECE CCN1CC(CN(C)c2ccc3c(c2)CCC[C@@H]3N)C1 2184689710 RTJIRIAUNMXWRG-KRWDZBQOSA-N 273.424 2.411 10 10 CECE N[C@@H]1CCCc2cc(N3C[C@H]4[C@H](O)CC[C@H]4C3)ccc21 2184682319 NODDJQQUMBHSQH-WBQNTZJQSA-N 272.392 2.230 10 10 CECE N[C@@H]1CCCc2cc(N3CCn4nccc4C3)ccc21 2184685321 WJLSUQACVJOYHX-MRXNPFEDSA-N 268.364 2.239 10 10 CECE C[C@@H]1CN(c2ccc(CO)cc2Cl)CC[C@H]1CO 2046667587 BVKFRXPRMYICHX-PWSUYJOCSA-N 269.772 2.287 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H](O)[C@H](C4CC4)C3)ccc21 2184710359 DOGWYTREBNQFMY-BBWFWOEESA-N 272.392 2.100 10 10 CECE CN[C@@H]1CCc2cc(N(C)Cc3ccncn3)ccc21 2184725286 IHKYCEFSYZGQKI-MRXNPFEDSA-N 268.364 2.320 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@H](C(C)(C)O)C3)ccc21 2184723450 MWVQMFAOJFLCMM-CJNGLKHVSA-N 274.408 2.491 10 10 CECE C[C@H](N)c1ccc(N2CC([C@H](F)CO)C2)cc1Cl 2048047611 IEYDYPSMXBWQDK-ISVAXAHUSA-N 272.751 2.126 10 10 CECE Oc1cccc(CNCC(F)(F)C2CCOCC2)c1O 2185380000 SLGSSLVSFIYXRW-UHFFFAOYSA-N 287.306 2.249 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)CC2CCCC2)CC1 2054032554 RYNBQGXPLFQLLU-UHFFFAOYSA-N 272.374 2.187 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@]2(C)CCOC2)cc1O 2055448263 KUAHABPQFAMEGZ-QMTHXVAHSA-N 251.326 2.061 10 10 CECE COC[C@](C)(CN(c1ccc(CN)cc1)C1CC1)OC 2198271732 PVYOORWAMSRFGB-INIZCTEOSA-N 278.396 2.166 10 10 CECE CCCOc1cc(N2C[C@H]3[C@H](N)CC[C@H]3C2)ccc1N 2191592965 MOKWGGAIKCNAPE-IACUBPJLSA-N 275.396 2.231 10 10 CECE COCC(CCN1CCC[C@@H]1CN=[N+]=[N-])COC 2067333145 VAQYEEPZSPIKMI-GFCCVEGCSA-N 256.350 2.060 10 10 CECE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H]2CC[C@H]3O2)cc1O 2198727295 FXRWGAGXMDCLMT-SUMAQBCMSA-N 274.364 2.311 10 10 CECE CCC[C@H](COC)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2073174512 YMHIVYGTGUKKNY-GHMZBOCLSA-N 254.334 2.350 10 10 CECE OC[C@@H](F)[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)C1 2199127800 QXPOAESRNLGRQQ-QLFBSQMISA-N 279.355 2.210 10 10 CECE Oc1cc(Cl)ccc1CNC1(C(F)(F)F)COC1 2074761850 UNXHZDQXOWBQSV-UHFFFAOYSA-N 281.661 2.467 10 10 CECE Nc1ccc(CCNC[C@H]2C[C@H]2C2CCOCC2)cc1 2200150807 UNODGJRWAVCRFA-WBVHZDCISA-N 274.408 2.464 10 10 CECE Cc1cc(N2CCC3(CCO3)CC2)ccc1CCN 2100942589 ZVGZLICCINOFOE-UHFFFAOYSA-N 260.381 2.256 10 10 CECE N[C@H](c1ccccc1O)[C@]1(O)C[C@H]2C[C@H]1CC2(F)F 2101420995 GMTMKTGEMTXCLC-ZFWZSOMGSA-N 269.291 2.188 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@H](C(F)F)[C@@H](N)C1 2102495356 DUQKRRJIFMSRGL-GGVZMXCHSA-N 274.286 2.117 10 10 CECE 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Cc1cc(CO)ccc1N(CCC(N)=O)Cc1ccccc1 1931976922 ANIAHMDIADLHFA-UHFFFAOYSA-N 298.386 2.369 10 10 CECE CC[C@@H](C)CS(=O)(=O)Cc1cc(CNC)ccc1OC 233855436 LAAOALGGIWRBGO-GFCCVEGCSA-N 299.436 2.376 10 10 CECE CN(CCC(F)(F)F)c1ccc([N+](=O)[O-])c(CO)c1 234266234 BKCXFQKPFCGCHN-UHFFFAOYSA-N 278.230 2.476 10 10 CECE CC[C@@H](C)[C@H](N)Cc1nc(-c2ccc(O)c(O)c2)no1 2149619931 LEAMSJQFTYUAGW-PSASIEDQSA-N 277.324 2.064 10 10 CECE COCCNCc1cnc(Sc2cncs2)s1 1949570490 LBBWHTQZRZBZLY-UHFFFAOYSA-N 287.435 2.487 10 10 CECE CN[C@@H](c1ccoc1)[C@H](O)c1ccc2c(c1)CCN2C 2147426542 VOYYMTRGWBRGEA-JKSUJKDBSA-N 272.348 2.266 10 10 CECE CN[C@H](COC)c1cc(Br)ccc1O 1951858638 CDSCHUVXFLXVAC-SECBINFHSA-N 260.131 2.062 10 10 CECE CCN(CC)c1ccc([C@](C)(O)C(C)(C)N)c(OC)c1 1951905927 NTFORLMHIZXYDK-INIZCTEOSA-N 280.412 2.486 10 10 CECE CCOC(=O)C[C@@](C)(N)c1cc(C)c(C)cc1O 1952913423 IXOIKGZFAJAZHK-CQSZACIVSA-N 251.326 2.136 10 10 CECE Nc1ccc(CS(=O)(=O)Nc2ccnc(Cl)c2)cc1 149043789 CKBGJHOKCYQJNP-UHFFFAOYSA-N 297.767 2.259 10 10 CECE c1cc2c(cc1CNC[C@@H]1[C@H]3CCOC[C@H]31)CCCO2 1972270837 KPGHKCVVPNPUGG-BZUAXINKSA-N 273.376 2.384 10 10 CECE CN(C)c1ccc(CNC[C@@H](CO)C2CCC2)cc1 1972463871 JXKAGMHARQWVEB-HNNXBMFYSA-N 262.397 2.251 10 10 CECE Cc1c(CN(C)[C@H]2[C@@H]3CNC[C@@H]32)n(C)c2ccccc12 2149950199 LUUCHFMSOLWNCW-HALDLXJZSA-N 269.392 2.136 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@]3(C)C[C@H]2CO3)cc1O 2144649306 WSXRCYQRZYUNGV-DETPVDSQSA-N 276.380 2.430 10 10 CECE O=C(O)C1CCC(CNCc2ccc(O)c(O)c2)CC1 34595574 BLAGDMOYDHENCR-UHFFFAOYSA-N 279.336 2.078 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@@H]2CN3CCC2CC3)c1 35628673 DMIASZRULKSCSQ-IUODEOHRSA-N 260.381 2.445 10 10 CECE Oc1cccc(-c2nc([C@@H]3CCCOCC3)no2)c1O 2145288219 HHKDQVXDIONWDY-SECBINFHSA-N 276.292 2.432 10 10 CECE Nc1cccc(Br)c1N[C@@H]1C[C@H]2CNC[C@@H]21 1989322690 INWABJLUXCGFTG-DKCNOQQISA-N 282.185 2.051 10 10 CECE CNCCN(CC(F)(F)F)[C@@H](C)c1ccc(O)cc1O 2145388441 MIAXCMFDGZXMHF-VIFPVBQESA-N 292.301 2.243 10 10 CECE O=C(C[S@@](=O)c1ccc(F)cc1)c1ccc(O)c(O)c1 2145894009 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CC(C)(C)OC(=O)N[C@H](C(=O)O)c1cccc(F)c1O 1951383602 CWRPEXXVAKHPJY-VIFPVBQESA-N 285.271 2.182 10 10 CECE CC1(C)CCCCN1c1cc2c(cc1N)OCC(=O)N2 2150018975 NQZIFJOXOFFZCC-UHFFFAOYSA-N 275.352 2.369 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(C)C[C@H]2CO)cc1O 2151112508 JYAYIRGCNLPDJJ-AAEUAGOBSA-N 278.396 2.270 10 10 CECE CN[C@H](C)c1ccc(N2CCCCC[C@H]2CO)cc1O 253180340 SVHYYPSVIDEFQL-OCCSQVGLSA-N 278.396 2.414 10 10 CECE COC1(OC)CC[C@H]1CNCc1cc(F)ccc1O 1972387864 ONEBSAGUBXQOQB-NSHDSACASA-N 269.316 2.020 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@H](N)c2ccccc2O)cc1 2148163869 OATDHJZCPQHOJU-JKSUJKDBSA-N 272.348 2.192 10 10 CECE CCC[C@@H]1COC[C@]1(O)[C@@H](NCC)c1ccccc1O 2148162977 LGMSPHCFBYFOHO-UHOFOFEASA-N 279.380 2.220 10 10 CECE NCc1ccc(N2CC=C(CO)CC2)c(Br)c1 2004182605 CCGSTYNAXRMLQD-UHFFFAOYSA-N 297.196 2.037 10 10 CECE CN(C)CC(C)(C)CN(C)CCOc1ccc(N)cc1 2144761390 DOVSHEWMHARVQH-UHFFFAOYSA-N 279.428 2.167 10 10 CECE CCOCOc1ccc(N2CCC[C@H](N)C2)c(C)c1 157410576 BVQMEUHEGFBBEK-ZDUSSCGKSA-N 264.369 2.295 10 10 CECE CCN[C@H](C)c1ccc(N2CCCNC(=O)CC2)cc1 2145346782 PDHWRNQDECEVKZ-CYBMUJFWSA-N 275.396 2.074 10 10 CECE CN1CCC2(CCCN2c2ccc(CN)cc2F)CC1 2145386369 RFUXLUUNNUSAQR-UHFFFAOYSA-N 277.387 2.349 10 10 CECE CC(C)Cc1noc(CN(C)Cc2ccc(N)cc2)n1 2148894451 WEUPSAVCAZMIGG-UHFFFAOYSA-N 274.368 2.482 10 10 CECE CC[C@](C)(CO)Sc1ncc(C(=O)OC)s1 1985813389 BOYAOQMTSXECOR-SNVBAGLBSA-N 261.368 2.183 10 10 CECE CCCN(CC(=O)NC(C)(C)C)c1ccc(CN)cc1 34654662 IISYLIYRRUSKIL-UHFFFAOYSA-N 277.412 2.276 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@H]3C[C@H]32)cc1Br 2004412247 NCEHHKXJFHQGDO-WQHBLYJGSA-N 297.196 2.446 10 10 CECE CCCN[C@H](C)c1ccc2c(c1)CCCN2CCO 162272919 UXAQNICSTIUKHN-CYBMUJFWSA-N 262.397 2.492 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@](C)(O)C2)c(F)c1 163272879 RCANLTMCKXLXAN-IAQYHMDHSA-N 266.360 2.457 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](C3CC3)C2)c(F)c1 2146835080 URFHCCLELNWODJ-HICWGWBUSA-N 278.371 2.313 10 10 CECE CC1(C)C[C@@H](NCc2cccc(Cl)c2O)[C@H]1O 1998348988 GZICFGNJVHDQQL-ZYHUDNBSSA-N 255.745 2.295 10 10 CECE c1cc(N2CCCNCC2)ccc1OC[C@H]1CCCO1 43461575 YKRMSALEAYLYLM-MRXNPFEDSA-N 276.380 2.044 10 10 CECE CCN(C)[S@](=N)(=O)N(CC)Cc1ccc(N(C)C)cc1 2154231852 QOUCYRZADQOFIG-FQEVSTJZSA-N 298.456 2.403 10 10 CECE CCN(C[C@H](O)c1ccccn1)c1ccc(CN)cc1 2155633629 JHKBDOLZOYTWJC-INIZCTEOSA-N 271.364 2.100 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1CCCC[C@@H]1O 293540802 FYTYPPPUHIMHKU-GWCFXTLKSA-N 253.317 2.172 10 10 CECE C[C@@H]1C[C@H](F)CN1[C@@H](CN)c1ccc2c(c1)CCN2C 2160291757 MFDBVFUZNARKJM-WPGHFRTFSA-N 277.387 2.111 10 10 CECE CCN[C@@H]1CCN([C@@H](C)c2ccc(F)cc2O)C1 2030035782 LCNRSOIUMPCNGG-CMPLNLGQSA-N 252.333 2.276 10 10 CECE CC[C@@H]1COCCN(c2ccc(CN)cc2F)C1 2036797580 ZLBVGOPELNQCOX-NSHDSACASA-N 252.333 2.147 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC[C@@H](C(=O)O)C[C@H]1C 300198909 MDKBBMJYEPJAGP-OUAUKWLOSA-N 279.336 2.344 10 10 CECE COCCCOCCNCc1ccc2c(c1)CCCO2 2160556938 PNCDPUGWXZGEOP-UHFFFAOYSA-N 279.380 2.154 10 10 CECE CC[C@H](N)Cc1ccc2ccn(CC[S@@](C)=O)c2c1 400564058 NKUZVPBCJYMXPW-IFXJQAMLSA-N 278.421 2.300 10 10 CECE C[C@@H]1CC[C@@H](N(C)c2ccc(CN)c(F)c2)CO1 401513704 JFIOVJDKZZRSSI-ZWNOBZJWSA-N 252.333 2.288 10 10 CECE CC(=O)NCCN(C)c1ccc(CNC(C)C)cc1C 308179252 GLZDFHBLBGTNHZ-UHFFFAOYSA-N 277.412 2.065 10 10 CECE NCc1ccc(OC[C@H](O)CSc2nccs2)cc1 402955460 UJWACBMWQNRXIA-NSHDSACASA-N 296.417 2.134 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H](CN(C)C)C2)cc1 405146335 ZNCZNQSSNZMXGD-UONOGXRCSA-N 261.413 2.484 10 10 CECE Cc1cccc(CN2CCC[C@H](CN(C)C)C2)c1O 405184988 HRXZYKLGGAFRKJ-CQSZACIVSA-N 262.397 2.474 10 10 CECE COCCNCc1ccc(N2CCC(F)(F)C2)cc1 313383786 ICDJBOJYGDSLPK-UHFFFAOYSA-N 270.323 2.268 10 10 CECE Oc1ccccc1CNc1ncnc2scnc12 321201347 XPVQSCRNKTZKLS-UHFFFAOYSA-N 258.306 2.404 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C[C@@H]1OCC1(C)C 2159523644 YSCLTZBSKUTTDD-HNNXBMFYSA-N 276.380 2.376 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1ncc(C)cc1C 2161691377 HRBGBSNBUTUMSW-JKSUJKDBSA-N 272.348 2.398 10 10 CECE C[C@H](NCC1(O)CCSCC1)c1c(O)cccc1O 702238742 FVWIXKKUZRSXHE-JTQLQIEISA-N 283.393 2.007 10 10 CECE 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10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@]2(O)c1ccc(N(C)C)cc1 2329487128 WSCHHAGXLSXCAM-CUBALJKWSA-N 261.365 2.385 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)c(Cl)c1 2330783144 HDKGHJSEKLCKDJ-GLQYFDAESA-N 280.799 2.409 10 10 CECE C[C@H](N)CN(C)Cc1cc(OC(F)(F)F)ccc1O 2336031746 ZPYDKCOCRDXCMN-QMMMGPOBSA-N 278.274 2.070 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H]2C[C@H]1C[C@@H]2N(C)C 2341120460 FJETYLZEWJGRAA-DZKIICNBSA-N 260.381 2.016 10 10 CECE Cc1ccc([C@H](O)[C@H](N)c2ccccc2O)nc1C 2341615134 QCZPBQDBOCVHBJ-CABCVRRESA-N 258.321 2.137 10 10 CECE Nc1ccc(CCn2cc3c(cc2=O)CCC3)cc1 2342732672 ZONXQWCTQQTNAD-UHFFFAOYSA-N 254.333 2.162 10 10 CECE COc1ccnc(CSc2ncc(CO)s2)c1OC 2344203540 XKLFUKSEMRRIAZ-UHFFFAOYSA-N 298.389 2.340 10 10 CECE CCOc1cccc(CN2CC[C@@H](N)C2(C)C)c1O 2352412524 VCAUKKBQXNKYSP-CYBMUJFWSA-N 264.369 2.103 10 10 CECE Nc1ccc(NC(=O)CCOC[C@H]2C[C@H](F)C2)cc1 2352459501 QXAHSAOBBXSPCG-XYPYZODXSA-N 266.316 2.362 10 10 CECE COc1ccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@@]3(C)O)c(O)c1 2355727942 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Oc1ccc(Cl)c(F)c1CN1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 249614963 SOZMFMLEIRQJAF-WIWVTWSWSA-N 297.757 2.386 10 10 CECE CC[C@@]1(C)CN(c2ccc3c(c2)OCCCO3)CCN1 86122751 MPNCYMYOVLCLDN-INIZCTEOSA-N 276.380 2.426 10 10 CECE CNC(=O)[C@]1(C)CCN(Cc2cc(Cl)cc(C)c2O)C1 281158306 PMDNNDCCQPNDPF-OAHLLOKOSA-N 296.798 2.312 10 10 CECE Cc1nccnc1CN(C)CCCc1ccc(N)cc1 700091974 YRPFEDCPISBBQX-UHFFFAOYSA-N 270.380 2.432 10 10 CECE COc1ccc(N2CC[C@H](C)[C@H](OC)C2)c(N)c1 299958735 VPUJXKZRIYMELM-IINYFYTJSA-N 250.342 2.139 10 10 CECE COC[C@H]1CCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 293719038 TUDMYXCSOXWQIR-SNVBAGLBSA-N 286.715 2.175 10 10 CECE COc1cc(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)ccn1 2166951385 XBEBDSQSPRJSCQ-NSHDSACASA-N 275.312 2.395 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1COCCC1(F)F 2168221677 ZAGIBPHGCNJZBS-NSHDSACASA-N 285.294 2.157 10 10 CECE CCN(C[C@@H]1CCCNC1)c1ccc2c(c1)OCCO2 2162634923 DRTKPTILHPQBGK-CYBMUJFWSA-N 276.380 2.284 10 10 CECE c1cc2c(cc1N1CCC[C@@H]3CNC[C@H]31)OCCCO2 2162846992 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10 10 CECE Oc1c(F)cccc1[C@@H](N1CCOCC1)C(F)(F)F 575276660 GTQLHYIWGFHGLP-LLVKDONJSA-N 279.233 2.467 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@H]2CNCCC2(F)F)c1 817981370 RPTGRJQQUFUTSJ-MFKMUULPSA-N 270.323 2.348 10 10 CECE C[C@@H]1CN([C@H](C)c2cc(O)ccc2O)C[C@@H]1CC(=O)O 722650114 UQWPYKSYRZKZGH-MXWKQRLJSA-N 279.336 2.201 10 10 CECE Cc1cc(O)c(CN[C@@H]2CCC[C@@H](C(N)=O)C2)cc1Cl 825297381 DDMDXVOBUWJONJ-ZYHUDNBSSA-N 296.798 2.488 10 10 CECE CN(C)c1ccc(/C=C\CNC[C@H](N)C2CC2)cc1 841051626 SVVAYTBAEWVNOF-QGZUEGPWSA-N 259.397 2.093 10 10 CECE O=C(NCC[C@@H]1CC1(F)F)NCc1c(O)cccc1F 923363713 DIIHIJQISXOEIL-MRVPVSSYSA-N 288.269 2.376 10 10 CECE C[C@@H](NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1ccc(N(C)C)cc1 926943288 BYZOAHDTZCXODE-IRWJRLHMSA-N 290.407 2.207 10 10 CECE CC[C@H]1C[C@@H](NC(=O)NCc2c(O)cccc2F)CCO1 922933977 MLIFAKOOXFKZMP-QWRGUYRKSA-N 296.342 2.288 10 10 CECE CSc1ncc(CN[C@@H](C)[C@]2(C)CCN2)s1 2243813216 XBSPLUZEVLPCEG-KWQFWETISA-N 257.428 2.095 10 10 CECE O=C(NCc1ccc2cccnc2c1O)[C@H]1CC1(F)F 862025986 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10 10 CECE CCCN(CC1CCNCC1)c1ccc(OC)cc1N 2191577588 AOOROSCIRCNZPB-UHFFFAOYSA-N 277.412 2.493 10 10 CECE Oc1ccc([C@H]2NC[C@@H](CC(F)(F)F)O2)cc1O 2055506352 XCCQLLBXBWTRBO-XCBNKYQSSA-N 263.215 2.037 10 10 CECE CN[C@@H](C)c1ccc(N2CC(C)(CF)C2)cc1O 2057929554 GKBKEAWCKDCSHF-JTQLQIEISA-N 252.333 2.468 10 10 CECE C[C@@H]1C[C@@](CO)(CN(C)Cc2ccccc2O)CCO1 2192590218 SOCMEJLCPTYUMZ-CZUORRHYSA-N 279.380 2.002 10 10 CECE CC[C@@]1(C(=O)N[C@H](C)c2ccccc2O)CCCNC1 2192621473 CLUUFXUEOWKSSI-MLGOLLRUSA-N 276.380 2.349 10 10 CECE COc1ccc(=N[C@H](C)c2ccccc2O)[nH]c1OC 2192627057 SIQIGHOQVFBOHP-SNVBAGLBSA-N 274.320 2.399 10 10 CECE CC[C@H](N)Cc1ccc(N2C[C@H]3C[C@H]2CN3C)cc1C 2187601452 ZBULJYRGSZJJMP-UAGQMJEPSA-N 273.424 2.168 10 10 CECE CN1CCC[C@@H](N(C)c2ccc(CN)c(F)c2F)CC1 2192750031 MHAHCZNQNRHUIX-GFCCVEGCSA-N 283.366 2.344 10 10 CECE Cc1cc(N(C)[C@H]2C3CCN(CC3)[C@H]2C)ccc1CN 2192780751 MTYPQWGULUFJOY-SUMWQHHRSA-N 273.424 2.373 10 10 CECE COc1ccc(N2C[C@@H](CN(C)C)CC2(C)C)c(N)c1 2192940964 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2.131 10 10 CECE Cc1ccc(CN[C@]23CO[C@](CF)(C2)C3)c(O)c1 2084075275 KSMHXYCFYJWQCG-HDJSIYSDSA-N 251.301 2.061 10 10 CECE CCN(c1ccc(CO)c(OC)c1)[C@@H](C)COC 2084017805 WLNPPIFGEWNMHY-NSHDSACASA-N 253.342 2.049 10 10 CECE CNCc1ccc(N2CC(CSC)C2)cc1OC 2084015695 GXHGNPOWFHWHFY-UHFFFAOYSA-N 266.410 2.214 10 10 CECE CN(Cc1c(O)cccc1F)[C@H]1CCCC[C@H]1CN 2104511512 YJZSZOXVNOKTHL-FZMZJTMJSA-N 266.360 2.481 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2CCC1COC1 2104663380 NXGIYJCVJADHCR-GFCCVEGCSA-N 260.381 2.495 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CC[C@@H](C(C)C)C1 2085309708 CVGDVUBCLNXIFI-ZYHUDNBSSA-N 254.334 2.254 10 10 CECE COC[C@H]1CC[C@H]1N(C)c1ccc(CN)c(F)c1 2086265670 DRETXSBEXNMYQQ-BXUZGUMPSA-N 252.333 2.146 10 10 CECE COc1ccc(N2C[C@@]3(C)CNC[C@]3(C)C2)c(F)c1 2106381562 DMHWCKKVSUQQJA-HUUCEWRRSA-N 264.344 2.270 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@](C)(CC)CN)ccc21 2106799926 BTJLWAROLYGMFB-CVEARBPZSA-N 262.397 2.477 10 10 CECE CCO[C@@H]1C[C@H]1[C@H](N)c1ccc2c(c1)CCCN2C 2106830049 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CC(C)[C@@]1(O)CCN(CCCc2ccc(N)cc2)C1 2094377411 ODJUSSFZXWWVHP-MRXNPFEDSA-N 262.397 2.294 10 10 CECE COc1ccc(CN(C)[C@H]2COCC[C@H]2C)c(O)c1 2096269049 OOKCUGZUDQYZSO-RISCZKNCSA-N 265.353 2.258 10 10 CECE CCN[C@@H]1CCCN([C@H](C)c2ccc(O)cc2O)C1 2096690562 OTUCSTIEHNHTPF-VXGBXAGGSA-N 264.369 2.233 10 10 CECE Nc1ccc(CCN2CC[C@@H]([C@@H]3CCCO3)C2)cc1 2096708455 QLRYLIPMHSOURX-ZBFHGGJFSA-N 260.381 2.312 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCCCN2CCCC2=O)C1 2113413467 GCNSMGXMWZACHG-LBPRGKRZSA-N 265.361 2.021 10 10 CECE C[C@H](N)c1ccc(N(C)Cc2cccn2C)cc1O 2114547550 LQKPLDOMEQMXEU-NSHDSACASA-N 259.353 2.387 10 10 CECE CON(C)CCCNCc1ccc(Cl)cc1O 2213585055 JZOKZHNHOOFVOG-UHFFFAOYSA-N 258.749 2.019 10 10 CECE COc1cc(N(C)[C@H]2COC3(CCC3)C2)ccc1CN 2204541583 PEXKSVSJUGZROY-CQSZACIVSA-N 276.380 2.302 10 10 CECE CCNCc1ccc(N(C)[C@H]2CCC[C@@H]2O)cc1OC 2204559479 POHVIJWUTZAOLR-GJZGRUSLSA-N 278.396 2.154 10 10 CECE COc1cccc(O)c1CNC[C@H]1CCC2(CC2)CO1 2205213129 BIJAGJIEEFPIRY-GFCCVEGCSA-N 277.364 2.450 10 10 CECE COC[C@]1(C)C[C@@H]1N[C@H](C)c1cc(OC)ccc1O 2269284630 LHISGXKKQUSPCP-ONERCXAPSA-N 265.353 2.476 10 10 CECE CO[C@H]1[C@@H](NC(=O)Nc2ccc(N)cc2)CC12CCC2 2206703337 ZFLSFLLVXIDISO-STQMWFEESA-N 275.352 2.348 10 10 CECE Cc1cc(N2[C@H]3CC[C@@H](C3)[C@H]2CO)ccc1[C@H](C)O 2269674381 XZXBIEOOOILFGR-LMRQPLJMSA-N 261.365 2.398 10 10 CECE COc1cc(OC)c(N2CC[C@@](F)(CO)C2)cc1Cl 2270422938 QRRKNLPQHOXJRY-ZDUSSCGKSA-N 289.734 2.268 10 10 CECE C[C@]12CC[C@H]1CN(c1cc3c(cc1F)[C@@H](O)C(=O)N3)C2 2208304547 GEYUWVLOOUSYDE-RPAKXZQJSA-N 276.311 2.048 10 10 CECE CSc1ncc(CNCCN2CCCC2)s1 2208427176 GTQRZXYSSUEHSN-UHFFFAOYSA-N 257.428 2.050 10 10 CECE COc1ccc(N(C)C[C@@H](O)C(C)C)cc1OC 2219642896 LLEAVUURYILGKH-GFCCVEGCSA-N 253.342 2.157 10 10 CECE OCCCC1CN(c2ccc3c(c2)CCC[C@@H]3O)C1 2230519006 IZKQLFWYJCCCSV-INIZCTEOSA-N 261.365 2.265 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(=O)O)c1c(F)ccc(F)c1F 2231185160 ISXMDLCMLBWKAA-SECBINFHSA-N 274.202 2.130 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC(C)(C[S@@](C)=O)C1 2232096078 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IKCQKCAZMXJKQI-HRCADAONSA-N 272.392 2.134 10 10 CECE CN1CCc2cc(N3CCC(C4(O)CC4)CC3)ccc21 2235127805 WFKPGELWQIMUSE-UHFFFAOYSA-N 272.392 2.420 10 10 CECE COc1ccc(N2CC[C@H]3[C@H]2C(C)(C)[C@@H]3O)cc1OC 2235121855 WHLCSBLFQABMHM-TUKIKUTGSA-N 277.364 2.299 10 10 CECE COc1ccc(N2C[C@H]3CCC[C@]3(CO)C2)c(OC)c1 2235119399 HGSPNERJFYKAKX-MLGOLLRUSA-N 277.364 2.303 10 10 CECE CCC(CC)(CC(=O)N(C)CCCN=[N+]=[N-])C(=O)O 2225796458 XHPMJACXNAFEPV-UHFFFAOYSA-N 270.333 2.426 10 10 CECE CN(CCN=[N+]=[N-])C(=O)CC1(CC(=O)O)CCCC1 2225792394 MUZLLPIPFKQXOK-UHFFFAOYSA-N 268.317 2.180 10 10 CECE COc1ccc(N2CCC[C@H]2CO)c(CNC(C)C)c1 2235969419 DMWGIEXLSCFRET-AWEZNQCLSA-N 278.396 2.154 10 10 CECE CN1CCC(COCCCOc2ccc(N)cc2)CC1 2235924130 PFSQVGXTEIHCHH-UHFFFAOYSA-N 278.396 2.396 10 10 CECE COc1ccc(N(CC(C)C)C2COC2)c(C(=O)O)c1 2235945832 KVHMNFNSZJIRLG-UHFFFAOYSA-N 279.336 2.255 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H](C)CO2)c(CCN)c1 2235975113 PWQUCIBSCQXXJI-DOMZBBRYSA-N 278.396 2.058 10 10 CECE C[C@@H](O)[C@H]1CCCN(c2ccc3c(c2)CCN3C)C1 2226806677 CMHGNJIBRLHCTJ-OCCSQVGLSA-N 260.381 2.276 10 10 CECE OCCN(c1ccc2c(c1)OCCCO2)C1CCC1 2226810984 LLRYUYIKOFZFPK-UHFFFAOYSA-N 263.337 2.199 10 10 CECE COc1ccc(N(C)[C@H]2CCCC[C@H]2O)c(OC)c1 2226805092 MGINBZOKRWPECZ-GXTWGEPZSA-N 265.353 2.444 10 10 CECE COc1ccc(N2CCC[C@@](CO)(OC)C2)cc1Cl 2226937426 UWDZKYUGVJWHDE-CQSZACIVSA-N 285.771 2.326 10 10 CECE COc1ccc(N2CC[C@@H]3[C@@H](OC)C[C@H]32)c(C=O)c1 2227695895 QHIXZRTXWXLHJA-CFVMTHIKSA-N 261.321 2.121 10 10 CECE COc1ccc(N2CC[C@@H](C)O[C@H](C)C2)c(CO)c1 2227709175 QSKUVDKZRNNPLW-VXGBXAGGSA-N 265.353 2.191 10 10 CECE CNCc1ccc(N(C)C[C@@H]2CC[C@@H]2OC)c(F)c1 2227831719 WYOSMHAYIAPAEI-WFASDCNBSA-N 266.360 2.406 10 10 CECE CO[C@]12CC[C@@H]1CN(Cc1cc(C(C)=O)ccc1O)C2 2239144869 QAWKLSORCZMYRC-ZBFHGGJFSA-N 275.348 2.206 10 10 CECE CN1CCc2cc(CNCc3ncccc3O)ccc21 2239401194 GYYRIBSEKDTNMD-UHFFFAOYSA-N 269.348 2.069 10 10 CECE O[C@@H]1CCN(c2c(F)cc(CNC3CCC3)cc2F)C1 2240030322 CDTFFVBLPBIUKP-GFCCVEGCSA-N 282.334 2.178 10 10 CECE CC[C@@H](C)NCc1ccc(OC[C@](C)(O)CO)c(C)c1 2240233246 VCCJSVSEFSXZAP-CZUORRHYSA-N 281.396 2.005 10 10 CECE CN(C(=O)[C@H]1OCC[C@@H]1C(F)(F)F)c1ccc(N)cc1 2240534023 IZJPRBTWNUEPBO-QWRGUYRKSA-N 288.269 2.199 10 10 CECE Cc1cc(N(CCOCCO)C(C)C)ccc1[C@@H](C)N 2285131681 NFLMLSVNVZJRRB-CQSZACIVSA-N 280.412 2.238 10 10 CECE COc1c(F)cc(N2CCCN[C@@H](C)C2)cc1F 2256174740 POCLQEHYURAMBF-VIFPVBQESA-N 256.296 2.162 10 10 CECE CSc1ncc(CNCC(F)(F)[C@@H](N)C2CC2)s1 2257128702 SAUKBTOEVKOGGS-VIFPVBQESA-N 293.408 2.327 10 10 CECE CCOC(=O)c1cnc(SC[C@H]2NCC[C@@H]2C)s1 2260269248 QCXXZUVBNYSXRO-DTWKUNHWSA-N 286.422 2.410 10 10 CECE CC[C@@H](C)N(C)Cc1ccc(N2CCNCC2)cc1 2270551586 XMKDPWKJUJWFSI-CQSZACIVSA-N 261.413 2.327 10 10 CECE COC1(C(=O)N2CCC[C@H](CN=[N+]=[N-])C2)CC(C)C1 2266435963 MWMVIZPLTVHLCY-QWKFWESOSA-N 266.345 2.350 10 10 CECE O[C@@H]1C[C@@H]2CN(c3ccc(OC(F)F)cc3)CC[C@H]21 2278526696 QJILTBSCODMNIL-OASPWFOLSA-N 269.291 2.495 10 10 CECE C[C@@H](NS(=O)(=O)Cc1ccc(N)cc1)[C@@H]1CC12CCC2 2283736953 BOSBZPSTJVJGPJ-RISCZKNCSA-N 294.420 2.267 10 10 CECE COC[C@]1(C)C[C@H]1CN(C)c1ccc(CO)c(OC)c1 2284631958 BVQYTPSIDYXJRQ-BBRMVZONSA-N 279.380 2.296 10 10 CECE CCNCc1cc(F)c(N2CC[C@@H](O)[C@@H]2CC)c(F)c1 2288900401 OPPCYXHGPNPXNL-UONOGXRCSA-N 284.350 2.424 10 10 CECE CS(=O)(=O)[C@H]1CC[C@@H](Sc2ncc(C=O)s2)C1 2302967195 HKUPGIPFQZKSKO-APPZFPTMSA-N 291.419 2.013 10 10 CECE COc1ccc(NC(=O)Cc2ccc(N)cc2)c(C)n1 1218537926 MQVACIZKXWAHTJ-UHFFFAOYSA-N 271.320 2.162 10 10 CECE Cc1ccc(CN[C@@H]2CCCNC2)c(O)c1Br 2307481520 FXISBWCAGJWPQH-LLVKDONJSA-N 299.212 2.305 10 10 CECE CP(C)(=O)CCN1CCc2cc(O)c(O)cc2C1 2318669719 QBJIYFFMCMPKGH-UHFFFAOYSA-N 269.281 2.079 10 10 CECE Cc1nc(N2CCc3cc(O)c(O)cc3C2)cs1 2318672922 HKNSVXUGIUJRRY-UHFFFAOYSA-N 262.334 2.425 10 10 CECE CSc1cc(N2CCO[C@H](C)CC2)ccc1CN 2328545061 TWAWMIFGBWZPRP-LLVKDONJSA-N 266.410 2.482 10 10 CECE CC[C@H](O)CN(CC)c1ccc(CN)c(SC)c1 2328544923 QLAOCDJDYMCGGC-ZDUSSCGKSA-N 268.426 2.464 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H]3CCC[C@@H](N)C3)ccc21 2329487205 ZPNUOLAOGCVWCJ-XPKDYRNWSA-N 260.381 2.230 10 10 CECE CC1(C)[C@H](O)CCN1c1ccc(CO)c(C2CC2)c1 2339147433 XLFYKXAKWUOEIK-OAHLLOKOSA-N 261.365 2.406 10 10 CECE CO[C@@H]1CN(c2ccc(CN)c(C3CC3)c2)C[C@@H]1F 2339161870 VLNPCQFXVJBVPZ-LSDHHAIUSA-N 264.344 2.196 10 10 CECE CC(C)CNCc1ccc(N(C)CC2(O)CC2)cc1 2340246488 CTCJKMDIGKPHDB-UHFFFAOYSA-N 262.397 2.393 10 10 CECE COc1ccnc(C[S@@](=O)CCCN=[N+]=[N-])c1OC 2344201098 QFFVAJGIOKDGDU-IBGZPJMESA-N 284.341 2.048 10 10 CECE C[C@@H](CN(C)C)N(C)c1ccc2c(c1)CCC[C@H]2O 2351784749 RIMRCGHVLQPVGX-BLLLJJGKSA-N 262.397 2.443 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)C[C@@H]4CC[C@H]3C4)ccc21 2354608201 LGELKYLVPQWCOH-UMPQAUOISA-N 272.392 2.230 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CC[C@H](C)NC3)ccc21 2354609118 VIELIRNKZMJHFP-XGWLTEMNSA-N 274.408 2.491 10 10 CECE COc1cccc(OC[C@@H](O)COc2ccc(N)cc2)c1 51327498 FVVUHYRRFXXQHS-ZDUSSCGKSA-N 289.331 2.096 10 10 CECE O=C1C/C(=C/c2ccc(O)c(O)c2)C(=O)N1c1ccccc1 102736428 RLUHQBYYAFIGIW-WQLSENKSSA-N 295.294 2.445 10 10 CECE CCCOc1cc(N2CCCN(C(C)=O)CC2)ccc1N 111053809 CJBYYRFZYPKTGB-UHFFFAOYSA-N 291.395 2.116 10 10 CECE COCCN(CC(F)F)c1ccc(OC)c(OC)c1 174799574 OCQQZVJFODHHMW-UHFFFAOYSA-N 275.295 2.422 10 10 CECE CCO[C@H]1CCCN(c2ccc(CNCCOC)cc2)C1 62737545 MONJWOUKQKCABR-KRWDZBQOSA-N 292.423 2.428 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)C[C@H]1CCCN1 300125105 HOPXIWZBUSEUAG-CMPLNLGQSA-N 252.333 2.276 10 10 CECE CCN1CC[C@H](CNC)[C@@H]1c1ccc(N(C)C)cc1 70282375 QGISANWOCPDGLO-ZBFHGGJFSA-N 261.413 2.355 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CCc2c(F)cccc21 214687748 WXQAPCHOCHDCIF-CQSZACIVSA-N 292.314 2.430 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N1CCCN(C)CC1 220114291 ZYECBGVJTDPSMS-ALCCZGGFSA-N 274.364 2.235 10 10 CECE C[C@@H]1CN([C@H](C)c2ccc(F)cc2O)C[C@H]1C(=O)O 227818532 PPPMSMLACLJTGJ-KBVBSXBZSA-N 267.300 2.245 10 10 CECE C[C@@]1(CNC(=O)c2ccc(O)c(O)c2)CCCS1 227039712 WDPRSTJGHOEQEP-ZDUSSCGKSA-N 267.350 2.113 10 10 CECE Nc1ccc(CCC(=O)Nc2ccc(Cl)nn2)cc1 223854419 UZJRVLIXSBYTEW-UHFFFAOYSA-N 276.727 2.284 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@@H](CC(=O)O)C1 227725170 JNBQCPZRWYRPIJ-ZJUUUORDSA-N 267.300 2.389 10 10 CECE Nc1ccc(CC(=O)Nc2cc(F)ccc2[N+](=O)[O-])cc1 149077056 TWPGJZJBKPOFSD-UHFFFAOYSA-N 289.266 2.497 10 10 CECE CCN(CC)[C@H](C)CNCc1cccc(OC)c1O 236870284 JNEVOCWZAPYLPZ-GFCCVEGCSA-N 266.385 2.221 10 10 CECE C[C@@H]1SCCC[C@@]1(NCCCN=[N+]=[N-])C(=O)O 94480043 COISSQMTARFYHE-WPRPVWTQSA-N 258.347 2.015 10 10 CECE CCCN(CC(=O)N(C)C)Cc1cc(OCC)ccc1O 92382425 HQLJFWFYRWPBHJ-UHFFFAOYSA-N 294.395 2.091 10 10 CECE Oc1cc(Cl)ccc1CN1CCNC[C@@H]1C(F)(F)F 1236975746 JNLJYOXVMWMSJL-LLVKDONJSA-N 294.704 2.382 10 10 CECE O=C(Nc1ncccc1Cl)c1ccc(O)c(O)c1 236574213 JDBRFQVCOKHARX-UHFFFAOYSA-N 264.668 2.399 10 10 CECE COc1cccc(CS(=O)(=O)Nc2ccc(N)cc2)c1 243440805 NBRFAKGOGXHSDR-UHFFFAOYSA-N 292.360 2.219 10 10 CECE C[C@H]1CO[C@H](C)CN1Cc1cc2c(cc1O)CCC2 249054423 LGGKGXBKIOVXKG-NWDGAFQWSA-N 261.365 2.490 10 10 CECE CC(=O)c1ccc(O)c(CN2CC[C@H](C)[C@H](CO)C2)c1 700391943 GTVWAFGBVDHTSG-NHYWBVRUSA-N 277.364 2.045 10 10 CECE COC(=O)[C@@H](C)Cc1c(Br)ccc(O)c1O 260082804 AUEMIDLJRFDKJL-LURJTMIESA-N 289.125 2.212 10 10 CECE Cc1cccc(CN2CC(C)(C)O[C@]3(CCOC3)C2)c1O 280380064 WBEBTJVJICXZDN-QGZVFWFLSA-N 291.391 2.471 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@H]2C[C@H]1CO2 387418165 FNXZSZKHBMUUQM-LSDHHAIUSA-N 260.381 2.471 10 10 CECE O=C(COc1ccsc1)NCc1ccccc1O 800519097 LQGWFGZODLQHQS-UHFFFAOYSA-N 263.318 2.149 10 10 CECE CC[C@@H](O)[C@H](N)c1ccc(Cl)c(Cl)c1O 396750227 QVNMJQSKNPMOEV-VXNVDRBHSA-N 250.125 2.470 10 10 CECE CCCOc1ccc(N2CC[C@H]3OCCN[C@H]3C2)cc1 2162654895 FGNGZSPJVMTSGY-JKSUJKDBSA-N 276.380 2.043 10 10 CECE NC[C@@H]([C@@H](O)c1ccc(N2CCCC2)cc1)C(F)(F)F 2163107710 PNAUMLLUMAHGLK-STQMWFEESA-N 288.313 2.457 10 10 CECE CN1CCCc2cc(C3(O)C[C@@H]4CC[C@H](C3)N4)ccc21 2163111907 XBXMCBMUFBFRPQ-FKEKPDDDSA-N 272.392 2.171 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@]1(O)CCCSC1 2163136277 RJDMFPYSAFIIEO-HZPDHXFCSA-N 292.448 2.198 10 10 CECE CN1CCc2cc([C@H](N)[C@@]3(O)CCCC3(F)F)ccc21 2163138775 QPKTVDCMLAMTKS-KBPBESRZSA-N 282.334 2.229 10 10 CECE CC(C)[C@@](C)(CO)NCc1ccc(N(C)C)c(F)c1 810173040 VUQGOPWJGMMCCR-OAHLLOKOSA-N 268.376 2.388 10 10 CECE COc1ccc(O)c(CNc2nccnc2OC(F)F)c1 811804995 GYOQUJDZXVCHQL-UHFFFAOYSA-N 297.261 2.404 10 10 CECE CO[C@]1(CO)CCCN(Cc2c(O)cccc2Cl)C1 826952413 JYZPPIKEGJQMTO-CQSZACIVSA-N 285.771 2.019 10 10 CECE Oc1ccc(Cl)c(F)c1CN1CC[C@@](O)(C(F)F)C1 824726139 GHHQKXMEABFOBT-LBPRGKRZSA-N 295.688 2.387 10 10 CECE CC1(C)CC[C@H](CN2CCc3cc(CN)ccc32)O1 2133388872 WVFCOTGCYRKKSQ-CQSZACIVSA-N 260.381 2.465 10 10 CECE C[C@H](O)CC(C)(C)CNC(=O)/C=C\c1ccc(O)c(O)c1 588405723 MSKVFCGJDMJOEV-XOIDGJRKSA-N 293.363 2.024 10 10 CECE CO[C@@H]1C[C@H]1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 822831495 DJVAACBIHSKATA-DAXOMENPSA-N 290.407 2.143 10 10 CECE CSc1ncc(CNC(=N)NC(C)(C)C)s1 2243799446 BAELEUURJWKBEL-UHFFFAOYSA-N 258.416 2.277 10 10 CECE CN(C)c1ccc(/C=C\CNC[C@]2(O)CCSC2)cc1 835043158 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CCN1CCc2cc([C@@H](O)[C@H]3C=CCCN3)ccc21 2126015304 RAKIPYXWYLSFHV-GDBMZVCRSA-N 258.365 2.021 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1COCC(C)(C)O1 1966159870 VFEYHKXFZCWHPU-CYBMUJFWSA-N 265.353 2.018 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2O)C1(CO)CCCC1 2128323873 XHIBRSRYWBCLGF-OAHLLOKOSA-N 261.365 2.408 10 10 CECE COc1ccc(N2CC[C@H](O)[C@H]2C(C)(C)C)c(N)c1 2128672966 ZSHGDQLQUVUKHG-KBPBESRZSA-N 264.369 2.263 10 10 CECE CN(C)c1ccc([C@H](c2ccccn2)N2CCNCC2)cc1 19932429 MVHLTIWIYIQGFN-GOSISDBHSA-N 296.418 2.142 10 10 CECE COc1ccc(N(C)CC2(C(=O)O)CC2)cc1F 259004775 WVPGOVRMXNJHCA-UHFFFAOYSA-N 253.273 2.135 10 10 CECE CCn1nc([C@H](N)c2ccc(N(C)C)cc2)cc1C 2129242593 BCHUFMUJLOBEGT-OAHLLOKOSA-N 258.369 2.326 10 10 CECE CCCN(CC)C1CN(c2ccc(CO)cc2F)C1 2141158780 BKAGDCJNQPHDMC-UHFFFAOYSA-N 266.360 2.239 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2CC1CN(C)C1 2134890833 MBPXZIMVKCHQSI-GFCCVEGCSA-N 259.397 2.021 10 10 CECE CO[C@@H]1CCN(c2ccc([C@@H](C)O)cc2[N+](=O)[O-])[C@@H]1C 1914237649 AOFRUPSOLVVFJG-GPCCPHFNSA-N 280.324 2.262 10 10 CECE CC(C)CN(c1ccc2c(c1)NC(=O)[C@H]2N)C1CC1 103424526 GWTPMGIUJAKDCU-AWEZNQCLSA-N 259.353 2.263 10 10 CECE Nc1ccc(CCNC(=O)C2CCC(F)CC2)cc1 1969321402 ZBVLYVULWGWPDD-UHFFFAOYSA-N 264.344 2.456 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CCC[C@H](F)C2)cc1 1967160453 HPSUTENOAMIOTG-STQMWFEESA-N 264.344 2.456 10 10 CECE Cc1ccc([C@H](C)NCCOCC(C)(C)O)c(O)c1 1967464145 ZTZXGHCYQXLRQU-LBPRGKRZSA-N 267.369 2.139 10 10 CECE COc1ccc(O)c([C@H](C)NCCN2C[C@H]3C[C@@H]3C2)c1 1967517123 PNLYUPPBAAIEDS-YNEHKIRRSA-N 276.380 2.003 10 10 CECE C[C@H](NCCNC(=O)OC(C)(C)C)c1ccc(O)cc1O 227604401 YBWHZTCYUCPPMB-JTQLQIEISA-N 296.367 2.273 10 10 CECE CNCc1ccc(N2CCC[C@](C)(O)CC2)cc1C 230359853 PTYXMOGBGBKVLO-INIZCTEOSA-N 262.397 2.456 10 10 CECE COc1ccc([C@@H](C)NCC[C@H]2CCOC2)c(O)c1 230672483 BIJBSCITZIQHKJ-NEPJUHHUSA-N 265.353 2.478 10 10 CECE Cc1ccc(CN[C@@H]2C[C@H]3CC[C@H]2[C@@H](O)C3)c(O)c1 2139761679 JBLHUNIGYYWYDU-MEWXFMAXSA-N 261.365 2.340 10 10 CECE CCN(CC(N)=O)c1ccc(CNCC(C)C)cc1C 231823587 DVBVZENUAHDWEK-UHFFFAOYSA-N 277.412 2.052 10 10 CECE CCn1cc(NCc2ccc(C)cc2O)ccc1=O 2139771212 WAIASBLYGBOBEO-UHFFFAOYSA-N 258.321 2.494 10 10 CECE C[C@@H]1C[C@]1(F)CN(C)c1ccc(CO)cc1[N+](=O)[O-] 2141403673 OKBNCZBGCWOTKS-RNCFNFMXSA-N 268.288 2.271 10 10 CECE CNC(=O)CCN(C)c1ccc(CNC(C)C)c(Cl)c1 234374254 FYDREZGQEVBEAT-UHFFFAOYSA-N 297.830 2.410 10 10 CECE CC(=O)C(=O)[C@@]1(O)CCCCC[C@@H]1C(F)(F)F 1943256743 WQBKBKXKFKSHJF-WCBMZHEXSA-N 252.232 2.018 10 10 CECE CCCOCCCN1CCN(c2ccc(N)cc2)CC1 2149040993 QDHYOQBYXDGVEC-UHFFFAOYSA-N 277.412 2.208 10 10 CECE COC[C@H]1CCCN(CCCc2ccc(N)cc2)C1=O 2150855738 GPTLLAKWVREULS-CQSZACIVSA-N 276.380 2.086 10 10 CECE Oc1cc(Br)ccc1CN[C@@H]1C[C@H]2OCC[C@@H]12 1946506339 DGDLRTXCCTXJSU-DMDPSCGWSA-N 298.180 2.422 10 10 CECE CCOC(=O)[C@H](N)c1ccc(N(CC)CC)cc1OC 1951384170 BEALXAPBVQWIDQ-CQSZACIVSA-N 280.368 2.104 10 10 CECE COc1ccc(N=NN2CCNCC2)cc1Cl 2330173800 UAVGDCMKICCKHK-UHFFFAOYSA-N 254.721 2.253 10 10 CECE COC(=O)[C@@H]1CCN[C@@H]1c1ccc(N2CCCC2)cc1 1952851112 UTVDKWCPBTWPFZ-HUUCEWRRSA-N 274.364 2.110 10 10 CECE C[C@H]1OCC[C@@H]1CCNCc1c(O)cccc1F 1972148870 XEHKMOIWJYSATC-MNOVXSKESA-N 253.317 2.436 10 10 CECE Oc1c(CN2CCOC[C@H]2C(F)(F)F)ccc(F)c1F 2150467196 CPKGNFMSZVGDJD-VIFPVBQESA-N 297.223 2.434 10 10 CECE Cc1cccc(CN[C@@H](C)[C@H]2CCCS(=O)(=O)C2)c1O 2146111745 JZTAIZMPZVMOOC-JSGCOSHPSA-N 297.420 2.004 10 10 CECE CC(C)NCc1ccc(N2CCNC(=O)[C@H]2C)c(Cl)c1 164071127 SFHSOMLPVQMKJE-LLVKDONJSA-N 295.814 2.163 10 10 CECE CN(CCN=[N+]=[N-])S(=O)(=O)C1CCCCCC1 1998399259 GYDHVUQOJYGKFL-UHFFFAOYSA-N 260.363 2.281 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4C[C@H]3[C@@H]3C[C@H]43)c(Cl)cc21 2159509949 OPTMXJHVLHWCFC-CBXJATJCSA-N 289.766 2.137 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CC(C(C)(F)F)C2)cc1 2151480926 RGWVGUDSESBVDC-CQSZACIVSA-N 283.366 2.339 10 10 CECE CNCc1ccc(N2CCC[C@](O)(COC)C2)c(Cl)c1 2151837642 MIPPLKRFJOPFBZ-OAHLLOKOSA-N 298.814 2.037 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3CCN(C)[C@@H]3C2)c(F)c1 2158534520 AJKRVXGSKDWYIR-XHBSWPGZSA-N 278.371 2.409 10 10 CECE C[C@@H]1CCO[C@@H]1COCCC(=O)Nc1ccc(N)cc1 2152440394 MSWMGIFXLOHHQV-BXUZGUMPSA-N 278.352 2.039 10 10 CECE COc1ccc(CNC[C@]23CCC[C@H]2CCO3)c(O)c1 2153054368 ZGZCXXGCKOJRQB-XJKSGUPXSA-N 277.364 2.450 10 10 CECE Cc1ccc([C@H](C)N2CCOC[C@H]2CN(C)C)c(O)c1 2153247803 ONJMNPOWTWIXSM-UONOGXRCSA-N 278.396 2.024 10 10 CECE CN1[C@H]2CC[C@@H](NCc3ccc(O)c(O)c3)C[C@H]1CC2 2154197871 HDUYYWHXIZDIOR-HZSPNIEDSA-N 276.380 2.203 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@@H](O)[C@H]2CC3)c(F)c1F 2154105430 DXZVKJJUFRHMEV-DMDPSCGWSA-N 282.334 2.306 10 10 CECE CC[C@@]1(C)OCCC[C@H]1Nc1c(N)cccc1C(N)=O 2155097067 GHEZJSQIUKRVCP-IUODEOHRSA-N 277.368 2.127 10 10 CECE COc1ccc(CNCCP(C)(C)=O)c(O)c1 2018300189 IVKQOMBXYUIHDN-UHFFFAOYSA-N 257.270 2.113 10 10 CECE Nc1ccc(OC[C@@H](O)COc2cccc(F)c2)cc1 51327615 XWHQKDIVRSPSGM-CYBMUJFWSA-N 277.295 2.227 10 10 CECE C[C@H](c1cncs1)N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 2155722826 PVLMCGNAFOHKLI-AMIZOPFISA-N 289.360 2.326 10 10 CECE CCCN(Cc1cnsn1)c1ccc(CN)cc1 2027256149 DQMXTIAJOORZBN-UHFFFAOYSA-N 262.382 2.413 10 10 CECE C[C@H](NC(=O)Cc1ccc(N)cc1)[C@H]1CCSC1 2029415031 SCWFCEROPHFZOR-JQWIXIFHSA-N 264.394 2.069 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3C(CO)[C@@H]3C2)cc1Cl 2030274979 KRHCKFUVAJZRGO-GGZOMVNGSA-N 266.772 2.034 10 10 CECE NC(=O)c1cccc(N)c1NC1CCC(F)CC1 2032144298 KPNNPXSKYAENCM-UHFFFAOYSA-N 251.305 2.060 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)CCS[C@H](C)C1 2034215662 FYYPJMPYJODUJR-HONMWMINSA-N 267.394 2.299 10 10 CECE C[C@H](O)c1ccc(N2CC3(CN(C)C3)C2)c(Cl)c1 2034815921 SEVJDHIXAWSWBO-JTQLQIEISA-N 266.772 2.145 10 10 CECE COc1ccc(O)c([C@H](C)N(C)[C@@H](C)CCN)c1 2040925246 OPFQUYMAHUFYCV-QWRGUYRKSA-N 252.358 2.131 10 10 CECE CCOc1cccc(CN2C[C@H](C)CNC[C@@H]2C)c1O 2159125411 NEKBAHVLNUGUJV-OLZOCXBDSA-N 278.396 2.221 10 10 CECE C[C@H](N[C@H]1CCCOCC1)c1cc(O)ccc1O 310849700 PHIDDVPCOUIWSE-QWRGUYRKSA-N 251.326 2.318 10 10 CECE CCn1ccc(NC(=O)CCc2ccc(N)cc2)n1 311529156 XPWFGBUVBCFRJH-UHFFFAOYSA-N 258.325 2.057 10 10 CECE Nc1ccc(CC(=O)N2CC[C@H](C(F)(F)F)C2)cc1 311959297 ONQCICBBKPPVME-JTQLQIEISA-N 272.270 2.222 10 10 CECE CO[C@H]1CCCC[C@H]1OC(=O)Cc1ccc(N)cc1 312091915 ZWSIDNUUSKBXIT-UONOGXRCSA-N 263.337 2.312 10 10 CECE OCc1cc(F)c(N2C[C@@H]3CCC[C@]3(CO)C2)c(F)c1 2159404596 KBVWVHKREFSBMB-XHDPSFHLSA-N 283.318 2.056 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NC1COCCOC1 313210653 PGPNWTCMLUUCJA-AAEUAGOBSA-N 277.364 2.254 10 10 CECE Cc1cccc(O)c1CN[C@@H]1CCOC12CCOCC2 2160784091 HLNAQXCHRNRVHL-OAHLLOKOSA-N 277.364 2.128 10 10 CECE COc1cccc(O)c1CN1C[C@@H](C(=O)O)CC[C@H]1C 2160713811 NKGQKCDECZRPDB-MNOVXSKESA-N 279.336 2.086 10 10 CECE O=C(O)[C@H]1CN(Cc2c(O)cccc2Cl)CC1(F)F 700525084 MTECTMSPSRLFFI-MRVPVSSYSA-N 291.681 2.197 10 10 CECE Cc1cnn(C2CN(c3c(F)cc(CO)cc3F)C2)c1 2170296266 BDYLIYKTWJUSFA-UHFFFAOYSA-N 279.290 2.023 10 10 CECE CCNCc1ccc(N2C[C@@H]3CN(C)C[C@H]3C2)c(C)c1 706981276 ABCQNAZAOSLPOL-HOTGVXAUSA-N 273.424 2.102 10 10 CECE CN(c1ccc(CO)c(Cl)c1)[C@@H]1CCC[C@@H]1O 708580619 QJFDMFUELRRJST-OLZOCXBDSA-N 255.745 2.182 10 10 CECE CNCc1cc(F)c(N(C)C[C@H]2CCC[C@@H]2O)c(F)c1 689848435 QGAZMFQPAUHFLW-RISCZKNCSA-N 284.350 2.281 10 10 CECE CCN1CC(CN(C)c2ccc(CO)cc2Cl)C1 709361231 BWGSROULNRJMNX-UHFFFAOYSA-N 268.788 2.220 10 10 CECE C[C@@H](CN(C)C(=O)COc1ccc(N)cc1)C(F)(F)F 2179747682 PHDYVKVKMMUKIJ-VIFPVBQESA-N 290.285 2.304 10 10 CECE C[C@H](C(N)=O)N(C)Cc1cc(Cl)cc(Cl)c1O 711129487 MICDPAGYGAUZHH-ZCFIWIBFSA-N 277.151 2.005 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@H]3CN[C@@H](C3)C2)cc1OC 2162648695 HQLRVIYURSMART-SGMGOOAPSA-N 276.380 2.281 10 10 CECE Nc1ccc(OCCC(=O)Nc2cnsc2)cc1 690728450 UJEUAFBTTFJGPH-UHFFFAOYSA-N 263.322 2.133 10 10 CECE Cc1c(CNCc2cnc(O)[nH]2)n(C)c2ccccc12 379734038 BYWXAGIUEARCBR-UHFFFAOYSA-N 270.336 2.205 10 10 CECE CC[C@H](NC)c1ccc(N(C)C[C@@H](COC)OC)cc1 691274496 VXJNCRCUKUVQMK-HOTGVXAUSA-N 280.412 2.455 10 10 CECE C[C@H](c1cc(O)ccc1O)N1C[C@@H]2CCC[C@@]2(CN)C1 380737930 LPOLVJNKBLBCKB-BFQNTYOBSA-N 276.380 2.220 10 10 CECE CCN1CCc2cc([C@@H](O)[C@H]3CC34CC(N)C4)ccc21 2163062343 LVFIGSVSRFPKPD-OGOZQZCJSA-N 272.392 2.230 10 10 CECE CCN1CCc2cc([C@H](O)c3cnc(C)cn3)ccc21 2163075602 GEMGATONVNSLJO-INIZCTEOSA-N 269.348 2.249 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)[C@@H](C)COC 2163137646 FCJRPBFQJIVNAP-MAZHCROVSA-N 280.412 2.047 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)C1(O)C[C@@H]2C[C@H]2C1 2163243909 RHDBEOPXDDYZRG-OFQRWUPVSA-N 272.392 2.448 10 10 CECE CCC1(O)CN(c2ccc([C@H](C)N)cc2Cl)C1 384125056 KCQNBTICGLODIR-VIFPVBQESA-N 254.761 2.321 10 10 CECE C[C@@H]1C[C@@H](N(C)c2cc3c(cc2N)OCCO3)[C@@H](C)O1 384686402 BQVAOMYEMCGDQG-CKYFFXLPSA-N 278.352 2.042 10 10 CECE CC[C@H]1CN(Cc2ccc(OC)cc2O)CCCO1 387524559 NNTKZSOJWVCIGZ-ZDUSSCGKSA-N 265.353 2.402 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CCCC2(F)F)cc1 390470637 BKZRGOIUOXLWQZ-LLVKDONJSA-N 268.307 2.363 10 10 CECE CC(F)(F)CC(=O)Nc1ccnn1-c1ccc(N)cc1 393330165 VKJNBBBIYQOELW-UHFFFAOYSA-N 280.278 2.438 10 10 CECE CCN1CCc2cc([C@H]3NCCC[C@@H]3C(=O)O)ccc21 2176732245 YTUFLQQXVHTWSO-DZGCQCFKSA-N 274.364 2.194 10 10 CECE C[C@@H](CCCCO)NCc1ccc2c(c1)CCN2C 398439351 AAFPWIVCFLXKRA-ZDUSSCGKSA-N 262.397 2.320 10 10 CECE CCNCc1ccc(N2C[C@@H](C)C[C@@H](CO)C2)cc1 398765739 AQNAUWYMKCGYTF-DZGCQCFKSA-N 262.397 2.251 10 10 CECE CCN[C@H](C)c1ccc(N(C)CC[S@@](C)=O)c(F)c1 399025329 OFOALMNNWOACKI-NSPYISDASA-N 286.416 2.311 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](CO)CC(C)(C)C2)cc1O 2172584999 IFUQUCNNJIIBRZ-NEPJUHHUSA-N 278.396 2.257 10 10 CECE CCNCc1ccc(N2C[C@@H](O)[C@H](CC)C2)cc1C 399974352 SNZFIRIBDAPVHE-CZUORRHYSA-N 262.397 2.312 10 10 CECE CCCOc1cc(N2C[C@H](O)C3(CCC3)C2)ccc1N 2165086284 ACTCNVCWJYFLTH-HNNXBMFYSA-N 276.380 2.409 10 10 CECE CN(Cc1cc(Cl)ccc1O)[C@@H]1CO[C@]2(CCOC2)C1 2179004894 JKCVXECYMSGYLN-DZGCQCFKSA-N 297.782 2.425 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCCC[C@@H](C(=O)O)C1 2179012428 FIDVSHMFFWJVRA-GHMZBOCLSA-N 279.336 2.346 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@H](O)C2CCCC2)cc1O 2167596811 ZCPAEBRMEWKZKE-BZNIZROVSA-N 278.396 2.399 10 10 CECE COc1ccc(Cn2nccc2Br)c(O)c1 2069914197 JKKNLULJEVBZAJ-UHFFFAOYSA-N 283.125 2.408 10 10 CECE CCc1cc(N)n(Cc2cc(Cl)ccc2O)n1 2070097467 OMUUIHFPCPDZJF-UHFFFAOYSA-N 251.717 2.435 10 10 CECE OCc1cc(F)c(N2CC[C@@H](O)CC23CCC3)c(F)c1 2169899824 ZBMYFLHPDNZYTP-LLVKDONJSA-N 283.318 2.341 10 10 CECE CCN(Cc1cnn(C)c1)c1ccc([C@@H](C)N)c(O)c1 2169972479 QCKJYICMXXEXCY-LLVKDONJSA-N 274.368 2.172 10 10 CECE C[C@@H](c1ccccc1O)N(C)Cc1cccnc1CN 2192596656 VFIMOMRNWZEHNX-LBPRGKRZSA-N 271.364 2.439 10 10 CECE CN1CCc2cc([C@]3(O)CCN[C@H]3C(C)(C)C)ccc21 2188133048 OLFVHPOYEBMXMP-DOTOQJQBSA-N 274.408 2.275 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@H](C)c2nnc(CO)s2)c1 2192612008 VPXPUJOYSHUVJT-VHSXEESVSA-N 293.392 2.456 10 10 CECE CN([C@H]1CCc2cccc(O)c21)[C@@H]1CCN2CC[C@H]1C2 2192728416 DNARNXCHXILGOX-ZNMIVQPWSA-N 272.392 2.406 10 10 CECE CCN(CCO)Cc1cc(-c2ccccn2)ccc1O 12156497 GYDLIBHABZEDDY-UHFFFAOYSA-N 272.348 2.268 10 10 CECE CN1CCc2cc([C@H](O)C(=O)[C@@H]3CC3(C)C)ccc21 2094755507 GBCOVFXPVNWKCI-JSGCOSHPSA-N 259.349 2.328 10 10 CECE CC1(C)CN(CCN2CCC[C@H](CN=[N+]=[N-])C2)C(=O)O1 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254.334 2.110 10 10 CECE COc1ccc(N2CC[C@H]([C@@H](C)N)C2)c(F)c1F 2081862073 KNHMVJPCAUEXNF-BDAKNGLRSA-N 256.296 2.147 10 10 CECE CCC[C@H](C(=O)O)N(C)[C@@H](C)c1c(O)cccc1O 2102204073 YDMNJEKNPIRZQD-VHSXEESVSA-N 267.325 2.344 10 10 CECE C[C@H](Cc1cnn(C)c1)NCc1c(O)cccc1Cl 2103586215 SEIVGFYWYUXBNB-SNVBAGLBSA-N 279.771 2.500 10 10 CECE Cc1nccn1CCN(C)c1ccc(CO)c(Cl)c1 2103642256 USFRYDXZNKRNMA-UHFFFAOYSA-N 279.771 2.474 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCN2CCC(F)(F)C2)C1 2103803311 MCDYATJKPOLCKF-LLVKDONJSA-N 273.331 2.350 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1ncoc1C1CC1 2104139475 QBFYTSPQMIYAJA-SECBINFHSA-N 261.285 2.467 10 10 CECE C[C@H]1C[C@@H](C)NCCN1Cc1ccc(F)cc1O 2084072403 TZZCJVHHOCVSRL-MNOVXSKESA-N 252.333 2.104 10 10 CECE C[C@H](N)[C@H]1CCCN(Cc2ccc(F)cc2O)C1 2084081167 YFQQVOCAGHXNQJ-QWRGUYRKSA-N 252.333 2.091 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@H]2C[C@H]1CN(C)C2 2104355834 SGQNUYYPLFEMME-GVXVVHGQSA-N 264.344 2.228 10 10 CECE COc1cccc(O)c1CN(C)[C@H]1CCC[C@@H](N)C1 2104442057 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C[C@H](CCNCc1ccc(O)c(O)c1O)C(F)(F)F 2110278955 LRCHRFRPNWZVKI-SSDOTTSWSA-N 279.258 2.482 10 10 CECE Nc1ccc(CN[C@@H]2CCC[C@@H]2n2ccnc2)cc1 2092531054 FGEIWNOBECLBRF-CABCVRRESA-N 256.353 2.349 10 10 CECE CCN[C@@H](c1nc(C)cc(C)n1)c1ccccc1O 2093558542 OXDNCCWMQURRMN-CQSZACIVSA-N 257.337 2.498 10 10 CECE Oc1ccc(F)cc1CN1CCN2CCCC[C@H]1C2 2097975048 MTGZLVDQPYSSJA-AWEZNQCLSA-N 264.344 2.201 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C[C@@H](O)C(F)(F)F 2099394712 IJBKJPDZDWNPDY-GFCCVEGCSA-N 276.302 2.402 10 10 CECE C[C@H](N)c1ccc(N2CC[C@]3(C[C@H](O)CO3)C2)c(Cl)c1 2201763314 NAWHDPXRFAREHA-WBIUFABUSA-N 296.798 2.090 10 10 CECE CO[C@@H]1CCN(Cc2cccc(C)c2O)C[C@@]1(C)OC 2201486477 NDTTVGVKLOXZAZ-GDBMZVCRSA-N 279.380 2.326 10 10 CECE C[C@@H](c1c(O)cccc1O)N1C[C@H]2CCC[C@@]1(CN)C2 2200717891 FMKMTDFNLYNKGR-MKBNYLNASA-N 276.380 2.362 10 10 CECE Oc1ccc(CCNCC23CCC(CC2)OC3)cc1O 2203702511 MMAOELIWPWKUJK-UHFFFAOYSA-N 277.364 2.189 10 10 CECE COc1cc(N2CCCC23CCOCC3)ccc1CO 2204549360 ITOUVBUGGMAFEA-UHFFFAOYSA-N 277.364 2.337 10 10 CECE CNCc1ccc(N2CCC[C@]2(C)COC)cc1OC 2204684598 KWAFANJDFAFGJT-MRXNPFEDSA-N 278.396 2.420 10 10 CECE CC(C)NCc1ccc(N2Cc3cncnc3C2)cc1 2206211388 XCECSYLIPCMRCB-UHFFFAOYSA-N 268.364 2.495 10 10 CECE CC[C@@H](O)c1ccc(N2CC[C@H](OCCCO)C2)cc1 2207041303 TUJFBESQQCWWEA-JKSUJKDBSA-N 279.380 2.108 10 10 CECE CN(Cc1ccc(N)cc1)c1cncc(F)c1C(=O)O 2207189744 QUOLORXVDGVKDW-UHFFFAOYSA-N 275.283 2.138 10 10 CECE O=C(O)C[C@@]12CC[C@@H]1CN(Cc1cc(F)ccc1O)C2 2207533268 FONDOAZVSRZYQD-IAQYHMDHSA-N 279.311 2.218 10 10 CECE COc1ccc(N2[C@H]3CCC[C@H]2CNC3)cc1F 2219169122 QESMVCBCMDMCOM-RYUDHWBXSA-N 250.317 2.165 10 10 CECE CC1(C)[C@H](O)CN1c1ccc(OCC(F)F)cc1 2219557251 BDHAAHPZUKMRAC-LLVKDONJSA-N 257.280 2.290 10 10 CECE COc1ccc(N2CCCC[C@H](O)C2)c(OC)c1 2219647958 UWSUUAVOZQTFBP-NSHDSACASA-N 251.326 2.055 10 10 CECE C[C@@H](CCN(C)C)N(C)c1ccc2c(c1)CC[C@H]2N 2272992292 FZECJOZSVLGBLR-BLLLJJGKSA-N 261.413 2.409 10 10 CECE Cc1cccc(O)c1CN[C@H](C(F)F)[C@@H]1CCOC1 2231048875 OGFBUTMZIRNXJR-MFKMUULPSA-N 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10 10 CECE CNCc1ccc(N2C[C@@H](O)C2(C)C)cc1C(F)(F)F 2201310805 JCMYJWKPOCYQBO-GFCCVEGCSA-N 288.313 2.384 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CCCCN2CCCC2=O)C1 2113416435 ZOBMDHQFDRVSNB-GFCCVEGCSA-N 265.361 2.164 10 10 CECE NCc1ccc(N2CCC[C@@H]3COCC[C@@H]32)c(F)c1 2113901027 JAQGMTNPXXPXGV-OCCSQVGLSA-N 264.344 2.290 10 10 CECE Cc1cc(N2C(=O)[C@H]3[C@@H](CC3(C)C)C2=O)ccc1N 2114436163 TWHCSTKDJBEACC-ZYHUDNBSSA-N 258.321 2.113 10 10 CECE COc1cc(N(C)C[C@@H](O)C2CCCC2)ccc1CO 2204535295 GAJSMSFRYJUOCI-OAHLLOKOSA-N 279.380 2.175 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2CC(C)(C)CCN2)c1O 2204622232 KNZIVIMSOBSCFF-ZDUSSCGKSA-N 276.380 2.095 10 10 CECE CCOc1cccc(CN[C@@H]2CC3(CCC3)[C@@H]2O)c1O 2205606280 NLLRDZWQWNJWRM-IUODEOHRSA-N 277.364 2.184 10 10 CECE Cc1cc(CN)ccc1N1CCc2ccnc(O)c2C1 2206106127 IZFXAXMOIDLDHN-UHFFFAOYSA-N 269.348 2.117 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@H]2C[C@H](N)CC[C@H]2C1 2206175731 TVNRTXWNLLSXGO-YVECIDJPSA-N 276.380 2.218 10 10 CECE Oc1cc(-c2nc(C[C@@H]3CC34CC4)no2)cc(O)c1O 2207603829 CRLFKYAIDQMUFA-MRVPVSSYSA-N 274.276 2.196 10 10 CECE Cc1nn(C)c([C@H](N)c2ccccc2O)c1Cl 2217391871 HCWFJJGMRNVQDP-LLVKDONJSA-N 251.717 2.136 10 10 CECE CSc1ncc(CN=c2[nH]c3cnccc3n2C)s1 2208640465 KUOBSBZQBQMWTO-UHFFFAOYSA-N 291.405 2.181 10 10 CECE COc1ccc(N2CCC[C@@H]2[C@@H](C)O)cc1OC 2219642455 FQQFLGNESSFBOX-ZYHUDNBSSA-N 251.326 2.053 10 10 CECE C[C@@H]1CCC[C@H](C(=O)N2CC[C@H](CN=[N+]=[N-])C2)O1 2219725914 CBGQEZAKHHTKSL-GMTAPVOTSA-N 252.318 2.103 10 10 CECE CCN1CCc2cc([C@@H](O)CNC3CCC3)ccc21 2272422623 CJLGAYAWANKLMY-INIZCTEOSA-N 260.381 2.245 10 10 CECE OCc1ccc(N2C[C@H](O)CCC23CC3)cc1Cl 2220281403 ZMKQOGLXYYCRQL-GFCCVEGCSA-N 267.756 2.326 10 10 CECE Cc1cc(CNC2CCC2)ccc1OCC[S@@](C)=O 2231562660 ISBZPFGYPKXSJG-LJQANCHMSA-N 281.421 2.394 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)Cc1ccnn1C 2232099637 BQBASNFZPGUSJL-GFCCVEGCSA-N 258.369 2.385 10 10 CECE C[C@@H]1CN(c2ccc(CO)c(Cl)c2)[C@H](C)CN1C 2222181769 RTJHQCFEQZHBSU-GHMZBOCLSA-N 268.788 2.361 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1ccn2nccc2c1 2234175640 DTBLKMXDLFPOPF-RYUDHWBXSA-N 270.296 2.296 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCN1CCCO1 2234117918 HGAUKZVIFRFMPD-QWHCGFSZSA-N 276.380 2.476 10 10 CECE CCN1CCc2cc(N3C[C@H](O)CC4(CC4)C3)ccc21 2235038376 YVHFPUKDXUGKOR-OAHLLOKOSA-N 272.392 2.420 10 10 CECE COc1ccc(N2C[C@H](O)C[C@]2(C)CO)cc1C(C)C 2235142407 DHVYVBIXRZKNLQ-CZUORRHYSA-N 279.380 2.141 10 10 CECE COC[C@@H]1CC[C@@H](N(C)c2ccc(OC)cc2CN)C1 2235973961 VFIIVBLDEKTZLM-TZMCWYRMSA-N 278.396 2.405 10 10 CECE COc1ccc(N2C[C@@H](OC)C(C)(C)C2)c(CCN)c1 2235977743 VGTJAHPYDBWOAS-OAHLLOKOSA-N 278.396 2.058 10 10 CECE Cc1cccc(S(=O)(=O)Nc2ccc(O)c(N)c2)c1F 2236147484 QHAIIKRKVIITIQ-UHFFFAOYSA-N 296.323 2.223 10 10 CECE CC1(NS(=O)(=O)Cc2ccc(N)cc2)CC2(CCC2)C1 2236488781 QEWZKEZPFSFAJV-UHFFFAOYSA-N 294.420 2.411 10 10 CECE Nc1ccc(N2CCN(CC(F)(F)C(F)F)C2=O)cc1 2236806857 AJWQTQXTNRFYSR-UHFFFAOYSA-N 291.248 2.411 10 10 CECE CN(C[C@H]1C[C@@H](O)C1)c1ccc2c(c1)OCCCO2 2226817108 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C[C@H](N)c1cnc(SC[C@@H]2NCC[C@H]2C)s1 2245110956 YNGHUAQRPZVFDX-VGMNWLOBSA-N 257.428 2.253 10 10 CECE CSc1ncc(CNC2CC(O)(C(F)(F)F)C2)s1 2257100563 CPGIOAACXQBWDM-UHFFFAOYSA-N 298.355 2.410 10 10 CECE Cc1cc(N(C)[C@@H](C)C[S@@](C)=O)ccc1[C@H](C)N 2257516120 KKMXJQSJTQESGT-OAVHHTNSSA-N 268.426 2.218 10 10 CECE COc1cscc1[C@H](O)[C@@H](N)c1ccccc1O 2258919560 XYXHUERQJTXHSC-STQMWFEESA-N 265.334 2.196 10 10 CECE CC1(C)CC(S(=O)(=O)CCc2ccc(N)cc2)C1 2260449051 PLWAHOABKVVHTM-UHFFFAOYSA-N 267.394 2.415 10 10 CECE COc1cc(OC)c(N2CCCC23CNC3)cc1Cl 2270410998 OBQFKHAGBOBYTJ-UHFFFAOYSA-N 282.771 2.299 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2ccnnc2)c(F)c1 2274308159 OXJOIUPNNRMHCJ-SNVBAGLBSA-N 260.316 2.272 10 10 CECE CCNCc1ccc(N2CC[C@]3(O)C[C@H]3C2)c(C)c1 2265248581 FKVZYHWYIXLBSA-HOCLYGCPSA-N 260.381 2.066 10 10 CECE COc1ccc(N2CCC[C@H]2[C@@H](C)O)c(OC)c1C 2277992596 IJOCVIMSHBEZHT-NEPJUHHUSA-N 265.353 2.362 10 10 CECE CSc1ncc(CNC(=O)C[C@H]2CC3(CC3)CN2)s1 2269195012 CUVUHYGYAKBVLO-VIFPVBQESA-N 297.449 2.013 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N[C@@H](c1ccccc1O)[C@]1(O)C[C@@H]2C[C@H]1CC2(F)F 2329122720 GMTMKTGEMTXCLC-VDUILEQBSA-N 269.291 2.188 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2C[C@@H]2CC(=O)O)c1 2335886417 JCVNGAMYOHGMJY-TUAOUCFPSA-N 263.337 2.462 10 10 CECE C[C@H](NC[C@H]1COCC1(C)C)c1ccc(O)cc1O 2336146049 SEGQWIMYCKSYTG-QWRGUYRKSA-N 265.353 2.421 10 10 CECE c1cc2c(cc1N1CC[C@H]3CCCN[C@H]3C1)CCO2 2336191884 QMRMTCUJCHYGBV-DOMZBBRYSA-N 258.365 2.200 10 10 CECE O[C@H]1CCCc2cc(N3CCOC[C@@H](F)C3)ccc21 2336673851 NFELDXBBJNJMRL-WFASDCNBSA-N 265.328 2.231 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@@H]3C[C@@]3(CO)C2)c1C 2340852064 WMBURXPVAQDIKW-WWGRRREGSA-N 261.365 2.175 10 10 CECE CSc1cc(N2C[C@H]3CC[C@H]2[C@H](O)C3)ccc1CN 2353854768 ZDAXYUAIEJLLMY-LEWSCRJBSA-N 278.421 2.217 10 10 CECE CSc1cc(N2C[C@@H]3CC(O)C[C@H]3C2)ccc1CN 2353859125 XOCUYAGBYJXFHQ-RYUDHWBXSA-N 278.421 2.074 10 10 CECE CSc1cc(N(C)CCN2CCCC2)ccc1CN 2353859228 ZOHWUJPXAFOHDY-UHFFFAOYSA-N 279.453 2.399 10 10 CECE COc1ccc(O)c(CN[C@H]2C[C@@H]3C[C@H]2C[C@@H]3OC)c1 2354394228 DWTAAUGJNRBHNO-KHJVZFFJSA-N 277.364 2.304 10 10 CECE Cc1cc(N(C)C[C@@]23COC[C@@H]2C3)ccc1C[C@H](C)N 2354588456 JFHFSEPDIDPEET-QRTARXTBSA-N 274.408 2.357 10 10 CECE N[C@H](Cc1ccc(O)c(O)c1)C(=O)OCC1CCCCC1 52145578 GOBSAGFPWBHLGP-CYBMUJFWSA-N 293.363 2.091 10 10 CECE Nc1ccc(OC[C@H](O)CSc2nccs2)cc1 51328553 COVKGJDJVNCEIG-JTQLQIEISA-N 282.390 2.257 10 10 CECE C[C@H](N[C@@H]1CCCC[C@@H]1O)c1ccc(O)cc1O 51991498 IQFDKVZZBPOZRR-BIMULSAOSA-N 251.326 2.052 10 10 CECE NCc1ccc(N2CCN(c3ccccn3)CC2)c(F)c1 20469664 XSTALZUROAPSIW-UHFFFAOYSA-N 286.354 2.006 10 10 CECE CC[C@H]1C(=O)NCCN1c1ccc(CNC(C)C)cc1C 110682994 HYEKGBJSNIUNLU-HNNXBMFYSA-N 289.423 2.208 10 10 CECE COc1ccc(N2CCC[C@H]2C[C@H](C)O)c(N)c1 302609478 KRLNAMKRUXDWAK-QWRGUYRKSA-N 250.342 2.017 10 10 CECE COc1ccc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)cc1 32968151 WHLUFVFFGSLISI-PPDFBGJRSA-N 283.287 2.146 10 10 CECE CN1CCCc2c1cc(Br)c(O)c2O 218286743 YWWXIRORCSNNPE-UHFFFAOYSA-N 258.115 2.243 10 10 CECE C[C@H]([C@@H](O)c1ccc(O)c(O)c1)N(C)C(=O)OC(C)(C)C 212266945 MIONJNDPQYDTOL-NOZJJQNGSA-N 297.351 2.387 10 10 CECE CC[C@@H](C)S(=O)(=O)CCCOc1ccc(N)cc1 35058181 KCBMAELBIBVKRB-LLVKDONJSA-N 271.382 2.251 10 10 CECE COCCCN(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 213387328 MKSIWVSPMFOJFM-ALCCZGGFSA-N 294.307 2.165 10 10 CECE COC(=O)[C@@]1(C)CCCN1Cc1cccc(C)c1O 189985272 MYSLSIOSTRRLSI-OAHLLOKOSA-N 263.337 2.228 10 10 CECE CC[C@@]1(C(=O)O)CCCN1c1ccc(OC)cc1[N+](=O)[O-] 213876242 RCKIWLZCYWXMPM-AWEZNQCLSA-N 294.307 2.437 10 10 CECE Oc1c(F)cccc1CNCCc1cscn1 158769767 CVFDDNIRNUZVEO-UHFFFAOYSA-N 252.314 2.320 10 10 CECE Cc1nn(C)cc1NCc1ccc(N2CCOCC2)cc1 189567665 RRWHVTROGPSDCE-UHFFFAOYSA-N 286.379 2.177 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CC[C@H](N(C)C)C1 134175658 QEOVOCWGNDKNKV-JQWIXIFHSA-N 252.333 2.228 10 10 CECE CC[C@@H](C)N(CCO)c1ccc([C@H](C)N)c(O)c1 380588464 CPMJZTRZARLTIL-MNOVXSKESA-N 252.358 2.009 10 10 CECE C[C@@H]1COCC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 194180490 XZICDHUIXSENOE-DGCLKSJQSA-N 294.370 2.181 10 10 CECE COc1cc(Cl)cc(CNCC2(O)CCCC2)c1O 228674258 STHWWNBLHZRGAO-UHFFFAOYSA-N 285.771 2.449 10 10 CECE C[C@H](NCC1(O)CCCC1)c1ccc(O)cc1O 87016133 BGMGUMRDZIOVBF-JTQLQIEISA-N 251.326 2.054 10 10 CECE Cc1c([N+](=O)[O-])cc([C@@H](C)N)c(O)c1Br 238424125 PVGUYYXMHSAOMA-RXMQYKEDSA-N 275.102 2.391 10 10 CECE N[C@@H](CC(=O)O)c1ccc(Cl)c(Cl)c1O 238643111 YNTGNWFUWYQKJE-LURJTMIESA-N 250.081 2.174 10 10 CECE CC(C)N[C@@]1(C(N)=O)CCC[C@@H](Sc2nccs2)C1 93778711 YRQFOFVQXNMTSE-MFKMUULPSA-N 299.465 2.400 10 10 CECE C[C@@H](Cc1c(F)cc(O)c(O)c1Br)C(=O)O 258419925 CZMBEGNFJOPFKB-BYPYZUCNSA-N 293.088 2.263 10 10 CECE COc1cnn(Cc2ccccc2O)c1Br 258535900 NUQCXRNKDDIFIL-UHFFFAOYSA-N 283.125 2.408 10 10 CECE CC(=O)c1ccc(O)c(CN2CCC[C@@H]3COC[C@H]32)c1 700725510 PREAUWIVSPLBBM-UKRRQHHQSA-N 275.348 2.206 10 10 CECE Cc1cc(Br)cc(CN(C)CCCO)c1O 281808537 PYFVQDWGFCJETH-UHFFFAOYSA-N 288.185 2.277 10 10 CECE CNCc1ccc(N2CC(C(=O)NC(C)C)C2)cc1Cl 2168054816 IFCAKHMYEKNTPH-UHFFFAOYSA-N 295.814 2.020 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3C[C@H]4CC[C@H]3N4)ccc21 2163072308 XDFWLYJDDMAIFA-DLTWYDFYSA-N 272.392 2.243 10 10 CECE C[C@@H]1[C@@H]2OCC[C@H]2[C@@]1(O)c1ccc2c(c1)CCCN2C 2163108100 RHUGSZSMFQLRGW-OFIKQIQMSA-N 273.376 2.311 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@H](O)c1ccns1 2163136416 SMDKGEBAPULSHL-LSDHHAIUSA-N 289.404 2.130 10 10 CECE Cc1cc(O)nc(CCN[C@H](C)c2ccccc2O)n1 2163207696 HVWNAJUJZODXIJ-LLVKDONJSA-N 273.336 2.090 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](C)Oc1cc(C)ccc1Cl 808506768 QURFEYVYYLJUDB-SNVBAGLBSA-N 298.722 2.117 10 10 CECE CO[C@H]1C[C@H](N(C)c2ccc(CO)c(Cl)c2)C[C@H]1OC 2166101603 GXXKAWRIBHJEMY-XMQYKBBCSA-N 299.798 2.461 10 10 CECE CN1CCCc2cc(N3C[C@@H]4CCNC[C@@H]4C3)ccc21 2168793140 VPJXPWPLITXVPE-LSDHHAIUSA-N 271.408 2.115 10 10 CECE CN(c1ccc2c(c1)CCC(C)(C)O2)[C@H]1[C@@H]2CNC[C@@H]21 2166548145 XPBPDIVRCAIMLH-FOLVSLTJSA-N 272.392 2.444 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2C[C@]2(C(=O)O)C1)c1ccc(O)cc1O 712958245 MOSFSNCVSHBCQA-FHTCGPRVSA-N 277.320 2.002 10 10 CECE Cc1ccc2c(c1)/C(=C/c1cncnc1)C(=O)N2C 811699138 QTDNFSJTXPBDLA-MLPAPPSSSA-N 251.289 2.302 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@@H]2CCCN3C)c(F)c1 720444314 IJTKAEDIAKQWRS-CVEARBPZSA-N 277.387 2.218 10 10 CECE C[C@H]1C[C@H](CNCc2ccc(O)c(O)c2)C[C@@H](C)O1 724293598 XSHOLSIHYPTEQV-PTEHBNRSSA-N 265.353 2.391 10 10 CECE CN(C)c1ccc(CNC(=O)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1F 824265688 LYOQTENJLNVCGE-CLLJXQQHSA-N 291.370 2.489 10 10 CECE NCc1ccc2c(c1)CCN2C[C@@H]1CC2(CC2)CO1 2133393554 GOKFCKGPWZAICZ-AWEZNQCLSA-N 258.365 2.077 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3OCC[C@@H]3C2)c(F)c1 724796458 IUTSOTPIDGHTDS-JVLSTEMRSA-N 264.344 2.461 10 10 CECE Oc1cccc(CNC[C@@H]2CC[C@H](C(F)(F)F)O2)c1O 722398186 KSQFOWKKXDVERK-GXSJLCMTSA-N 291.269 2.297 10 10 CECE C[C@@H](F)CN1CCN(Cc2cc(F)ccc2O)CC1 2133457601 PAINUVNKNGISPO-LLVKDONJSA-N 270.323 2.007 10 10 CECE CO[C@@]1(CNC/C=C\c2ccc(N(C)C)cc2)CCOC1 835047647 STHSDGXBXUDTRU-VGOKWCNXSA-N 290.407 2.161 10 10 CECE O=C(c1cc(O)cs1)N1CCC(c2ncc[nH]2)CC1 732279007 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CCC(F)(F)CN1C(=O)CN(Cc2ccccc2O)C1=O 863527491 ZITVMEHGZVFIPB-UHFFFAOYSA-N 298.289 2.202 10 10 CECE COc1cc([C@@H](N)CO)c(Cl)cc1N1CCCCC1 72199649 WHHCQTRNJRXBKG-LBPRGKRZSA-N 284.787 2.331 10 10 CECE CC(C)OCCCC(=O)N1Cc2cccc(O)c2C1 871204609 MJHZFNKXXNYTBS-UHFFFAOYSA-N 263.337 2.440 10 10 CECE O=C(NC/C=C\C1CC1)NCc1c(O)cccc1F 1119683923 VTLYKPWZSVQSTR-IHWYPQMZSA-N 264.300 2.297 10 10 CECE C[C@](F)(CNC(=O)c1ccc(O)c(O)c1)C(F)(F)F 1876637615 IMDQEONHLMVZRJ-JTQLQIEISA-N 281.205 2.118 10 10 CECE COc1ccc(N(C)CCOCCNC2CCC2)cc1 2202699511 CFZUMSNNKWMGDG-UHFFFAOYSA-N 278.396 2.290 10 10 CECE CN(Cc1ccccc1O)C[C@H]1CCC(F)(F)C1=O 1877529134 NJVWCFUNRLODTE-LLVKDONJSA-N 269.291 2.438 10 10 CECE CCN(CC)c1ccc(CN2C[C@@H]3C[C@@]3(O)C2)cc1 895646667 HSZSRCYAYVIJLF-GOEBONIOSA-N 260.381 2.099 10 10 CECE Cc1cc(C(F)F)n(CC(=O)NCc2ccccc2O)n1 1177005431 YMOWEWYQHMODLK-UHFFFAOYSA-N 295.289 2.151 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC3(COC3)C2)c(F)c1 1880930244 ZOHJTNLITWLQRL-VIFPVBQESA-N 268.307 2.211 10 10 CECE 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2.316 10 10 CECE N[C@@H](c1ccc(Cl)c(Cl)c1O)[C@@H](O)C1CC1 713741755 GVGUXOYRWXYHLN-UWVGGRQHSA-N 262.136 2.470 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@@]2(C)CO)c(F)c1 722976913 FVPMHLJFUIJFRE-NHYWBVRUSA-N 266.360 2.457 10 10 CECE C[C@H](O)C(C)(C)NCc1ccc2c(c1)CCCN2C 144882832 MKGJZKLXCYNQIB-LBPRGKRZSA-N 262.397 2.318 10 10 CECE C[C@@H](CN1CCOCC1)Cn1ccc2cc(N)ccc21 720006685 KYOAJZHHODZTRL-ZDUSSCGKSA-N 273.380 2.192 10 10 CECE CCOC(=O)C(F)(F)[C@@H](N)c1cc(C)cc(F)c1O 725274877 VSPULWIVRWMJJN-JTQLQIEISA-N 277.242 2.038 10 10 CECE O=C(/C=C\c1cnccn1)N1CCOc2cc(F)ccc21 491841074 BGPKYAICCQTRSQ-RQOWECAXSA-N 285.278 2.055 10 10 CECE Cc1cccc(CN2CCN(C[C@@H](C)F)CC2)c1O 2133461669 YEZCEHXIBMDNJT-CYBMUJFWSA-N 266.360 2.176 10 10 CECE CO[C@@](C)(CO)CN[C@@H](C)c1cc2c(cc1O)CCCC2 848559291 RUNKTUCNEJLCAK-YVEFUNNKSA-N 293.407 2.319 10 10 CECE CN(C)CC[C@H]1CCCN1c1c(F)cc(CN)cc1F 700977632 UISITUZDJAEOLO-GFCCVEGCSA-N 283.366 2.344 10 10 CECE CCC1(NC(=O)NCCc2ccc(N)cc2)CCC1 841959085 UHLOBRSPGYYJJA-UHFFFAOYSA-N 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281.352 2.311 10 10 CECE C[C@@H]1CC[C@@](C)(NC(=O)COc2ccc(N)cc2)C1 1878809270 XEOBBKDWIKAIBV-IAQYHMDHSA-N 262.353 2.343 10 10 CECE CN(Cc1ccccc1O)C(=O)Cc1ccc(F)cn1 798161687 BJMNGGJLJPZJEM-UHFFFAOYSA-N 274.295 2.127 10 10 CECE CCN[C@@H](C)c1cc(F)c(N(C)[C@H](C)CO)c(F)c1 1880929628 VUOHFUUQHMLHIF-ZJUUUORDSA-N 272.339 2.452 10 10 CECE C[C@@H]1CC[C@H](CN(C)c2c(F)cc(CN)cc2F)O1 1885281085 KZVKOPFRGQDBAD-MWLCHTKSSA-N 270.323 2.427 10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCCN=[N+]=[N-] 1885557682 SNYVPHLBDGAJLM-SECBINFHSA-N 299.375 2.352 10 10 CECE CC(C)(C)SCC(=O)NCc1cc(O)ccc1O 1303223264 HTUDJYKIIOULGI-UHFFFAOYSA-N 269.366 2.246 10 10 CECE O=C(CNCc1c(O)cccc1Cl)N1CCCCC1 134652564 ODRANUISFZAUCC-UHFFFAOYSA-N 282.771 2.148 10 10 CECE CC[C@H]1CN(CC(C)=O)c2cc(OC)c(OC)cc2N1 76929945 YNBWKTTZVRKWCS-NSHDSACASA-N 278.352 2.303 10 10 CECE Cc1cc(NS(=O)(=O)N(C)C(C)C)cc(C)c1O 1963014937 SRQGLLFVWQNDNK-UHFFFAOYSA-N 272.370 2.006 10 10 CECE CCCCN1C[C@H](C)Oc2ccc(N3CCNCC3)cc21 77008915 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COc1ccc(N(C)CCC[C@H](C)O)c(OC)c1 789350728 HEJFGWBDQNXTEY-NSHDSACASA-N 253.342 2.301 10 10 CECE CCCn1nncc1[C@@H](NC)c1ccc(N(C)C)cc1 97418936 GWJDQFDPSTUDOS-HNNXBMFYSA-N 273.384 2.063 10 10 CECE COc1ccc(CNC[C@@H](NC(C)=O)C2CC2)cc1C 1276528444 IRBCUBRNFJQSKE-OAHLLOKOSA-N 276.380 2.008 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](CO)C[C@@H]2C)cc1O 2115822197 YNXWFRMZVUYEJT-SDDRHHMPSA-N 264.369 2.009 10 10 CECE CCCc1ncc(C(=O)NCc2c(O)cccc2O)s1 1456233733 FNBXFVYFTFEYBV-UHFFFAOYSA-N 292.360 2.437 10 10 CECE C[C@H](c1cc(F)ccc1O)N1[C@H]2CC[C@H]1[C@@H](CN)C2 2117664146 UBOLCTGQHZMPLA-KLTVKPSUSA-N 264.344 2.404 10 10 CECE CNCc1ccc(N2C[C@H](O)CCC23CCC3)cc1 2117906056 ZAGJTKKFDWCPRO-OAHLLOKOSA-N 260.381 2.290 10 10 CECE [N-]=[N+]=NC1CCN(S(=O)(=O)[C@@H]2CCCC[C@H]2F)CC1 2118939528 LSFJCJUODGNUNW-GHMZBOCLSA-N 290.364 2.372 10 10 CECE CCN1CC(CN(C)c2cc(Cl)c(CN)cc2F)C1 2120882473 XNXCPQQJYGQQPU-UHFFFAOYSA-N 285.794 2.326 10 10 CECE COC(=O)c1ccc(OCc2ccc(N)cc2)nc1 2120849822 CCXYRJLFPOFNSV-UHFFFAOYSA-N 258.277 2.029 10 10 CECE CC1(C)CN(c2ccc3c(c2)OCO3)CC(C)(C)N1 11632897 DKUPRUQYXTVJSQ-UHFFFAOYSA-N 262.353 2.382 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2C[C@H](O)C(F)F 2121043006 LYHLELBTLSSBDE-RNCFNFMXSA-N 270.323 2.085 10 10 CECE CN(C)CCCCN(C)C(=O)Nc1ccc(N)cc1 2121437259 UDAHETMVYWLQBS-UHFFFAOYSA-N 264.373 2.074 10 10 CECE NCc1ccc(N2CC3(CO)CCC2CC3)c(F)c1 2122357731 AIJVQZFVBXIKOP-UHFFFAOYSA-N 264.344 2.026 10 10 CECE CCCCCNC(=O)[C@@H](C)N1CCC[C@H]1CN=[N+]=[N-] 2123019288 PTUCFWLHARLYTR-NEPJUHHUSA-N 267.377 2.456 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCC=CO2)c1 1630366664 VFCWCJZEIYJDRI-QMTHXVAHSA-N 277.320 2.271 10 10 CECE C[C@H](C(=O)NCc1cc(O)ccc1O)C(C)(F)F 1637126365 VGTYUTUNQJICOY-SSDOTTSWSA-N 259.252 2.005 10 10 CECE CO[C@@H]1[C@@H](N[C@H](C)c2ccccc2O)COC1(C)C 1911075273 RWQJMNZDUKSXHI-SCDSUCTJSA-N 265.353 2.235 10 10 CECE CCCNCc1ccc(N2CCN(C)[C@@H](C)C2)cc1 216582093 VWGGLUZKPJJSQE-AWEZNQCLSA-N 261.413 2.327 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)[C@]23CCCC[C@@H]2OCC3)C1 1912154853 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262.397 2.469 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@]3(F)CCCNC3)ccc21 2280433278 AUAVMHUZDWQEBK-HZPDHXFCSA-N 278.371 2.194 10 10 CECE Cc1cc(N2C[C@@H]3CN(C)C[C@@]3(C)C2)ccc1[C@H](C)N 2285135749 UJUZJXMNSQKTNF-ZQIUZPCESA-N 273.424 2.403 10 10 CECE COc1ccc(N2CCSC[C@@H]2CCO)c(OC)c1C 2295462139 ABSWPKSDMZATHP-LBPRGKRZSA-N 297.420 2.316 10 10 CECE O=C(C=Cc1cncc(F)c1)N1CCOc2ccncc21 2297806374 JKEBBIQULZFIJN-UHFFFAOYSA-N 285.278 2.055 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1C[C@@H]2CC[C@H]1O2 1179834995 ZFNKTTFFYXBVLJ-MVWJERBFSA-N 255.264 2.080 10 10 CECE N[C@](CO)(CSc1nccs1)[C@H]1CC12CCC2 2304499611 PLSFXXHLQWMOLF-JOYOIKCWSA-N 270.423 2.115 10 10 CECE CN(CC1CCC1)C(=O)C=Cc1ccc(O)c(O)c1 2307987091 CQBAKDTYARHTDR-UHFFFAOYSA-N 261.321 2.370 10 10 CECE C[C@@]1(N)CN(Cc2c(O)cccc2Cl)CC1(F)F 2315161811 RBUGMOQFUCLEQA-LLVKDONJSA-N 276.714 2.214 10 10 CECE Nc1cc(Cl)c(N2C(=O)[C@H]3CC[C@H]3C2=O)c(Cl)c1 2317917211 GYKJZBHVSOJXJO-KNVOCYPGSA-N 285.130 2.475 10 10 CECE CSc1cc(N2CCC[C@@H]2[C@@H](C)O)ccc1CN 2328540076 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2.379 10 10 CECE C[C@H]1CN(c2c(F)cc(CN)cc2F)[C@@H](C)CO1 218979312 HCZFOZYGMZUSLH-IUCAKERBSA-N 256.296 2.037 10 10 CECE NC1CCN(c2ccc(OCC(F)F)cc2F)CC1 87439444 BXYORXALYZHLOW-UHFFFAOYSA-N 274.286 2.397 10 10 CECE CC[S@](=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 130854285 XBMODZUKVDQZFR-KPZWWZAWSA-N 268.426 2.172 10 10 CECE CC1CCC(O)(CNCc2ccc(O)c(O)c2)CC1 87045051 NXAKCHAFOYJYTG-UHFFFAOYSA-N 265.353 2.129 10 10 CECE CCCCNC(=O)[C@H](C)OC(=O)CCc1ccc(N)cc1 41101793 URXFAYUZXJJDMD-LBPRGKRZSA-N 292.379 2.049 10 10 CECE CN1C[C@H](NCc2c(O)ccc3ccccc23)CCC1=O 84063170 VMEWLCBNAVUVLR-CYBMUJFWSA-N 284.359 2.256 10 10 CECE CC[C@H]1CN[C@@H](C)CN1c1ccc(OC)cc1OC 83479464 NRXGJZAEYCLOFS-RYUDHWBXSA-N 264.369 2.281 10 10 CECE COc1ccc([C@@H](C)NCCCCCO)c(O)c1 228734872 OCAIDXLEYCILCY-LLVKDONJSA-N 253.342 2.214 10 10 CECE CC[C@](C)(CCO)NCc1ccc(OC)cc1O 230222440 BKNSCZTYXLEBIU-CQSZACIVSA-N 253.342 2.042 10 10 CECE COCCN(CCO)c1ccc(OC2CCC2)cc1 2226533665 CDZNQHGTAOMRLA-UHFFFAOYSA-N 265.353 2.063 10 10 CECE COc1cccc(CN2CCS[C@@H]3COCC[C@H]32)c1O 246779274 QCXHNQYGNVSMGD-TZMCWYRMSA-N 295.404 2.107 10 10 CECE CC(C)(N)c1c(O)c(O)cc(F)c1Br 258454094 OJLXPEHXKPVHMA-UHFFFAOYSA-N 264.094 2.193 10 10 CECE COc1ccc(CN[C@@H]2CCc3nc[nH]c3C2)cc1C 377769271 AFVQYFPQSHGHCE-CYBMUJFWSA-N 271.364 2.374 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C[C@H]2C)c(C#N)c1 384774821 HUGJYYIDERNLJK-DOMZBBRYSA-N 273.380 2.017 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2cnn(C)c2)cc1O 93670870 VHJSMAJEYUTOMQ-LLVKDONJSA-N 274.368 2.043 10 10 CECE CC[C@H](NCc1cnn(C)n1)c1cc(Cl)ccc1O 806168679 WRQJDZJDRGSGAR-LBPRGKRZSA-N 280.759 2.415 10 10 CECE OCc1cc(F)c(N2CC[C@H]3OCC[C@@H]3C2)c(F)c1 724693516 PKYZTZUHWKDABV-ZWNOBZJWSA-N 269.291 2.072 10 10 CECE CN(c1ccc2c(c1)CCC(C)(C)O2)[C@H]1[C@@H]2CNC[C@@H]21 2166550401 XPBPDIVRCAIMLH-FOLVSLTJSA-N 272.392 2.444 10 10 CECE CC(=O)c1cc(Cl)cc(CN2C[C@H]3CC[C@H]2CN3)c1O 817880237 NLWUTGYQUQWFGM-OLZOCXBDSA-N 294.782 2.184 10 10 CECE Oc1ccc(CN[C@H](C2CC2)[C@H]2CCCOC2)c(O)c1 724006834 GSFIZJJFCWWEDA-XJKSGUPXSA-N 277.364 2.393 10 10 CECE CN(C)c1ccccc1N(C)C(=O)/C=C/c1cnccn1 492201910 DDLNZJFVLATWMB-CMDGGOBGSA-N 282.347 2.219 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC[C@@H](CCN)C1 723695183 LBRSOFMXUIALMN-ZIAGYGMSSA-N 261.413 2.484 10 10 CECE CCc1nc(=NCc2cnc(SC)s2)s[nH]1 2243789798 IZDRMORLZLQULG-UHFFFAOYSA-N 272.424 2.313 10 10 CECE Cc1cc(O)c(CN2CC[C@H](C)C[C@@H]2C(N)=O)c(Cl)c1 840939259 LRCYKKIQUVKECI-TVQRCGJNSA-N 296.798 2.440 10 10 CECE C[C@H]1CCn2ncc(C(=O)N(C)Cc3ccccc3O)c2C1 843819693 FTPOVHHOGAUVGA-LBPRGKRZSA-N 299.374 2.443 10 10 CECE Cc1cc(O)c(CNCCc2cnccn2)c(Cl)c1 840908514 SBSJTWILYWLYGM-UHFFFAOYSA-N 277.755 2.476 10 10 CECE Cc1cc(O)c(CNC[C@@H]2C[C@H](F)CN2)c(Cl)c1 841079217 NFXITQGKAOADLW-UWVGGRQHSA-N 272.751 2.144 10 10 CECE COc1cccc([C@H](C)N[C@H]2CCc3nc[nH]c3C2)c1O 846168449 CTWQEYUAUZGJIG-QWRGUYRKSA-N 287.363 2.332 10 10 CECE CCOc1ccc(N(C)CCO[C@H]2CCOC2)cc1 929694513 BCUVPAXZLAMTNY-HNNXBMFYSA-N 265.353 2.327 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@@H](O)C23CCC3)cc1 850388275 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10 10 CECE CCN1CCc2cc(N3C[C@@H]4C[C@H](C3)[C@@]4(C)O)ccc21 2286199260 HVIMIWFQCJJOAK-XOIINTDNSA-N 272.392 2.276 10 10 CECE CN[C@@H](c1ccccc1O)[C@@H](O)c1nc(C)ccc1F 2287013256 UKQOTDBGXSWURP-DZGCQCFKSA-N 276.311 2.229 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)[C@H]1C(F)(F)C12CC2 2312334280 QTTKVRCENMIDRU-GJMOJQLCSA-N 256.256 2.379 10 10 CECE C[C@@]1(N)CN(c2ccc(OCF)cc2)CC1(F)F 2315275678 DWQUKFYGMCBQLA-LLVKDONJSA-N 260.259 2.165 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1[C@H](C)O[C@H](C)[C@H]1C 2315986141 ATDJQQARIMYNHP-ZNSHCXBVSA-N 254.334 2.205 10 10 CECE CN[C@@H](C[C@@H]1C[C@H]1C)[C@@H](O)c1ccc(N(C)C)cc1 2331908116 RXLCOWGUHNNQLN-XTBFLFJDSA-N 262.397 2.420 10 10 CECE COc1ccc(N2CC[C@H]3[C@H](OC)C[C@H]32)c(C=O)c1 2333715938 QHIXZRTXWXLHJA-BPLDGKMQSA-N 261.321 2.121 10 10 CECE CC[C@]1(C)NCC[C@@H]1NCc1ccc(N(C)C)cc1 2336814074 UKFVZEORXUECAV-HOTGVXAUSA-N 261.413 2.373 10 10 CECE CN(C)[C@@H]1CCN(c2ccc(CO)c(C3CC3)c2)C1 2339145768 LUUCPTXGHFDCIN-OAHLLOKOSA-N 260.381 2.197 10 10 CECE CNCc1ccc(N(C)C(C)(C)CO)cc1C1CC1 2339162907 CZDPOJPDUSQQEY-UHFFFAOYSA-N 262.397 2.491 10 10 CECE CO[C@@H]1C[C@H]2C[C@H]1CN2c1ccc2c(c1)CC[C@H]2O 2340740269 PDFRLNIVBWAAEL-KSZJFAHPSA-N 259.349 2.280 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@H]3C[C@H]2C[C@H]3O)c1C 2340856251 KDFNVBCTDKIGSR-NFFDBFGFSA-N 261.365 2.316 10 10 CECE CN[C@H](C)c1cc(F)c(N(C)C[C@@H]2CCO2)c(F)c1 2341215021 SLWWRLBLUYDNFT-KOLCDFICSA-N 270.323 2.470 10 10 CECE CO[C@@H]1C[C@@]2(C(=O)N3CCCC[C@H](CN=[N+]=[N-])C3)C[C@@H]12 2354278936 BVBJIFYVGDODKP-CZXHOFHRSA-N 278.356 2.350 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H](OC)[C@@H]2COC[C@@H]21 2354349587 MONFCFLMCVWMMW-HGTKMLMNSA-N 277.364 2.189 10 10 CECE Oc1cccc(-c2nc([C@@H]3C[C@@H]4CC[C@H]3O4)no2)c1O 2354985436 WGCFSODHCKFLLB-JVUFJMBOSA-N 274.276 2.183 10 10 CECE N[C@@H]1[C@@H]2CC[C@H]1N(Cc1c(O)ccc3ccccc13)C2 2356121367 HKFOBQPYQJWROP-SRCQZFHVSA-N 268.360 2.467 10 10 CECE CCNCc1ccc(N2C[C@@H](C(N)=O)CC[C@@H]2C)cc1C 50584265 SOPGZZAYRNWESK-ZFWWWQNUSA-N 289.423 2.195 10 10 CECE COc1cc(Cl)cc(CN[C@@H](CO)C(C)C)c1O 229053069 XORPAJGGBLCTNW-NSHDSACASA-N 273.760 2.161 10 10 CECE c1ccc(-n2nnnc2Sc2nccs2)cc1 60219272 SQDVKUARDHJAQM-UHFFFAOYSA-N 261.335 2.270 10 10 CECE CC(C)CCS(=O)(=O)N(C)c1ccc(N)cc1 111657056 VVAJUCLPTPPSAZ-UHFFFAOYSA-N 256.371 2.081 10 10 CECE C[C@H](NC(=O)[C@]12CC[C@H](C[C@H]1N)C2)c1ccccc1O 2357204255 IHMGZOAQPRWTPA-CIGZNWKYSA-N 274.364 2.087 10 10 CECE CCOc1ccc(N2C[C@@H](C)NC[C@@H]2C)cc1F 126738786 LTCBLMACNMTPAH-MNOVXSKESA-N 252.333 2.411 10 10 CECE CCN[C@@H]1CCN(c2ccc(OCC)c(F)c2)C1 126517748 GGSUUOXNTZFAIB-LLVKDONJSA-N 252.333 2.413 10 10 CECE Cc1cc(N2CCCCC2)ccc1/C=C1\NC(=O)NC1=O 33398545 PUDNAIYXDHIHAA-UVTDQMKNSA-N 285.347 2.166 10 10 CECE CCN(C(=O)c1cccc(O)c1O)[C@H]1CCCC[C@@H]1CN 126697177 PBWFSUUUOQGTRW-YPMHNXCESA-N 292.379 2.077 10 10 CECE O=C(N[C@@H]1CC[C@H]2[C@@H](C1)C2(F)F)c1cccc(O)c1O 1329365517 PXLMFYLMNZSKCP-FKTZTGRPSA-N 283.274 2.261 10 10 CECE Cc1cc(/C=C\C(=O)O)ccc1N(C)Cc1nccn1C 213717853 UMVNHKYPIQZEOF-ALCCZGGFSA-N 285.347 2.463 10 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251.326 2.316 10 10 CECE CC(C)[C@H](CCO)N[C@@H](C)c1c(O)cccc1O 231072608 PYTRLCMBYVNKFZ-QWRGUYRKSA-N 253.342 2.155 10 10 CECE COc1ccc(C(=O)N(C(C)=O)c2ccc(N)cc2)cc1 244215832 VWXJYBLHRFKAEK-UHFFFAOYSA-N 284.315 2.471 10 10 CECE Nc1ccc(NC(=S)Nc2cccnc2O)cc1 243196385 KCJOBGSOPPHIRH-UHFFFAOYSA-N 260.322 2.178 10 10 CECE CCN(C)c1ccc([C@@H](C)N[C@@H](C)Cn2cncn2)cc1 269012584 NYHKHHDNNQQBGS-UONOGXRCSA-N 287.411 2.474 10 10 CECE CN(c1c(F)cc(CN)cc1F)C1(CO)CC(C)(C)C1 2164565943 WDLNNJCHNPKBTG-UHFFFAOYSA-N 284.350 2.411 10 10 CECE COc1ccc(CNC(C)C)cc1CO[C@@H]1CCOC1 110526974 MABURHZSYNJHJT-OAHLLOKOSA-N 279.380 2.499 10 10 CECE C[C@@H]1CC(N(C)Cc2cc(N)ccc2O)C[C@@H](C)N1C 2166884403 TVRWQAHTUYQFJW-VXGBXAGGSA-N 277.412 2.277 10 10 CECE CCN(C(=O)c1ccc(OC)nc1)c1ccc(N)cc1 2166932093 XUQAAOOSYLZYPE-UHFFFAOYSA-N 271.320 2.339 10 10 CECE N[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)OCCCO2 2162656725 DQJRKTRJXHEIHG-CLLJXQQHSA-N 274.364 2.306 10 10 CECE CN1CCc2cc(C3(O)CCC4(CC3)CNC4)ccc21 2163066772 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2.456 10 10 CECE COCCNCc1ccc(N2C[C@H]3C[C@H]2CS3)cc1 322114674 PROVWPRCTAWHLB-LSDHHAIUSA-N 278.421 2.117 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCCc2nnc[nH]2)c1 80540414 RNTUAZAFPHYBCA-LLVKDONJSA-N 260.341 2.102 10 10 CECE CCN(C(=O)COc1ccc(N)cc1)[C@@H](C)C1CC1 324585652 CDXPCAGXTLLQSS-NSHDSACASA-N 262.353 2.295 10 10 CECE COc1cccc(O)c1CN1C[C@@H](N)CC12CCCC2 2160733126 CMAABPKOJACIDS-LBPRGKRZSA-N 276.380 2.247 10 10 CECE Nc1ccc(CC(=O)NCc2cncc(Cl)c2)cc1 705587976 WXVDWNMXWVTRQX-UHFFFAOYSA-N 275.739 2.176 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]2(C(F)(F)F)CCNC2)cc1 2163073643 KYTLLIKRHSMVSP-QWHCGFSZSA-N 288.313 2.328 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H]3CCNC3(C)C)ccc21 2163061226 GTNMRTPYQYLMNV-GOEBONIOSA-N 274.408 2.491 10 10 CECE CCNCc1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)c(Cl)c1 706998435 GKYUULPHPSUYPG-OKILXGFUSA-N 293.842 2.447 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H](C)[C@](C)(C(=O)O)C1 710357256 ZWQQQEDQTBPYAF-FEUHOPSXSA-N 279.336 2.201 10 10 CECE CN1C[C@@H](NCc2c(O)cccc2Cl)C(C)(C)C1 722256635 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DNTAJVXTTZIIDM-CQSZACIVSA-N 262.353 2.042 10 10 CECE Cc1cc(CN2CCC(=O)[C@@H](C)C2)ccc1N(C)C 294565350 LTDCZOSZLLNKOZ-ZDUSSCGKSA-N 260.381 2.472 10 10 CECE CC(=O)C(=O)COC(=O)COc1ccc(C(C)(C)C)cc1 808489536 UOISOECPUZYNHJ-UHFFFAOYSA-N 292.331 2.064 10 10 CECE O=C(O)/C=C\c1ccc(N2C[C@@H]3[C@H](C2)C3(F)F)cc1 715458263 KOEVCWAQGISLHL-KHQOXSAWSA-N 265.259 2.486 10 10 CECE CNC(=O)[C@@]1(C)CCN(c2ccc([C@@H](C)N)c(Cl)c2)C1 723197886 HIMZFZVGPKTSPY-BMIGLBTASA-N 295.814 2.322 10 10 CECE Nc1ccc(NC(=O)CCN2CC[C@@H](CCF)C2)cc1 2165895115 AZKWCVIRHQTCAA-GFCCVEGCSA-N 279.359 2.279 10 10 CECE Cc1ncc(C[C@H](NN)c2ccc(N(C)C)cc2)s1 718917297 HIUJREPZLKADHM-AWEZNQCLSA-N 276.409 2.265 10 10 CECE NCc1ccc2c(c1)CCN2C[C@@H]1CCCCCO1 2133391454 MTVOLHDHHBQERK-HNNXBMFYSA-N 260.381 2.467 10 10 CECE CN(C)c1ccc(/C=C/CN2CCN3C(=O)CC[C@@H]3C2)cc1 835028819 SQUHEDVCBXEEQK-REMYHPOOSA-N 299.418 2.072 10 10 CECE Oc1cncc(CNCc2ccc3c(c2)CCCO3)c1 922975323 FNWRULSLFLNXHI-UHFFFAOYSA-N 270.332 2.402 10 10 CECE C[C@H]1CCC[C@H](CNC(=O)NCc2ccccc2O)O1 852581516 VBRFYELADMGGQT-WCQYABFASA-N 278.352 2.149 10 10 CECE O=C(NCc1c(O)cccc1F)[C@H]1CC[C@@H]2CCCCN21 928710018 FYINDRVBUBGWNJ-SMDDNHRTSA-N 292.354 2.164 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H]1CC2CCC1CC2 691534414 NHERMANNAWQYSO-HCWSGVFWSA-N 266.345 2.254 10 10 CECE C[C@H](NC(=O)C(=O)C1CCSCC1)c1ccccc1O 866160501 BGEXIBGLJPYASF-JTQLQIEISA-N 293.388 2.282 10 10 CECE CC(C)c1cc(C(=O)N2Cc3cccc(O)c3C2)n[nH]1 871201711 YZVFCRMJEDEBPF-UHFFFAOYSA-N 271.320 2.395 10 10 CECE C[C@@H](CCN1CCOC1=O)NCc1ccc(Cl)cc1O 1876026659 CEQRJLKOGBXOFB-JTQLQIEISA-N 298.770 2.366 10 10 CECE Cc1ccc(O)c(CN2CCC3CC2(C(=O)O)C3)c1 1877377229 JAHCBBDHGMCAPW-UHFFFAOYSA-N 261.321 2.140 10 10 CECE C[C@H]1CCN(c2c(F)cc(CN)cc2F)C[C@]1(C)O 1876944540 UPIOENHUSURKOO-XPTSAGLGSA-N 270.323 2.021 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1CCC2(CC2)[C@@H]1O 1877524395 RHASUYHKSQGXDP-DZGCQCFKSA-N 261.365 2.375 10 10 CECE Cc1cccc(O)c1NC(=O)c1cccc(O)c1O 1137774676 FEUUBVMBRWDHAM-UHFFFAOYSA-N 259.261 2.364 10 10 CECE C[C@H](O)c1cc(F)c(N2CCC[C@H](O)[C@H]2C)c(F)c1 1880487257 HVCZVMYJPVJUQP-ZDMBXUJBSA-N 271.307 2.368 10 10 CECE Oc1cccc(F)c1CNCC1CC2(CC[C@H]2O)C1 1882897165 LHHROXBKMVJGDB-CIQACWJJSA-N 265.328 2.172 10 10 CECE Nc1ccc(CCCN[C@@H]2C[C@@]23CCCOC3)cc1 1896492944 GLCZADCLRBVCOM-HZPDHXFCSA-N 260.381 2.360 10 10 CECE CO[C@H]1CCN(CCc2ccc(N)cc2)[C@H]1C1CC1 1883006309 MGRDXRJFYORALR-HOTGVXAUSA-N 260.381 2.311 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3C[C@@H](C2)C3)c([N+](=O)[O-])c1 1899781816 VXAWLUCDUSJJAB-GARJFASQSA-N 262.309 2.494 10 10 CECE CCn1cnc(C(=O)NCc2cccc(Cl)c2O)c1 1159041352 JKMPNOCGEFUMRO-UHFFFAOYSA-N 279.727 2.192 10 10 CECE CN(C)[C@H]1CCCN(CCCc2ccc(N)cc2)C1 134714055 IVTYDAJAJFUYHH-INIZCTEOSA-N 261.413 2.227 10 10 CECE CCOC(=O)CCN1C[C@@H](CC)Oc2cc(CN)ccc21 74337881 PIJDRJBJUXJVSN-CYBMUJFWSA-N 292.379 2.076 10 10 CECE Cc1cccc(O)c1CNC[C@]1(CO)CC12CCC2 1963064480 UVNWLDFYADNKNA-INIZCTEOSA-N 261.365 2.343 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H](C(=O)O)[C@@H](C)C1 1963009142 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NRPZSXLQMJFITK-UHFFFAOYSA-N 290.392 2.312 10 10 CECE CN(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N)cc1 702052921 CMHFFSOCIJQUGF-UHFFFAOYSA-N 271.276 2.454 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H](C1CC1)C(F)(F)F 1893125046 AFXQFWNWXHNCIY-JTQLQIEISA-N 273.258 2.121 10 10 CECE COC1(CNCc2cccc(Br)c2O)CC1 1964584293 HPGUMIGGWRADAD-UHFFFAOYSA-N 286.169 2.423 10 10 CECE COC1CC(CN[C@@H](C)c2c(O)cccc2O)C1 703172273 YENGGKKQQMHYJJ-WHXUTIOJSA-N 251.326 2.173 10 10 CECE CC(C)CS(=O)(=O)N(Cc1ccc(N)cc1)C(C)C 80186475 JABJBLLCTNJKEN-UHFFFAOYSA-N 284.425 2.465 10 10 CECE CC[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccccc1O 84063235 CKFZPAOQMBPRSH-WCQYABFASA-N 262.353 2.054 10 10 CECE COCCNCc1ccc(N2CC[C@@H](F)C2)c(F)c1 689818997 AAWCTANMELHDDO-GFCCVEGCSA-N 270.323 2.110 10 10 CECE C[C@@](Cc1cccs1)(NCCN=[N+]=[N-])C(=O)O 690062970 WYNSKNVPOXMUBW-JTQLQIEISA-N 254.315 2.034 10 10 CECE Nc1ccc(OCCNc2nccc3nc[nH]c23)cc1 714219415 XPDQCVPGENXXTN-UHFFFAOYSA-N 269.308 2.031 10 10 CECE C[C@@H](NCC[C@H](O)C(F)(F)F)c1c(O)cccc1O 717414208 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CC1CCC(NC(=O)c2cc(O)c(O)c(O)c2)CC1 2132350131 KVFGYWOMKZHADR-UHFFFAOYSA-N 265.309 2.112 10 10 CECE N[C@@H]1CCN(C(=O)c2cccc(O)c2O)c2ccccc21 125931951 JEMBNHKGUUPMNM-GFCCVEGCSA-N 284.315 2.148 10 10 CECE NCc1ccc(N2CCCC[C@H]2CCO)c(F)c1 36887003 ATISOISWCCTYEZ-LBPRGKRZSA-N 252.333 2.026 10 10 CECE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(Cl)nc1 1540641423 UTSPMQGUSIDUGQ-UHFFFAOYSA-N 278.695 2.327 10 10 CECE CN(O)Cc1cc(Br)c(F)cc1O 217644444 DYQIHRGAPOKUMT-UHFFFAOYSA-N 250.067 2.115 10 10 CECE COc1ccc(CN(C)[C@@H]2CCSC2)c(O)c1 130630448 VQKBCJIUZIWMFP-LLVKDONJSA-N 253.367 2.338 10 10 CECE CCCN(Cc1ccc(N)cc1)[C@@H](C)C(=O)OC 43629552 AJSOIUOIGJRGDX-NSHDSACASA-N 250.342 2.042 10 10 CECE COc1cccc(CN[C@H]2CCCSC2)c1O 135702274 OUVHIRJLMSLIPM-NSHDSACASA-N 253.367 2.386 10 10 CECE CS[C@H]1CCC[C@@H]1NCc1cccc(O)c1O 226758353 RZQXGYQITVUZGA-JQWIXIFHSA-N 253.367 2.472 10 10 CECE Nc1ccc(Nc2ccccc2S(=O)(=O)O)cc1 44563942 BMNJBKPSZMTXBG-UHFFFAOYSA-N 264.306 2.259 10 10 CECE CCOC(=O)Nc1cc(N2CCOCC2)ccc1OC 41365159 HOVICEZZPMBSEV-UHFFFAOYSA-N 280.324 2.100 10 10 CECE C[C@H]1COCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 193883516 SXBXBNQKUMHWOK-WFASDCNBSA-N 276.380 2.041 10 10 CECE COc1ccc(CNCC(F)(F)C(F)F)c(O)c1 191779086 UCQNPBJNEMMCLN-UHFFFAOYSA-N 267.222 2.391 10 10 CECE C[C@H](Sc1nccs1)C(=O)NC(=O)NC1CCCC1 48875292 CBPBUQJMRHRHGK-QMMMGPOBSA-N 299.421 2.392 10 10 CECE CCN(CCCN(C)C)c1ccc(OC)cc1N 230696846 HIGVXHOZBCSKJC-UHFFFAOYSA-N 251.374 2.055 10 10 CECE CN[C@]1(C(=O)OC)CCC[C@@H](Sc2nccs2)C1 93778706 IROCYXONNARGFN-BXKDBHETSA-N 286.422 2.309 10 10 CECE COc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)N=[N+]=[N-] 385120714 CRNXHUGIADRJSP-UHFFFAOYSA-N 291.672 2.046 10 10 CECE CCC[C@@H](C)OC[C@@H](O)COc1ccc(N)cc1 230432020 RBDBMURIWQHTKS-DGCLKSJQSA-N 253.342 2.214 10 10 CECE Cc1ccc([C@@H](C)NC[C@H](O)C(F)(F)F)c(O)c1 230659283 WCEKCVVKFCVIPT-KCJUWKMLSA-N 263.259 2.274 10 10 CECE Cn1c2c(c3cc(C(C)(C)C)ccc31)CN(CC(N)=O)CC2 527396826 JBAVVJDMGYHJIC-UHFFFAOYSA-N 299.418 2.319 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@H]2CCCN2C)cc1 252582722 WASMAUYAFKWFKV-XJKSGUPXSA-N 261.413 2.497 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2C[C@@H](C(N)=O)C2)cc1Cl 703486487 LTIAMMANJCMTFM-ATZCPNFKSA-N 282.771 2.093 10 10 CECE CCN1CCc2cc([C@@H](NC)c3nccn3C)ccc21 2163065827 FFMOZEIZZXKYEE-OAHLLOKOSA-N 270.380 2.111 10 10 CECE CN1CCc2cc([C@@H](O)[C@@H]3CCNC4(CC4)C3)ccc21 2163074700 VLTCHVHBJVGGAV-GDBMZVCRSA-N 272.392 2.245 10 10 CECE Cn1cc([C@H](N)c2ccc(N3CCCCC3)cc2)cn1 2163105011 HFGRTIAQZANUFY-MRXNPFEDSA-N 270.380 2.459 10 10 CECE CN(C)c1ccc([C@H](NN)c2csc3cncn23)cc1 2163106698 KRLLBWUVWXETTA-AWEZNQCLSA-N 287.392 2.015 10 10 CECE Nc1ccc(CCCN2CCC([C@@H](F)CO)CC2)cc1 2163286601 RAOFZCRAFGLUHM-INIZCTEOSA-N 280.387 2.244 10 10 CECE CO[C@H](C)[C@@H](N)C[C@@H](O)c1ccc(N2CCCC2)cc1 2165784926 MRHKUFAMJHMOGJ-UHOFOFEASA-N 278.396 2.073 10 10 CECE NCc1ccc(N2C[C@@H](F)[C@H](F)C2)c(Br)c1 714667212 UJDFCNXASPZULZ-NXEZZACHSA-N 291.139 2.404 10 10 CECE O=C(Cc1ccncc1Cl)NCc1ccccc1O 816912163 MRJMAKBARNYNMO-UHFFFAOYSA-N 276.723 2.300 10 10 CECE COCCN(c1cc2c(cc1Cl)[C@H](N)C(=O)N2)C(C)C 123174610 SVECKWQZJWBPMX-ZDUSSCGKSA-N 297.786 2.153 10 10 CECE CC1(/C=C\C(=O)NCc2ccc(O)cc2O)CCOCC1 828027495 KAHXRNPHLJQANV-PLNGDYQASA-N 291.347 2.087 10 10 CECE c1csc(SCc2cn(CC3CC3)nn2)n1 829099899 BTEWRLPCMXPQNZ-UHFFFAOYSA-N 252.368 2.437 10 10 CECE CCOc1ccc(CN2CCC[C@]2(C)C(=O)O)c(O)c1 903698214 RQSUGXVXQATRBQ-OAHLLOKOSA-N 279.336 2.230 10 10 CECE CN(C)c1ccc(/C=C\CN2CCn3cncc3C2)cc1 835056965 XBRGNMQEDUIMJR-ARJAWSKDSA-N 282.391 2.478 10 10 CECE CN(C)c1ccc(/C=C/CN2CC[C@](O)(C(F)F)C2)cc1 835053109 BCQIUEOFUJYESF-QDLOVBKTSA-N 296.361 2.468 10 10 CECE Cc1cc(Cl)cc(CNCC2(N)CCC2)c1O 841049122 NIWDMHUJCBAZRB-UHFFFAOYSA-N 254.761 2.325 10 10 CECE CN(Cc1ccccc1O)C(=O)NC[C@]1(C)CCCCO1 927192727 SQXIXVUUBACQLP-INIZCTEOSA-N 292.379 2.493 10 10 CECE COc1cccc([C@@H](C)N[C@H](C)C(C)(C)O)c1O 846162547 LEGOGUHCNGITIN-NXEZZACHSA-N 253.342 2.211 10 10 CECE COCc1n[nH]c(CN[C@@H](C)c2ccc(Cl)cc2O)n1 850517728 ZWGZVOJUCJLJEH-QMMMGPOBSA-N 296.758 2.161 10 10 CECE CNC[C@H]1CCN1c1cc(Cl)c(OC)cc1OC 696365121 QHQKCVIXYAXZBS-SECBINFHSA-N 270.760 2.155 10 10 CECE CC[C@@H](NC1CN(c2ccncn2)C1)c1ccccc1O 866495466 CYQGCBULJSYLFH-CQSZACIVSA-N 284.363 2.112 10 10 CECE CCCc1nc(C(=O)N2Cc3cccc(O)c3C2)co1 871205372 ZGADXRRBKVXVBU-UHFFFAOYSA-N 272.304 2.489 10 10 CECE C[C@@H](c1ccccc1O)N1CCC2CC1(C(=O)O)C2 1877377024 HBQGZNVKBAUFHF-NLTNOIMHSA-N 261.321 2.392 10 10 CECE CN(Cc1ccccc1O)C[C@H]1CC2(CCC2)CN1 1877539624 XNFRYGXCNBOACF-CQSZACIVSA-N 260.381 2.356 10 10 CECE Cc1ccnnc1CN(C)CCc1ccc(N)cc1 1877926951 UYSZAUHEFXUXGJ-UHFFFAOYSA-N 256.353 2.042 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CNC2CC2)cc1 1879186729 BEOSLBXEDYVBGE-WBMJQRKESA-N 260.381 2.288 10 10 CECE CC[C@@H](CNCc1cc(Cl)ccc1O)C(=O)OC 895121211 WAPQZWLADQNLAF-VIFPVBQESA-N 271.744 2.334 10 10 CECE C[C@H](O)C1CCN(Cc2cc(F)cc(F)c2O)CC1 893995365 VOVKTNXOGVMEHB-VIFPVBQESA-N 271.307 2.263 10 10 CECE C[C@H](c1ccc(F)cc1O)N(CC(N)=O)C1CCCC1 132984744 TZPQEYHNOJWNRM-SNVBAGLBSA-N 280.343 2.322 10 10 CECE CN[C@H](C)c1cc(F)c(N(CCO)C(C)C)c(F)c1 1880960054 FYBPMIPUMGBVIC-SNVBAGLBSA-N 272.339 2.452 10 10 CECE COC(OC)c1ccc2c(c1O)C(=O)c1ccccc1C2=O 1077991933 UKQFUVNIVHRGHH-UHFFFAOYSA-N 298.294 2.459 10 10 CECE biogenic CN[C@@H](C)c1cc(F)c(N2C[C@@H]3C[C@H](C2)O3)c(F)c1 1899731759 QVSHIMSBSPFYPE-INTQDDNPSA-N 268.307 2.223 10 10 CECE CCCN1C[C@H](CC)Oc2ccc(N3CCNCC3)cc21 77017106 UDUPTLIWWJXPAR-HNNXBMFYSA-N 289.423 2.484 10 10 CECE CCN(Cc1ccc(N)cc1)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1O 1888480589 JXUYNBYLSBFBEG-UGQVUOCMSA-N 260.381 2.250 10 10 CECE CC1(C)C[C@@]1(C)CNC(=O)COc1ccc(N)cc1 701964104 CXZJNGPEAUFCNQ-HNNXBMFYSA-N 262.353 2.200 10 10 CECE CC(C)N[C@@H](c1nnco1)c1cc(F)ccc1O 83384574 SEQZULCOHZFCOW-LLVKDONJSA-N 251.261 2.002 10 10 CECE CC[C@H](CO)NCc1ccc(N(CC)CC)cc1O 83493301 ITRSPTJVLARIPA-CYBMUJFWSA-N 266.385 2.099 10 10 CECE CC[C@@]1(c2cc(OC)cc(Cl)c2O)COCCN1 83534864 PJFVIHGFOYDJTB-ZDUSSCGKSA-N 271.744 2.279 10 10 CECE NCc1ccc(N2CC[C@H](C(F)(F)CO)C2)c(Cl)c1 1892707086 IZVZNZXUZWCJGT-JTQLQIEISA-N 290.741 2.253 10 10 CECE C/C(=C\c1ccccn1)C(=O)NCc1c(O)cccc1O 1178918169 ZSTVJPZNIBDGIS-PKNBQFBNSA-N 284.315 2.213 10 10 CECE CCCN1CC[C@H](CNCc2cccc(F)c2O)C1 693029882 CGIZYQCUVBLJLF-GFCCVEGCSA-N 266.360 2.353 10 10 CECE COc1ccc(N2CC(OCC(F)(F)F)C2)c(N)c1 707223265 PAKLUNDJDOAMBQ-UHFFFAOYSA-N 276.258 2.045 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC(CCC(=O)O)C1 709367578 ZBUCXWQCBKSVIR-SECBINFHSA-N 267.300 2.389 10 10 CECE COC(C)(CCN[C@@H](C)c1c(O)cccc1O)OC 711034032 CFOFMNOTYUWMDC-JTQLQIEISA-N 269.341 2.148 10 10 CECE CCNCc1cc(F)c(N(C)C[C@H](O)C2CC2)c(F)c1 690274149 FORIZKOSQQIRNL-AWEZNQCLSA-N 284.350 2.281 10 10 CECE Oc1cc(Br)ccc1CN1C[C@@H]2COC[C@H]2C1 718153159 IYACLMNMMLCOJK-GHMZBOCLSA-N 298.180 2.233 10 10 CECE CCOc1cccc(CNC[C@]2(OC)CCSC2)c1O 719316246 MLCSEOZABWTONY-OAHLLOKOSA-N 297.420 2.403 10 10 CECE COC[C@@H](C)OCc1cc(CNC2CC2)ccc1OC 70207465 HUJSFABLBUKQDO-GFCCVEGCSA-N 279.380 2.499 10 10 CECE CNCc1cc(F)c(N2C[C@H](C)[C@@](C)(CO)C2)c(F)c1 694713158 JTHRVLCTDDGDBR-ZUZCIYMTSA-N 284.350 2.139 10 10 CECE FC1(F)Oc2ccc(N3CCN[C@@H](C4CC4)C3)cc2O1 86123721 QFGCUBYYEPKIOE-LLVKDONJSA-N 282.290 2.196 10 10 CECE CCc1ncc(CNCc2ccc(N(C)C)cc2)[nH]1 699206159 QQWHMXALPXEHKO-UHFFFAOYSA-N 258.369 2.328 10 10 CECE OC[C@@H]1C[C@H]2CC[C@H]1N2Cc1cc(F)cc(F)c1O 1332707833 NQTCRGYEJHFNCB-UFGOTCBOSA-N 269.291 2.016 10 10 CECE Cc1cc(O)c([C@H](C)N(C)[C@H](C)C(N)=O)cc1Cl 2258551411 VGKFUESFCIPYOO-DTWKUNHWSA-N 270.760 2.221 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)[C@@H]1CC1(C)C 2115223018 PRMROYMEQRWRCJ-GXFFZTMASA-N 261.369 2.326 10 10 CECE Cc1ccc(F)c(C(=O)NCc2cc(O)ccc2O)c1 1455356842 LEPUDKKPGAGHPF-UHFFFAOYSA-N 275.279 2.475 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H]3C[C@@H]3[C@H]3C[C@H]32)c1 2117416257 HYDKVFQZAJGUNA-SPWCGHHHSA-N 257.333 2.435 10 10 CECE CCOc1cccc(CNC2CC(C)(CO)C2)c1O 2119238333 GUCXJVCTDFPRNQ-UHFFFAOYSA-N 265.353 2.042 10 10 CECE [N-]=[N+]=N[C@@H](CO)c1ccc(O)c(Br)c1 1536017581 XKLBGSUFPJSBRZ-ZETCQYMHSA-N 258.075 2.498 10 10 CECE c1cc(N2CCCCC2)ccc1CNc1cnn[nH]1 1621098159 BYSMHMVZHIHXEC-UHFFFAOYSA-N 257.341 2.407 10 10 CECE CCc1ncncc1CN(C)c1ccc(CN)cc1 2122274271 VURISUQSTQTTJT-UHFFFAOYSA-N 256.353 2.134 10 10 CECE CC(C)N[C@]1(C(N)=O)CC[C@H](Sc2nccs2)[C@@H]1C 2122560366 IFFUXXBFXNYQRO-OUJBWJOFSA-N 299.465 2.256 10 10 CECE Cn1nnc(CN2CCC[C@@H]2CN=[N+]=[N-])c1C(F)F 2123015900 QVRNISSSBKZSPL-SSDOTTSWSA-N 271.275 2.027 10 10 CECE CN(CCCCC(=O)O)CCCc1ccc(N)cc1 2123055652 LEFXWLFITCFBEH-UHFFFAOYSA-N 264.369 2.388 10 10 CECE COC(=O)c1ccoc1CN1CCC[C@H]1CN=[N+]=[N-] 2123014460 GKIWBGGEOUGCCS-VIFPVBQESA-N 264.285 2.341 10 10 CECE NC(=O)c1cc(Sc2nccs2)ccc1[N+](=O)[O-] 1650661694 YMWKHMBUHREFTK-UHFFFAOYSA-N 281.318 2.301 10 10 CECE [N-]=[N+]=NC1CN(Cc2snnc2C2CCC2)C1 2299464049 WIRWRNDVAXWEKY-UHFFFAOYSA-N 250.331 2.300 10 10 CECE CC(C)Cc1nc(CN2CC[C@H](CN=[N+]=[N-])C2)no1 1912175919 RSGIDPSBRSBSAW-SNVBAGLBSA-N 264.333 2.400 10 10 CECE C[C@@H](C(=O)NC(C)(C)C)N1CCC[C@@H](N=[N+]=[N-])C1 1912162777 ADMSOLFWIYJUIK-VHSXEESVSA-N 253.350 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C[C@H](O)c1ccc(N2CC[C@H](c3ccnn3C)C2)cc1 2171778744 NPVIICQUOHNJEU-JSGCOSHPSA-N 271.364 2.467 10 10 CECE C[C@H](NC[C@H]1CCCCN(C)C1)c1cc(O)ccc1O 700817943 HVBVGAREHVNQBV-QWHCGFSZSA-N 278.396 2.480 10 10 CECE COC1(C)CCC(NC(=O)c2ccc(O)c(O)c2)CC1 2161483109 WMKXGGPVRLMTAC-UHFFFAOYSA-N 279.336 2.175 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1C[C@H]2OCC[C@@H]2C1 2172070680 LLFDYQPFCDEQBB-UKRRQHHQSA-N 273.332 2.318 10 10 CECE CN(C)C[C@H](N[C@H]1CCc2cccc(O)c21)C(F)(F)F 2177719511 OMHIAEZCUYIJRO-JQWIXIFHSA-N 288.313 2.462 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H](O)CC2)cc1O 378730258 WITZMLLVFQIHMI-YPMHNXCESA-N 264.369 2.024 10 10 CECE CN(Cc1ccsn1)c1cc2c(cc1N)OCCO2 705677160 YTRVDPDVYZQVTN-UHFFFAOYSA-N 277.349 2.133 10 10 CECE CN1C[C@@]2(C)CN(Cc3cccc(F)c3O)C[C@@]2(C)C1 706220781 VURVTQRXQXHVOY-IYBDPMFKSA-N 278.371 2.305 10 10 CECE CCSC[C@H](C)N(C)c1ccc2c(c1)NC(=O)[C@@H]2O 706357083 HEDDYNCOAKXDFK-TVQRCGJNSA-N 280.393 2.250 10 10 CECE CN1CCc2cc([C@@H](O)[C@]3(CN)CC34CCC4)ccc21 2163075307 BRXAGOQZARQGND-NVXWUHKLSA-N 272.392 2.231 10 10 CECE CN1CC[C@H](CN(C)Cc2cc(F)cc(F)c2O)C1 708400844 PXWZKFWLJYQTKP-JTQLQIEISA-N 270.323 2.054 10 10 CECE COc1ccc(N2CCC[C@H](C)[C@H]2CO)c([N+](=O)[O-])c1 708467381 CMLBXMRPNFZYLK-IINYFYTJSA-N 280.324 2.201 10 10 CECE CN(C)c1ccc([C@@H](C[C@H]2CC(C)(C)CO2)NN)cc1 2163108440 XNKXRDYSPUREEQ-LSDHHAIUSA-N 277.412 2.462 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@](C)(O)C1CC1 2163148381 WVUVJNAJPGODNV-DLBZAZTESA-N 274.408 2.491 10 10 CECE CCN(C[C@H](C)O)c1ccc(CNC2CC2)cc1F 709410260 LIIIUASNOODYPD-NSHDSACASA-N 266.360 2.285 10 10 CECE CCNCc1ccc(N2CCC[C@@H]([C@H](C)O)C2)cc1 688960746 GSVFNLFYBLTXFJ-DZGCQCFKSA-N 262.397 2.393 10 10 CECE COc1cc(N)c(N2CCC[C@]23CCOC3)cc1OC 380804158 YZCXLMRQJSTNSH-OAHLLOKOSA-N 278.352 2.045 10 10 CECE CN1CC[C@@H]2CN(c3ccc(CN)c(Cl)c3)C[C@H]2C1 381675138 ACAACDFBURSKTE-CHWSQXEVSA-N 279.815 2.187 10 10 CECE CN(CC1CC(F)(F)C1)c1ccc2c(c1)NC(=O)[C@H]2N 383202677 ZLJDEHIBUSWPNF-LBPRGKRZSA-N 281.306 2.120 10 10 CECE CC[C@@H](NCC1OCCCO1)c1ccccc1O 716370302 PQTWVKURXMAIQR-GFCCVEGCSA-N 251.326 2.196 10 10 CECE C[C@@H](CCCO)CNCc1ccc2c(c1)CCN2C 384446291 ZQMMEHNVVDYBAN-ZDUSSCGKSA-N 262.397 2.177 10 10 CECE COc1ccc(CN2CCC[C@@H](C(=O)O)[C@H]2C)c(O)c1 384456269 JGCOSNPONZISQV-ZWNOBZJWSA-N 279.336 2.086 10 10 CECE C[C@@H]1C[C@@H](CNCc2ccc(O)c(O)c2)CCO1 388685628 IZYCJQWNDPNYTD-PWSUYJOCSA-N 251.326 2.003 10 10 CECE CO[C@H](CN[C@H](C)c1c(O)cccc1O)C1CC1 394088936 ZWYNTIXBWMYFEM-NOZJJQNGSA-N 251.326 2.173 10 10 CECE COc1ccc([C@@H](C)NCc2ccc(C)nn2)c(O)c1 396579573 RFPVRSKVFWJODU-LLVKDONJSA-N 273.336 2.350 10 10 CECE CCNCc1ccc(N2C[C@@H](OC)C[C@@H](O)C2)c(Cl)c1 2165322773 MLCHVVYFHDLGGV-OLZOCXBDSA-N 298.814 2.036 10 10 CECE CN[C@H](C)c1ccc(N2CCO[C@H]([C@@H](C)O)C2)cc1Cl 2174153986 XDTJZAUGIWKQPE-HFAKWTLXSA-N 298.814 2.206 10 10 CECE Cc1cc(=NCc2ccccc2O)[nH]c(C)c1[N+](=O)[O-] 2174260102 YXNVZKOGJASQRY-UHFFFAOYSA-N 273.292 2.346 10 10 CECE C[C@H](N)Cc1cccc2c1ccn2Cc1cncnc1 2178778784 ZYSXBYUUFVHEPS-LBPRGKRZSA-N 266.348 2.369 10 10 CECE Nc1ccc(O)c(CNC(=O)C2[C@@H]3CCCCC[C@@H]23)c1 2167231403 KXIVEYCYISHNDZ-CHWSQXEVSA-N 274.364 2.417 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCC[C@@H](C(=O)O)C1 2179013165 MQUOFRYMUDHBKL-WDEREUQCSA-N 279.336 2.346 10 10 CECE NCc1ccc(N2CCOC3(CCOCC3)C2)c(Cl)c1 2168211618 NFTPVHYUHVXNKM-UHFFFAOYSA-N 296.798 2.185 10 10 CECE CNC(=O)c1cc(C)nn1[C@H](C)c1cccc(C)c1O 2070175167 NUDXJOSFZCJLHC-LLVKDONJSA-N 273.336 2.174 10 10 CECE COc1ccc(N(C)[C@@H]2CCCCNC2)c([N+](=O)[O-])c1 2169145625 FGZTVGNBUIKFHQ-LLVKDONJSA-N 279.340 2.182 10 10 CECE O[C@@H]1CCC12CN(c1ccc(CNC3CC3)cc1F)C2 2179703064 ILPFFNGXXRLUBC-OAHLLOKOSA-N 276.355 2.039 10 10 CECE CC[C@@H](O)c1ccc(N(CC)[C@@H]2CCCNC2=O)cc1 2171234194 CZJGZYRFSAXJCY-HUUCEWRRSA-N 276.380 2.235 10 10 CECE C[C@@H](N[C@@H]1CCCC(=O)N(C)C1)c1cc(F)ccc1O 2188500966 UPTCRQDJZGAXBC-ZYHUDNBSSA-N 280.343 2.193 10 10 CECE COc1cccc(O)c1CNC1CC(c2ncc[nH]2)C1 2181598058 BCHJLBCMMQHBRJ-UHFFFAOYSA-N 273.336 2.160 10 10 CECE COC(=O)[C@H]1CC[C@H](CN(C)Cc2ccc(N)cc2)C1 2181844439 MDLMIQQRIRHUSL-KBPBESRZSA-N 276.380 2.290 10 10 CECE O=C(c1cc(O)c(O)c(O)c1)N1CC=CC12CCCC2 2188908930 HFXBNRSHSHCUCP-UHFFFAOYSA-N 275.304 2.128 10 10 CECE Cc1nc2c[nH]c(=NCCc3ccc(N)cc3)nc2s1 2189177265 QLAVXBZWAKSHTI-UHFFFAOYSA-N 285.376 2.053 10 10 CECE Oc1ccc(CCNC2CC3(CCOCC3)C2)cc1O 2189847873 PBLFKULJFSJZAU-UHFFFAOYSA-N 277.364 2.189 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC[C@H]2COC[C@@H]21 2198567808 FWEFPGQSGDSGKI-YOEHRIQHSA-N 272.392 2.472 10 10 CECE CCN(C(=O)c1nn(C)cc1Cl)c1ccc(N)cc1 2094349689 LMWDIHRYELQXME-UHFFFAOYSA-N 278.743 2.322 10 10 CECE C[C@@H](N[C@H]1C[C@@H](n2cccn2)C1)c1ccc(O)cc1O 2184164149 BYSBGBFPLMWYNQ-UTUOFQBUSA-N 273.336 2.349 10 10 CECE CN(Cc1ccn(C)n1)c1ccc2c(c1)CCC[C@@H]2O 2184683918 GKTBKIBEEVYDQR-INIZCTEOSA-N 271.364 2.426 10 10 CECE O[C@@H]1CCCc2cc(N3CCN4CCC[C@@H]4C3)ccc21 2184689094 KUCJSZOYOVWLSN-NVXWUHKLSA-N 272.392 2.341 10 10 CECE N[C@@H]1CCc2cc(N3CC4(CCC4)C[C@@H]3CO)ccc21 2184719911 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C[C@H](O)c1ccc(N2CC([C@H](F)CO)C2)c(Cl)c1 2048029935 NBJCUKKDACZIED-QPUJVOFHSA-N 273.735 2.160 10 10 CECE CCN(CC)c1ccc([C@H](O)C(COC)COC)cc1 2199367127 KCISSCOWIVEJNB-INIZCTEOSA-N 281.396 2.475 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H](CF)C2)c(F)c1 2052004241 WMCXIKZCLFNHHE-KOLCDFICSA-N 256.296 2.020 10 10 CECE CC[C@@H](N)CN(CC)[C@H](C)c1cc(O)ccc1O 2053095471 GDGMYCGZBPZUEU-GHMZBOCLSA-N 252.358 2.218 10 10 CECE C[C@@H](C(=O)O)[C@@H](C)N1CCOc2cc(N(C)C)ccc21 2195426147 ORHYULKELYILHK-GHMZBOCLSA-N 278.352 2.061 10 10 CECE CN(CC1(F)CCC1)C(=O)c1ccc(O)c(O)c1 2057680897 KOHPFWMRGQIIPW-UHFFFAOYSA-N 253.273 2.062 10 10 CECE Cc1cccc(O)c1CN(C)C[C@@H]1OCC[C@H]1F 2058677339 UNQYQCWVDDGQQG-OCCSQVGLSA-N 253.317 2.259 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N1CC(C2CNC2)C1 2196645258 GWZAJGWUYCFDHU-SMDDNHRTSA-N 272.392 2.400 10 10 CECE Cc1ccn2[nH]c(=N[C@@H](C)c3ccccc3O)nc2c1 2192621917 HZDDXNWMMTTXAJ-NSHDSACASA-N 268.320 2.338 10 10 CECE C[C@H]1C[C@H](C)N(c2ccc(CO)c([N+](=O)[O-])c2)C1 2068307050 CRNFWOMYYPFTIK-UWVGGRQHSA-N 250.298 2.322 10 10 CECE CO[C@H]1C[C@H](CF)N(c2ccc(CN)cc2Cl)C1 2069983891 YZVKXGBZQHVUFB-MNOVXSKESA-N 272.751 2.362 10 10 CECE Cc1ccnnc1CN(C)c1ccc2c(c1)CC[C@@H]2N 2192800555 PVKFYHVSISTGCQ-HNNXBMFYSA-N 268.364 2.367 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])C1CC=CC1 2070792685 BPGSLOTVFGPJDZ-GFCCVEGCSA-N 252.318 2.174 10 10 CECE CC1(C)CCC[C@@H](N2CCc3cc(CN)ccc32)[C@@H]1O 2197091210 KCEFNIVKIRFTEI-CVEARBPZSA-N 274.408 2.447 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](O)C23CCC3)cc1Cl 2081648986 ABELPPAOXUFYRH-ZANVPECISA-N 267.756 2.497 10 10 CECE CNCc1ccc(N2CC(OCC(C)C)C2)c(F)c1 2102490516 CSBMPNVDIQVFOE-UHFFFAOYSA-N 266.360 2.406 10 10 CECE Cc1ccncc1[C@@](C)(O)[C@H](N)c1ccccc1O 2103705656 FGZATKXFIJCYFW-HUUCEWRRSA-N 258.321 2.003 10 10 CECE C[C@@H](N)c1ccc(N(C)C2CCC(O)CC2)cc1O 2103868935 XBHDZSQTVOQXEJ-XSRFYTQQSA-N 264.369 2.152 10 10 CECE CNCc1ccc(N(C)[C@H]2CC[C@@H](O)CC2)cc1C 2103877313 NAFARMOXMAZTJF-FZNQNYSPSA-N 262.397 2.454 10 10 CECE CC[C@H](NC)c1ccc(N(C)Cc2ncno2)cc1 2104123227 FIUCPQVMZRZOKS-ZDUSSCGKSA-N 260.341 2.377 10 10 CECE C[C@H](N)C1CCN(Cc2ccc(F)cc2O)CC1 2084080028 PDYVNDQWJUHEJF-JTQLQIEISA-N 252.333 2.091 10 10 CECE O=C(O)C1CC2(CCN(Cc3ccccc3O)C2)C1 2105025457 BISPWUMLGPHZEU-UHFFFAOYSA-N 261.321 2.079 10 10 CECE CC[C@H]1CC[C@@H](NCc2ccc(O)c(O)c2O)C1 2085254175 ZHFYOOUAAUHZCC-GXSJLCMTSA-N 251.326 2.472 10 10 CECE CN(CCCOc1ccc(N)cc1)CC1(F)CC1 2085435972 PLVNATBEJVBKER-UHFFFAOYSA-N 252.333 2.472 10 10 CECE CO[C@@H]1C[C@@H](C)CC[C@@H]1NCc1cccc(O)c1O 2105783027 IAUQNJDWBMVVQX-VHRBIJSZSA-N 265.353 2.391 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2[C@H]3NCCCC[C@@H]32)cc1 2106786039 DHPQWSKBEKCTQH-WCVJEAGWSA-N 260.381 2.174 10 10 CECE CN(C)c1ccc([C@H](O)[C@@]23CCC[C@@H]2CNC3)cc1 2106794846 AKXMKGSZNSBUNC-VNQPRFMTSA-N 260.381 2.176 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@H]1CCCN(C)C1 2106793941 RUULQELRQTVRJS-HOCLYGCPSA-N 261.413 2.355 10 10 CECE C[C@@H]1C[C@@H]([C@@H](N)c2ccc3c(c2)CCN3C)CCO1 2106798427 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2.242 10 10 CECE C[C@H]1CN(C)[C@H](C)CN1c1ccc([C@@H](C)O)cc1F 2229728650 RMCNETYLLQHNKR-GRYCIOLGSA-N 266.360 2.408 10 10 CECE CC(C)n1ncc(N)c1NCCc1ccc(O)c(O)c1 2240570199 RSNWVHUWUHDXFA-UHFFFAOYSA-N 276.340 2.112 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)C1CCS(=O)(=O)CC1 2240838830 YGTNFQZYVXSOQG-GFCCVEGCSA-N 297.420 2.062 10 10 CECE CC[C@H]1[C@@H](O)CCN1c1ccc(CO)c(Cl)c1 2250995937 WIHHQZHDSDWICW-STQMWFEESA-N 255.745 2.182 10 10 CECE CSc1ncc(CN2CCNC(C)(C)C2)s1 2243802136 QUUFPEYEQUITQY-UHFFFAOYSA-N 257.428 2.049 10 10 CECE COc1ccc(N2CC(C)(C)OC[C@@H]2C)c(N)c1 2256746359 DEDZVCIMFDPONO-JTQLQIEISA-N 250.342 2.281 10 10 CECE C[C@@H]1COC(C)(C)CN1c1ccc(CN)c(F)c1 2256719021 YVMLGGVNUOMFQR-SNVBAGLBSA-N 252.333 2.288 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CCCO)cc1C 2257468476 PAGWZSRKUVKXQQ-ZDUSSCGKSA-N 250.386 2.484 10 10 CECE Cc1cc(O)c([C@H](C)N(C)[C@@H](C)C(N)=O)cc1Cl 2258551412 VGKFUESFCIPYOO-IUCAKERBSA-N 270.760 2.221 10 10 CECE C[C@]1(CNCc2cccc(F)c2O)CCC[C@@H]1O 2258800722 QUQQQNSITUXOKA-GXTWGEPZSA-N 253.317 2.172 10 10 CECE CC[C@@H](O)c1ccc(N2CCn3cncc3C2)cc1 2271012989 TWGMTBZFZBQXFI-OAHLLOKOSA-N 257.337 2.347 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1ccc(F)cc1N 2271351573 KHIZUEGQFCDOSI-WDEREUQCSA-N 263.276 2.369 10 10 CECE CN(CCCOc1ccc(N)cc1)Cc1nncs1 2266608462 KJKNTOXQXQQOES-UHFFFAOYSA-N 278.381 2.021 10 10 CECE CCNCc1cc(F)c(N2CC[C@@]3(O)C[C@@H]3C2)c(F)c1 2280019323 ZJZCQLJHBABRNS-IAQYHMDHSA-N 282.334 2.035 10 10 CECE C[C@H](NCCN(C)C(=O)C1CC1)c1ccc(F)cc1O 2280542434 YWZORJOQEUEKHL-JTQLQIEISA-N 280.343 2.050 10 10 CECE COc1ncc(NCc2cccc(C)c2O)nc1OC 2280710991 OEMHJWSNFQCIKI-UHFFFAOYSA-N 275.308 2.120 10 10 CECE COc1ccc(N2CC[C@@H](CO)C23CC3)c(OC)c1C 2295378197 NICIKUUXBIGDGF-LBPRGKRZSA-N 277.364 2.363 10 10 CECE c1cc(N2CCNCC2)ccc1CN[C@]12CCC[C@@H]1C2 2286067230 GNXMQKBXVGTQTA-WBVHZDCISA-N 271.408 2.128 10 10 CECE NC[C@@H]1CC(F)(F)CN1c1ccc2c(c1)OC(F)(F)O2 2296499406 GUHBIKVOZIDWDS-QMMMGPOBSA-N 292.232 2.181 10 10 CECE O[C@H]1CCCc2cc(N3CCn4cncc4C3)ccc21 2286541978 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Cc1c([C@H](C)O)ccc(N2CC(C[S@@](C)=O)C2)c1C 2340855602 LAACJCSYBNSSGZ-HXPMCKFVSA-N 281.421 2.171 10 10 CECE COC1(C(F)F)CC(C(=O)NCCCCN=[N+]=[N-])C1 2343096954 GTNFLUFHXAKUFZ-UHFFFAOYSA-N 276.287 2.253 10 10 CECE CC(C)[C@@H]1C[C@H](O)CN1c1ccc2c(c1)OCCO2 2344604802 RTAFMEMTMFEOAW-STQMWFEESA-N 263.337 2.053 10 10 CECE CO[C@@]12CC[C@H]1CN(c1ccc(CN)c(SC)c1)C2 2353852053 QTEXNYVNWKYVPB-SWLSCSKDSA-N 278.421 2.482 10 10 CECE N[C@@H]1C[C@@H]2C[C@H]1C[C@]2(O)c1ccc(N2CCCC2)cc1 2354670254 ACSQWETTXUJHOD-SDNTUTLCSA-N 272.392 2.232 10 10 CECE CCN(CC)c1ccc([C@]2(O)C[C@@H]3C[C@H]2C[C@H]3N)cc1 2354675054 RNECOEFHSZAEGF-GUDXXQAFSA-N 274.408 2.478 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@H]1C[C@@H]2CNC[C@@H]21 2355448404 DYBTZNPHOCVXIF-BSWAZPDLSA-N 272.392 2.176 10 10 CECE CC[C@H](C)NC(=O)[C@@H](C)NCc1cnc(SC)s1 2208472661 CZEGSHXTRUIRTC-DTWKUNHWSA-N 287.454 2.258 10 10 CECE CC(C)C1=NN2C(=N)/C(=C\c3ccncc3)C(=O)N=C2S1 102465472 VRWGGROYXZPZMW-QMWDNBGHSA-N 299.359 2.357 10 10 CECE 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CC(=O)c1cc(Cl)cc(CN2C[C@H](O)C3(CC3)C2)c1O 372297722 VYRATXHZBRXDKL-ZDUSSCGKSA-N 295.766 2.205 10 10 CECE COc1ccccc1CC(=O)N(C)Cc1ccc(N)cc1 35360067 XOLKWYCDWUPSTK-UHFFFAOYSA-N 284.359 2.479 10 10 CECE Cc1c(F)cc(C(N)=O)cc1NCc1cccc(O)c1O 41117450 WNOFXNIVISPOHB-UHFFFAOYSA-N 290.294 2.256 10 10 CECE Nc1ccc(OCCC(=O)Nc2ccc(CO)cc2)cc1 138967837 MCGCBVSXQGPQFF-UHFFFAOYSA-N 286.331 2.169 10 10 CECE CCCN(CC(=O)NC)c1ccc(CNC)c(Cl)c1 233038691 IAJVOWYHAXGCKG-UHFFFAOYSA-N 283.803 2.022 10 10 CECE CC1=NN(C(N)=S)C(=O)[C@H]1N=Nc1ccc(C)cc1C 252460478 FSOGLFMMOPZSSF-NSHDSACASA-N 289.364 2.217 10 10 CECE aggregator CC1=NNC(=O)[C@@H]1N=Nc1cc(-c2ccccc2)n[nH]1 252622975 OGYFPVGLDLNTJC-GFCCVEGCSA-N 268.280 2.035 10 10 CECE OC[C@@H](F)C1CN(c2ccc(CNC3CC3)c(Cl)c2)C1 2166907683 BZIBMPFPCDPKCQ-OAHLLOKOSA-N 298.789 2.359 10 10 CECE CCNC(=O)[C@H]1CCCN1c1ccc([C@H](C)NC)cc1 2169609293 PVBPAMIDIGEUOY-SWLSCSKDSA-N 275.396 2.072 10 10 CECE OC[C@@H]1CCC[C@H](c2cccc(Br)c2O)N1 713812563 LVINKDMMPADNBH-GZMMTYOYSA-N 286.169 2.330 10 10 CECE CO[C@@H]1CC[C@H]1NCc1c(O)cccc1Br 724197448 JIQHPGHSEYORBR-ZYHUDNBSSA-N 286.169 2.422 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H]2CCCCN2CCO)c1 834849864 GXADWZNCPJBIPG-LSDHHAIUSA-N 292.423 2.198 10 10 CECE COC[C@@](C)(O)CCN[C@@H](C)c1ccc(C)c(C)c1O 834844708 UFGCVLNZOVFEGK-BBRMVZONSA-N 281.396 2.447 10 10 CECE C[C@H](C[S@@](C)=O)N(C)C/C=C\c1ccc(N(C)C)cc1 835047268 FBHKTHQIYNADRF-HSUXVVMDSA-N 294.464 2.465 10 10 CECE CC[C@@](C)(CO)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 847761468 SDSFBXOCJXUCIU-WBMJQRKESA-N 278.396 2.338 10 10 CECE CC(C)c1nn(C)cc1C(=O)NCc1c(O)cccc1F 928710339 BTWWHYBHJZFGHQ-UHFFFAOYSA-N 291.326 2.318 10 10 CECE C[C@H](N[C@H]1C[C@@H](C)n2ncnc21)c1ccc(F)cc1O 850499711 VUHAXVKXIJVWJF-PTRXPTGYSA-N 276.315 2.479 10 10 CECE O=C(NCC(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1cc(O)cs1 926934574 GZQQYBQEYDDMHL-QXEWZRGKSA-N 279.361 2.189 10 10 CECE C[C@@H](NC1CCC(C(N)=O)CC1)c1cc(F)cc(F)c1O 756707235 XCEWXJJLMOJHBC-FKTRJACZSA-N 298.333 2.365 10 10 CECE C[C@@H](CC(=O)NCc1ccc(N)cc1)[C@H]1CCCO1 850711157 LGDOFFKTTZEPDE-SMDDNHRTSA-N 262.353 2.090 10 10 CECE COc1ccc(CN2CCO[C@H](C(F)(F)F)C2)c(O)c1 698966625 CIAUIJURQCAEBY-LBPRGKRZSA-N 291.269 2.164 10 10 CECE COc1cc(C)cc(CN2CCO[C@H](C3CC3)C2)c1O 776770780 CEAMEOORDNILKS-HNNXBMFYSA-N 277.364 2.320 10 10 CECE COC[C@](C)(CN[C@@H](C)c1cc(C)ccc1O)OC 1895307618 GZJDTRBYVPRSPF-WFASDCNBSA-N 267.369 2.403 10 10 CECE O=C(N[C@H](C1CCC1)[C@H]1CCOC1)c1cccc(O)c1O 871304036 XPPZILUNGLTWBE-SMDDNHRTSA-N 291.347 2.033 10 10 CECE C[C@H](c1ccccc1O)N(C)C[C@@H](C(=N)N)C1CC1 1877529296 PJVVEXNYLHYVEG-ZWNOBZJWSA-N 261.369 2.347 10 10 CECE CN(CCc1ccc(N)cc1)CC12CC(C)(CO1)C2 1879896687 VBBLOJBCQOZDTK-UHFFFAOYSA-N 260.381 2.312 10 10 CECE Cc1ccc([C@@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)c(O)c1 797070863 NFVGBHOYDRCUAN-VXGBXAGGSA-N 297.420 2.317 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)C[C@@H]2CCOC2)c(F)c1 1880480276 UUJYUGZTEZZEES-ZJUUUORDSA-N 271.307 2.491 10 10 CECE C[C@H]1CC[C@@](CO)(NCc2ccc(N(C)C)cc2)C1 1880892769 ZNMFKOIEKKXWFJ-XJKSGUPXSA-N 262.397 2.393 10 10 CECE C[C@@H]1C[C@H](O)CCN1c1ccc2c(c1)OCCCO2 1149635277 OQEBJLQGCZFJPH-DGCLKSJQSA-N 263.337 2.198 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)c2ccns2)c1 1150543307 KYGLZPGRUCKFTO-MRVPVSSYSA-N 278.333 2.348 10 10 CECE CN1CCc2cc(C(=O)NCc3cccc(O)c3O)ccc21 1303194818 KPYGUMVKHROVLY-UHFFFAOYSA-N 298.342 2.020 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cccc3c2OCO3)c1 1301046709 ICOPKYAPOYDKMB-UHFFFAOYSA-N 285.299 2.359 10 10 CECE C[C@](O)(CNCc1ccc2c(c1)CCCO2)C(F)F 1962995297 JAKOZFZITYKENZ-AWEZNQCLSA-N 271.307 2.117 10 10 CECE Cc1cc(C(C)(C)C)cc(C)c1C(=O)C(=O)C(=O)O 76353180 RNPOVHBXZNVKSX-UHFFFAOYSA-N 262.305 2.437 10 10 CECE CNCC1CCN(c2ccc(OC)cc2OC)CC1 84639292 MWVBCKPRZAAPPF-UHFFFAOYSA-N 264.369 2.140 10 10 CECE O=C(O)C[C@H]1CCCN(c2ccc3c(c2)OCO3)C1 84628424 XRDCILSNOXPDSS-SNVBAGLBSA-N 263.293 2.106 10 10 CECE CC(=O)c1sc([C@H](N)c2cc(O)ccc2O)nc1C 83585771 AGRHYDGZNUOGGT-LLVKDONJSA-N 278.333 2.113 10 10 CECE C[C@@H]1CN(Cc2ccc(N)cc2)[C@@H](C)C[C@@H]1C(=O)O 1891505560 FJEGIJWYESKNBF-SUNKGSAMSA-N 262.353 2.200 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1cc(C2CC2)on1 701281333 NJGSVMMCRLETJJ-SECBINFHSA-N 261.285 2.467 10 10 CECE Nc1ccc(N2CCN(CCCC(F)F)CC2)cc1 701448661 ZQWPCSDXKVXUEJ-UHFFFAOYSA-N 269.339 2.436 10 10 CECE C[C@H](Cc1nccn1C)N[C@H](C)c1ccccc1O 1964488555 JRSPZIDENAAALN-VXGBXAGGSA-N 259.353 2.408 10 10 CECE CO[C@H]1CN(Cc2cccc(F)c2O)CC[C@H]1C 275924646 GTKRUNZLMBSXAH-MFKMUULPSA-N 253.317 2.388 10 10 CECE C[C@@](NCCN=[N+]=[N-])(C(=O)O)c1cc(F)cc(F)c1 94828142 DTJKTVZBENHVMT-NSHDSACASA-N 270.239 2.165 10 10 CECE CN1CCCc2cc(CNC[C@@]3(O)CCSC3)ccc21 702310863 XHOQVVPDPIOCGI-INIZCTEOSA-N 292.448 2.027 10 10 CECE Oc1c(CN[C@@H]2CCN3CCCC[C@@H]23)ccc(F)c1F 703347416 JDEOFRJPUPBLHS-OLZOCXBDSA-N 282.334 2.387 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](CO)CC[C@@H]2C)c(F)c1 688727629 BZOCBQPFDUVVJX-SRVKXCTJSA-N 267.344 2.476 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2cn(C)nn2)cc1Cl 689241102 ZOWTUURCHBBPTD-SECBINFHSA-N 279.775 2.125 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cnc(Cl)c(Cl)c1 706304284 WCALJBNCJBMSJJ-UHFFFAOYSA-N 260.084 2.429 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)c1ccc2c[nH]nc2c1 692829931 MCTQGQCTEDRHQB-LLVKDONJSA-N 270.296 2.478 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](C)[C@@H](CO)C2)c(Cl)c1 708754228 GYOBNELOXHDGRP-JBLDHEPKSA-N 269.772 2.458 10 10 CECE C[C@H](c1cc(F)ccc1O)N(CCN)CC(F)(F)F 713335770 KTWBUKIFVICAEI-MRVPVSSYSA-N 280.265 2.415 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCCC4(CC4)C3)ccc21 695070416 PUMDQKNSCBBZNM-ZDUSSCGKSA-N 257.337 2.019 10 10 CECE CC[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(O)cc1O 699524907 ILPKDNIQDJPBIT-OPQQBVKSSA-N 251.326 2.173 10 10 CECE COc1ccc(N2C[C@@H](C3CC3)NC[C@@H]2C)cc1OC 86179635 HDSZSFOCBJJXSR-FZMZJTMJSA-N 276.380 2.281 10 10 CECE CCN(C[C@@H]1C[C@H]1C)c1ccc2c(c1)NC(=O)[C@@H]2O 698395081 DQHGNBMZRVBXFC-ISTVAULSSA-N 260.337 2.154 10 10 CECE Nc1ccc(CCC(=O)N2CC[C@H]2C(F)(F)F)cc1 1916139546 TZZVWMXQIKFVGB-NSHDSACASA-N 272.270 2.365 10 10 CECE Nc1ccc(CN2CCC(N3CC=CC3)CC2)cc1 2115211533 CCKKDTANVCOPQM-UHFFFAOYSA-N 257.381 2.105 10 10 CECE CCNCc1ccc(N2CCO[C@H](CF)C2)c(F)c1 2115423251 PEASJJFWEVELFS-GFCCVEGCSA-N 270.323 2.110 10 10 CECE CN(C)c1ccc([C@@]2(O)CCC[C@@H](N)C2(C)C)cc1 2116391006 JAUSIQQVFIRMKC-ZBFHGGJFSA-N 262.397 2.478 10 10 CECE CN1CCc2cc([C@@H](N)C3(C)CCOCC3)ccc21 2117346298 FLWAMBOGHBFYGZ-OAHLLOKOSA-N 260.381 2.495 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)N1CC(Cc2ccco2)C1 1453412421 NMEXEMNPOLEHRV-GQCTYLIASA-N 299.326 2.405 10 10 CECE C[C@H](N[C@H](C)[C@@H]1C[C@@H]1C(=O)O)c1ccc(F)cc1O 2118312880 FLAQVKSAKKAJSD-VVJJBPBLSA-N 267.300 2.291 10 10 CECE CC(C)(C)OC(=O)N[C@H](CN)c1cccc(F)c1O 1535930136 UWVGZGMRPMXJDG-SNVBAGLBSA-N 270.304 2.056 10 10 CECE CCOc1cccc([C@H](C(=O)O)N2CCCCC2)c1O 211614684 LHDVXWPPCDRYRP-CYBMUJFWSA-N 279.336 2.403 10 10 CECE CCN[C@]1(C(N)=O)CCC[C@@H](Sc2nccs2)[C@@H]1C 2119207423 SPHOEKQQBYFLCJ-OPQQBVKSSA-N 299.465 2.257 10 10 CECE CCNCc1ccc(N2C[C@H](F)[C@@H](CO)C2)c(Cl)c1 2120632399 VSZXBDAPNINARY-YPMHNXCESA-N 286.778 2.216 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2ccc3nsnc3c2)C1 2120714266 OCQHTCDRBNOAOM-QMMMGPOBSA-N 274.309 2.216 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@H](O)c1cnco1 2121350205 KDGXMKQPZMJGIJ-UONOGXRCSA-N 262.309 2.155 10 10 CECE CCc1[nH]nc(Cl)c1C(=O)NCc1c(O)cccc1F 1558454781 MDLYBPSNXHSBMM-UHFFFAOYSA-N 297.717 2.400 10 10 CECE C[C@@H]1CCCCN1C(=O)CN1CCC[C@@H]1CN=[N+]=[N-] 2123013856 CEUCBDJXKMLNLP-VXGBXAGGSA-N 265.361 2.162 10 10 CECE NCc1ccc(N2C[C@@H]3COCC[C@@H]32)c(Br)c1 1909728089 JTSRBHLWPIBSAM-PWSUYJOCSA-N 297.196 2.133 10 10 CECE Cc1ccc(O)c(C(=O)NCc2c(O)cccc2F)c1 1635360148 AZQPKNMHEOTHGT-UHFFFAOYSA-N 275.279 2.475 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1coc2cc(O)ccc12 1630273876 WGDFVWPXUNYWBP-UHFFFAOYSA-N 299.282 2.480 10 10 CECE CN(C)c1ccc(OCC2(F)CCNCC2)cc1 2221880904 ZKIXGEKLMWAKCD-UHFFFAOYSA-N 252.333 2.223 10 10 CECE CCC(C)(C)OC1CN(C(=O)Cc2ccc(O)c(O)c2)C1 1640618557 QCWPFNDJCPMJIU-UHFFFAOYSA-N 293.363 2.056 10 10 CECE C[C@]1(C(=O)N2CCCC[C@@H](CN=[N+]=[N-])C2)CCCO1 1912175108 IEFYTYYVAUPTMF-WCQYABFASA-N 266.345 2.495 10 10 CECE CC(C)(C)NS(=O)(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 1912158385 WZQMWOCVNWUWSX-SNVBAGLBSA-N 289.405 2.032 10 10 CECE COc1ccc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])nc1 1912166395 WTTKYOROKINTPL-SECBINFHSA-N 261.285 2.005 10 10 CECE C[C@@H](N[C@H](C)c1nccn1C)c1c(O)cccc1O 2125222410 GUFBWCNILKNCEB-NXEZZACHSA-N 261.325 2.243 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cccn2CC(F)(F)F)C1 1912191186 OFESYNOIVJLADX-UHFFFAOYSA-N 273.218 2.185 10 10 CECE CN(C)CCN(C)c1ccc(C=CC(=O)O)cc1Cl 1911862853 OCTVZPRYGBEMOZ-UHFFFAOYSA-N 282.771 2.436 10 10 CECE O=C(NCc1c(O)cccc1F)c1ocnc1C(F)F 1652297940 CFTSFJBZGKHPSX-UHFFFAOYSA-N 286.209 2.387 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3[C@H](CO)[C@@H]3C2)cc1 2125606228 QWJFAEVWMLTZLW-BQDHKBFISA-N 260.381 2.032 10 10 CECE C[C@@H](C(=O)NC1CCCC1)N1CCC[C@@H](CN=[N+]=[N-])C1 1912202661 KSVJWHYWCGGMPW-RYUDHWBXSA-N 279.388 2.456 10 10 CECE CO[C@@H](CN1CCC(CN=[N+]=[N-])CC1)[C@H]1CCCOC1 1912204192 JEQBRCWTZLKXOT-KBPBESRZSA-N 282.388 2.450 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)CC[C@H]2CCCO2)C1 1912207574 XKRQKEMZRZLMTN-GHMZBOCLSA-N 252.318 2.104 10 10 CECE Cc1ccc(S(=O)(=O)N2CCC(N=[N+]=[N-])CC2)o1 1912149308 DWRXNIDTRGYGSL-UHFFFAOYSA-N 270.314 2.051 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CC(=O)NCC(F)(F)F)C1 1912159042 CCFUYIPWFWEEHR-SECBINFHSA-N 293.293 2.077 10 10 CECE CCC(C)(C)NC(=O)[C@H](C)OCc1ccc(N)cc1 20390908 PUEKFJOHDNJPNN-NSHDSACASA-N 264.369 2.479 10 10 CECE Nc1ccc(CN[C@H]2C[C@@H](Cn3cccn3)C2)cc1 2128372886 LUXJYZPNMHNDPR-OTVXOJSOSA-N 256.353 2.034 10 10 CECE C[C@H](O)CN(c1ccc2c(c1)CCC[C@@H]2N)C1CC1 2128273211 VFCJFXMVBAPHRW-ZBEGNZNMSA-N 260.381 2.372 10 10 CECE N[C@@H]1CCc2cc(N3CCO[C@@H](CCF)C3)ccc21 2128294576 LDLDKJQFYLXORA-DZGCQCFKSA-N 264.344 2.197 10 10 CECE CC(F)(F)[C@H](N)[C@H](O)c1ccc(N2CCCC2)cc1 2128395431 ZUPWCZGHRRAFFJ-CHWSQXEVSA-N 270.323 2.303 10 10 CECE C[C@@]1(C(=O)NCc2c(O)ccc3c2CCCC3)CCCO1 150966707 QPDKVWXKZIXUMQ-KRWDZBQOSA-N 289.375 2.456 10 10 CECE Clc1cc(CNC2CC2)ccc1N1CCOCC1 163935729 LITLBPBAHOYXQD-UHFFFAOYSA-N 266.772 2.429 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2CCCCS2)cc1 157892958 SPRSQZCIBCJLNL-CYBMUJFWSA-N 264.394 2.213 10 10 CECE COc1ccc(N2CC[C@@H](C)N[C@H](C)C2)c(OC)c1 251814655 ZDQQHVJJXYCOHO-VXGBXAGGSA-N 264.369 2.281 10 10 CECE CC1(C)CC[C@@H](O)CN1c1ccc2c(c1)OCCO2 259503323 TXZJUUZOONJYPF-GFCCVEGCSA-N 263.337 2.198 10 10 CECE CN(C[C@H]1CCN1C)c1ccc2c(c1)CCC[C@@H]2O 2129904952 NBUPMNKOWDKSOA-ZBFHGGJFSA-N 260.381 2.197 10 10 CECE CCNCc1ccc(OC[C@H]2COC(=O)C2)c(C)c1 2131149469 KXTWLQZTPKFASC-ZDUSSCGKSA-N 263.337 2.046 10 10 CECE CNCc1ccc(N2CC[C@H](O)[C@@H]3CC[C@H]32)cc1Cl 2133732766 USWKJQNEDZDWDD-YUELXQCFSA-N 280.799 2.409 10 10 CECE Cc1ccc(O)c(CNCC(=O)N(C)c2ccccc2)c1 1857857380 FMCIUHQRKRAGOO-UHFFFAOYSA-N 284.359 2.453 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134554372 CDFCPLXQVNJUOO-WCDYYPSBSA-N 256.349 2.129 10 10 CECE CO[C@H]1CCN(Cc2ccc(Cl)cc2O)C[C@@H]1OC 2134860380 QODFLUSGAFOMTF-KBPBESRZSA-N 285.771 2.281 10 10 CECE COC[C@](Sc1nccs1)(C(=O)O)C(C)C 1904756129 BAILLYRKQMULLX-SNVBAGLBSA-N 261.368 2.361 10 10 CECE OCc1ccc(N2C[C@H](CO)C3(CCC3)C2)c(Cl)c1 1914529189 PALIMJXCDVGREJ-GFCCVEGCSA-N 281.783 2.431 10 10 CECE CNCc1ccc(N2CC(F)(C3CC3)C2)cc1OC 2139705366 YLHQQPXCOFPAPX-UHFFFAOYSA-N 264.344 2.353 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1 1917483975 MNXGGNFDAFEQJQ-CSOUEMRRSA-N 270.376 2.362 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC=CC[C@H]2C(=O)O)c1 2136360967 ARPNFWYPTRUPLE-YPMHNXCESA-N 261.321 2.477 10 10 CECE CC[C@@H]1CN([C@@H](C)c2cc(O)ccc2O)CC[C@H]1N 251936004 ZSVRZSBBGYHYDK-MISXGVKJSA-N 264.369 2.218 10 10 CECE Cc1ncnc(CNCc2cccc(F)c2O)c1C 2141692125 AIUPIPCDGUDMFF-UHFFFAOYSA-N 261.300 2.228 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCN(CC(F)F)CC1 1923105111 XNYCDYVPFYAGJV-SNVBAGLBSA-N 288.313 2.475 10 10 CECE CN[C@@H](C)c1ccc(N2CCC(NC(C)=O)CC2)cc1 228280711 FHDVAKWPBRKVMS-LBPRGKRZSA-N 275.396 2.072 10 10 CECE CC(C)(C)[C@H](CO)CNCc1cc(F)ccc1O 1967699943 SJCBPPDLBPLWNO-NSHDSACASA-N 255.333 2.276 10 10 CECE COc1ccc(CN[C@H](C)[C@@H]2C[C@@H]3CCO[C@H]23)c(O)c1 1926219768 RPLSSIMXQCODJY-AZLWOZFGSA-N 277.364 2.304 10 10 CECE C[C@H](NCc1cccc(F)c1O)[C@@H]1C[C@@H]2CCO[C@H]12 1926222167 INGYSGKPFDWXMP-OUCVZQCGSA-N 265.328 2.434 10 10 CECE COC[C@@](C)(CO)CN[C@H](C)c1ccc(N(C)C)cc1 1926959956 PPPSCEWRSIVWHZ-CZUORRHYSA-N 280.412 2.048 10 10 CECE COc1ccc(O)c(CN[C@H](C)CCCCCO)c1 1969749108 LJBUDQUFPAUFAM-GFCCVEGCSA-N 267.369 2.432 10 10 CECE C[C@H](N)CC1CCN(Cc2ccc(O)c(O)c2)CC1 2138736815 LUAYPWCSPGFXEL-NSHDSACASA-N 264.369 2.047 10 10 CECE Cc1cc(N2CCCC[C@H]2C2OCCO2)ccc1CN 1941975726 YAOZTMBVHJGMKD-HNNXBMFYSA-N 276.380 2.186 10 10 CECE Cc1csc([C@@H](N)[C@@H](O)c2ccc3c(c2)CCN3C)n1 2147837944 UADJVQRVJPTRHQ-KBPBESRZSA-N 289.404 2.177 10 10 CECE Nc1ccc(O)c(CN2CCS[C@H]3CC[C@H]32)c1 1946793301 MJOYJSWTUZJGNI-YPMHNXCESA-N 250.367 2.054 10 10 CECE COC[C@@]1(OC)CCN(c2ccc([C@@H](C)O)cc2F)C1 2151844497 VHPIKIUMNHGXTJ-IAQYHMDHSA-N 283.343 2.121 10 10 CECE COc1cc(OC)c2c(c1)C(=CC(=O)O)CCN2C 1951313269 PMYMGIARWSMJEG-UHFFFAOYSA-N 263.293 2.012 10 10 CECE COC(=O)c1ccc([C@@H](CO)N=[N+]=[N-])cc1Cl 1951795631 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Cc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 243199253 KEABNGCDVAECEP-UHFFFAOYSA-N 271.316 2.265 10 10 CECE O=C(O)CCc1c(Br)cc(O)c(O)c1F 258538046 JDLGGUBUDIGRCZ-UHFFFAOYSA-N 279.061 2.017 10 10 CECE Cc1cc(N(C)C[C@H]2CCN(C)C2)ccc1/C=C\C(=O)O 252452265 ZIXAXHKZOJQQQU-VSKVDJIOSA-N 288.391 2.481 10 10 CECE COc1ccc(O)c(CNCC2(O)Cc3ccccc3C2)c1 362042634 UPLNBXVKHCHGBY-UHFFFAOYSA-N 299.370 2.020 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@H]1C[C@@H]2C[C@@H]2C1 700036473 JCBYUCNDMYRVGE-USZNOCQGSA-N 266.345 2.254 10 10 CECE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(F)cn1 808094252 HOIDPDINEWETSE-UHFFFAOYSA-N 295.310 2.342 10 10 CECE Cc1c(CC(=O)CCc2ccc(N)cc2)cnn1C 708564404 KFUNVFRVLBTMCO-UHFFFAOYSA-N 257.337 2.055 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@@H](C4)[C@H]3C2=O)c(Cl)c1 2166998285 ZEYYQPYAUDTPFP-PTYMLPSESA-N 288.734 2.234 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H]4CNC[C@H]4C3(C)C)ccc2O1 2162637175 NRWMVYSYMUWHBG-UXIGCNINSA-N 272.392 2.444 10 10 CECE CN1CCN(c2ccc(CNC3(C(F)F)CC3)cc2)CC1 800311721 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CC[C@H](COCC1CC1)NC(=O)NCc1ccccc1O 852464662 RXMQRMUQYOJALZ-CQSZACIVSA-N 292.379 2.397 10 10 CECE O=C(NCc1c(O)cccc1F)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 928711034 ZFHQROSUVWPJFJ-YBXAARCKSA-N 275.323 2.440 10 10 CECE COc1ccc(N2CCO[C@H](C(F)(F)F)C2)c(N)c1 698736722 PDDFMVVRGFPBFN-NSHDSACASA-N 276.258 2.045 10 10 CECE CC[C@@H](C)[C@H](OC)C(=O)NCc1c(O)cccc1F 928708709 RIVYJGBHVUUFGW-RNCFNFMXSA-N 269.316 2.209 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)/C=C/SC)C2)cc1 855232959 CUIFVTLQWIJFJR-ZJNQMXKESA-N 292.404 2.267 10 10 CECE CSCCC(=O)NCc1ccc2cccnc2c1O 862028569 DDTVQTFOJHZNJA-UHFFFAOYSA-N 276.361 2.310 10 10 CECE COC[C@@]1(F)CCN(Cc2cc(F)cc(F)c2O)C1 1875795061 HUPDLNMFRHESHJ-CYBMUJFWSA-N 275.270 2.231 10 10 CECE O=C(NC1(CO)CCCCCCC1)c1cccc(O)c1O 871403366 YQXFTUDUVBVZFE-UHFFFAOYSA-N 293.363 2.303 10 10 CECE O=C(N[C@@H]1CC[C@H]1C1CCC1)c1cccc(O)c1O 1876627620 HUUJWFCNGXVXNJ-CMPLNLGQSA-N 261.321 2.406 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@@H]2CCN3CC[C@H]2C3)c1 1877892842 PTCWBTUYBIPIPG-VNHYZAJKSA-N 260.381 2.445 10 10 CECE COc1cc(C)cc(CN2CC[C@@H](C(C)(C)O)C2)c1O 895477318 HSTJYKZJMRRZER-CYBMUJFWSA-N 279.380 2.302 10 10 CECE COc1cc(C)cc(CN2CCC(N(C)C)CC2)c1O 893953332 CPCFLTTYPJYMMU-UHFFFAOYSA-N 278.396 2.235 10 10 CECE CNCc1ccc(N(C)C[C@]23C[C@](C)(CO2)C3)cc1 1879893357 HYXHUTYEUGOOGN-IYBDPMFKSA-N 260.381 2.411 10 10 CECE COC[C@H]1C=CCN1c1c(F)cc([C@H](C)O)cc1F 1880490109 NVUIGPPYYGUVCN-GXSJLCMTSA-N 269.291 2.409 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC[C@]3(CCO3)C2)c(F)c1 1880487033 QGTRVKPLWZLYMF-OTYXRUKQSA-N 269.291 2.387 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](CO)[C@@H]2C)c(F)c1 1880967609 CNTRFFZRLBFRMP-LPEHRKFASA-N 270.323 2.192 10 10 CECE COc1cc(O)c(CN2[C@@H](C)C[C@@H]2C)cc1OC 793221029 URPUPQBTGJRMAK-UWVGGRQHSA-N 251.326 2.392 10 10 CECE Cc1cc(=O)c(OCCCOc2ccc(N)cc2)co1 1776010320 LENMAERCFSLBRT-UHFFFAOYSA-N 275.304 2.378 10 10 CECE CCC[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-] 1885563020 OBFWFINYTOLFEK-JTQLQIEISA-N 299.375 2.354 10 10 CECE CCN(C(=O)OC(C)(C)C)[C@@H](C)CC(=O)NCCN=[N+]=[N-] 1885562591 HVBRTXAYWYUSCD-JTQLQIEISA-N 299.375 2.449 10 10 CECE CC[C@@H](O)CN(C)Cc1cc(Cl)cc(C(C)=O)c1O 1964194889 ZETNHBOXUQCJAP-GFCCVEGCSA-N 285.771 2.451 10 10 CECE Nc1ccc(OCCNC(=O)c2cc(Cl)ccn2)cc1 701337475 QYHQJYGHYZESKJ-UHFFFAOYSA-N 291.738 2.126 10 10 CECE COc1cc(C)cc([C@]2(C)COC(C)(C)CN2)c1O 83482203 DKMQCXWIBSOYPU-HNNXBMFYSA-N 265.353 2.323 10 10 CECE Cc1cccc([C@@H]2NCCc3c(O)ccc(O)c32)c1O 83657887 UJKDLZBYNNRREY-HNNXBMFYSA-N 271.316 2.347 10 10 CECE COc1ccc2c(c1O)[C@H](c1cncs1)NCC2 83708332 DPCLYKWIHZTYSJ-LBPRGKRZSA-N 262.334 2.092 10 10 CECE CC[C@@]1(C)CN(c2ccc(OC)c(F)c2)CCN1 86127634 WSSIDZAOAFGYHM-AWEZNQCLSA-N 252.333 2.413 10 10 CECE CCOC(=O)C[C@@](C)(NC)c1ccc(N(C)C)cc1 87547479 KDEWMXAWOQAPIL-OAHLLOKOSA-N 264.369 2.140 10 10 CECE Cc1cc(CO)ccc1N1CCC[C@@H](N2CCC2)C1 702281966 YOACVURKAWNXCA-OAHLLOKOSA-N 260.381 2.162 10 10 CECE C[C@@H](CNC(=O)Cc1ccc(N)cc1)OC(C)(C)C 1893212174 SJQVYJJWUMIZDE-NSHDSACASA-N 264.369 2.131 10 10 CECE C[C@@H]1CCCCN1CCCNCc1ccc(O)c(O)c1 19912963 BIKAOCNFNZIVEQ-CYBMUJFWSA-N 278.396 2.452 10 10 CECE C[C@H](Cc1nccn1C)N[C@H]1CCc2cccc(O)c21 1964489067 NWUPHKBLJKBDJJ-YPMHNXCESA-N 271.364 2.334 10 10 CECE COc1ccc([C@H](C)N2CCN(C)C[C@@H](C)C2)c(O)c1 707530069 MKWHBWQURVNUCC-OLZOCXBDSA-N 278.396 2.345 10 10 CECE CCN(Cc1cc(F)cc(F)c1O)CC(C)(C)CN 708494016 CKUOCNAGGRGMNI-UHFFFAOYSA-N 272.339 2.477 10 10 CECE Oc1c(F)cc(F)cc1CN[C@H]1CO[C@@H](C2CC2)C1 708516736 KXDXYFNGQSPQJT-DGCLKSJQSA-N 269.291 2.328 10 10 CECE Oc1cccc(Cl)c1CN1C[C@H]2CC[C@H]1[C@H]1CNC[C@H]21 709965163 RYLOJNCAJBHWSZ-FJJYHAOUSA-N 292.810 2.475 10 10 CECE COc1cc(N)c(N(C)[C@H](CO)C(C)(C)C)cc1OC 690114918 LOGPJKQBKVWDGV-CQSZACIVSA-N 282.384 2.129 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)S(=O)(=O)CC(C)(C)C 718842709 MEEHAMKNEFTOHT-JTQLQIEISA-N 298.408 2.057 10 10 CECE COC[C@H](C)Oc1ccc(N2CCCNCC2)cc1C 70378410 FHFVTRKTGPQKNK-AWEZNQCLSA-N 278.396 2.208 10 10 CECE CC[C@H]1CN[C@H](CC)CN1Cc1ccc(O)cc1O 86445291 WGCCKUYZLWYCTH-OLZOCXBDSA-N 264.369 2.060 10 10 CECE COc1ccc(N(C)Cc2cncc(OC)n2)cc1 1331395355 CDTZMXHOMRWOQT-UHFFFAOYSA-N 259.309 2.130 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@]12CO[C@](C)(C1)C2 2202641109 FEVPTHOJJOFTTA-UVBJJODRSA-N 275.348 2.481 10 10 CECE Cc1nc2c(C(=O)N[C@@H](C)c3ccccc3O)ccnc2[nH]1 1454826021 TULKQMXNPHHJAE-VIFPVBQESA-N 296.330 2.463 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H]3C[C@@H]3[C@@H]3C[C@@H]32)c1 2117416256 HYDKVFQZAJGUNA-MXAVVETBSA-N 257.333 2.435 10 10 CECE CN1CCCc2cc3c(cc21)[C@H](C(=O)O)CCCO3 211909889 DCTWVTKYTUFEPF-LLVKDONJSA-N 261.321 2.410 10 10 CECE O=C(N[C@H]1CC[C@@H](CF)CC1)c1cccc(O)c1O 2118444808 XZWRZCBQCIRUAN-AOOOYVTPSA-N 267.300 2.356 10 10 CECE CC(C)NCc1ccc(N2CC=C[C@H]2CO)c(F)c1 2119811516 FUNJVTQFYCHCAX-ZDUSSCGKSA-N 264.344 2.061 10 10 CECE CNCc1ccc(N(C)C[C@@H]2[C@@H]3CCO[C@@H]32)c(C)c1 2119934260 OFZPYXUBGNJAGW-LZWOXQAQSA-N 260.381 2.186 10 10 CECE C[C@H](N[C@H]1C=C[C@@H](CO)C1)c1ccc(N(C)C)cc1 1614570547 KDDUJILODJNLKR-GUTXKFCHSA-N 260.381 2.340 10 10 CECE C[C@]1(C(F)F)C[C@@H]1CNC(=O)c1cccc(O)c1O 2120899811 QOJBGZPAGATXPU-UHLUBPPHSA-N 271.263 2.119 10 10 CECE CC[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1 1624363117 GYZIJJQMHOAEKG-NSHDSACASA-N 263.337 2.289 10 10 CECE CC(=O)Nc1nc(CN2CCC[C@H]2CN=[N+]=[N-])cs1 2123016122 UKYAIBHVQHQVIU-JTQLQIEISA-N 280.357 2.376 10 10 CECE O=C(NCc1cc(Cl)ccc1O)c1ncccc1O 1632229095 ZMAMSJDVNZSJEW-UHFFFAOYSA-N 278.695 2.076 10 10 CECE Cc1ccnc([C@H](C)NC(=O)/C=C\c2ccc(O)c(O)c2)n1 1638383020 VHDQDOCCZMTQSU-QZPNVGJNSA-N 299.330 2.087 10 10 CECE CN(Cc1ccccc1O)C(=O)c1cccn2nccc12 1635658356 RNGLGZQWPXZZGV-UHFFFAOYSA-N 281.315 2.312 10 10 CECE CO[C@@H]1[C@@H](NCc2cc(Cl)ccc2O)COC1(C)C 1911070877 ANRDATLHVSOZSI-WCQYABFASA-N 285.771 2.328 10 10 CECE COc1ccc(N2C[C@@]3(C)CC[C@@]2(CO)C3)c(N)c1 1911504352 PXWIBGLHEUJMQC-GJZGRUSLSA-N 262.353 2.019 10 10 CECE O=C(NCC[C@]12CCC[C@@H]1C2)c1cccc(O)c1O 2125610917 XAXHXTBRAJTIEC-BMIGLBTASA-N 261.321 2.408 10 10 CECE [N-]=[N+]=NC1CCN([C@@H]2CCO[C@@]3(CCOC3)C2)CC1 1912171321 JCYQUWQOWUORNB-OLZOCXBDSA-N 266.345 2.099 10 10 CECE CC[C@](CCC(F)(F)F)(NCCCN=[N+]=[N-])C(N)=O 1912199125 OULMMHXWUHQIID-SECBINFHSA-N 281.282 2.253 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)C2[C@H]3CCCC[C@H]23)C1 1912210337 IDWCJHNTRRZMMK-VWYCJHECSA-N 284.385 2.280 10 10 CECE Nc1ccc(O)c(CNC(=O)C[C@@]23CCC[C@@H]2C3)c1 2125588431 WQSAPJYHCRBVAY-ABAIWWIYSA-N 260.337 2.171 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCC12CC(CN)C2 2125785622 AGRSYELGFNLAJK-RWWNRMGGSA-N 264.344 2.406 10 10 CECE O=S(=O)(O)c1ccc(/N=N/c2ccc(O)cn2)cc1 5331343 FBIBTUJHMONIDH-BUHFOSPRSA-N 279.277 2.449 10 10 CECE N[C@@H]1CCCc2cc(N3CCC=C[C@@H]3CO)ccc21 2128272454 HDUZJEHXXSYWGY-GDBMZVCRSA-N 258.365 2.150 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@H](O)C3(C)C)ccc21 2128315713 VPFVHPPNVAPRRD-LSDHHAIUSA-N 260.381 2.243 10 10 CECE C[C@]1(CO)CCCCN1c1ccc2c(c1)CC[C@H]2N 2128309009 MSVVCFRPHCRZHE-HZPDHXFCSA-N 260.381 2.374 10 10 CECE CNCc1ccc(N2CCC[C@H](CO)C2)c(Cl)c1 163977135 WLYONAVVFQZMOL-LBPRGKRZSA-N 268.788 2.268 10 10 CECE CCCNCc1ccc(N2C[C@H](CO)OC[C@@H]2C)c(C)c1 167309514 ILTVVPPIBGLPOA-GOEBONIOSA-N 292.423 2.081 10 10 CECE CCC[C@@H](O)CN[C@H](C)c1ccc(OC)cc1O 168771056 OQMIZZKKUWVFQX-GHMZBOCLSA-N 253.342 2.212 10 10 CECE C[C@@H]1COCCN1c1ccc(/C=C\C(=O)O)cc1F 209038953 WGGUUFYWACKNSX-TZGMSPROSA-N 265.284 2.149 10 10 CECE C[C@@]1(CCO)CCN(c2ccc3c(c2)CC[C@H]3O)C1 2131898157 CHYGTTXIWOKLDW-CVEARBPZSA-N 261.365 2.265 10 10 CECE CC[C@@H](C(=O)Nc1ccc(N)cc1)n1cccc(C)c1=O 33512768 FPBVKSMELCEGGX-AWEZNQCLSA-N 285.347 2.329 10 10 CECE Cc1cc(CO)ccc1N1CCC[C@@]2(CC[C@H]2O)C1 2129552434 NTPGHDSVGRFQMC-HZPDHXFCSA-N 261.365 2.229 10 10 CECE CC1(C)OCCC[C@@H]1CNCc1ccc(O)c(O)c1 2130457794 KCZOJODCKAWJOS-GFCCVEGCSA-N 265.353 2.393 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H](C3(O)CC3)C2)cc1 2130503568 OJMGDOXNXWOSDP-JSGCOSHPSA-N 260.381 2.448 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2COCC2(F)F)c1 2131099579 DORMMGCLWVMINW-UFBFGSQYSA-N 273.279 2.086 10 10 CECE Oc1cccc(CNc2ccc3cncn3c2)c1O 2131240521 BTXDTAHKIQWFFF-UHFFFAOYSA-N 255.277 2.358 10 10 CECE CO[C@@H](CNCc1cc(Cl)ccc1O)[C@@H]1CCOC1 850344530 LSQGPMCNULBLMC-YGRLFVJLSA-N 285.771 2.187 10 10 CECE Cc1ccc(CN(C)Cc2ccccc2O)c(N)n1 1143207756 DTXUYODJJYRYEI-UHFFFAOYSA-N 257.337 2.310 10 10 CECE CN(C)c1ccc([C@H]2CC[C@@H](CC(=O)O)CN2)cc1 2138642372 MAUXLMNTZMHKSN-SMDDNHRTSA-N 262.353 2.268 10 10 CECE CCc1nc([C@H](N)c2ccc(N(C)C)cc2)cn1C 1913460117 QVITYOGAHNESAH-OAHLLOKOSA-N 258.369 2.097 10 10 CECE Oc1c(CNCC[C@@H]2CCC[C@H]2O)ccc(F)c1F 1913719017 RYBFRYIVPKZZAE-JOYOIKCWSA-N 271.307 2.311 10 10 CECE CO[C@@H]1CCN(c2c(F)cc(CO)cc2F)[C@@H]1C 1914235155 APJDEKJEGDLMTJ-PRHODGIISA-N 257.280 2.071 10 10 CECE CN(Cc1ccc(N)cc1)c1ccc(F)cc1C(N)=O 111027801 NYTWVBDFJDNPEI-UHFFFAOYSA-N 273.311 2.143 10 10 CECE Cc1ccc([C@H](C)NC(=O)c2ccc(O)c(O)c2)o1 226954721 PHWGFORNXZEWIM-VIFPVBQESA-N 261.277 2.490 10 10 CECE COc1cc(N2CCC[C@](C)(OC)C2)ccc1CN 2139688317 QRLPUJKFJLZJOJ-HNNXBMFYSA-N 264.369 2.159 10 10 CECE Cc1cccc(CNc2cc(C(=O)O)ccn2)c1O 2139759317 XABDMFVDXJVQIF-UHFFFAOYSA-N 258.277 2.406 10 10 CECE CC[C@@H]1CN(c2ccc(CO)c(OC)c2)[C@H](C)CO1 2139702011 FWVNQBHEJJGLAF-BXUZGUMPSA-N 265.353 2.191 10 10 CECE Cc1ccc(S(=O)(=O)NCc2cccc(C)c2O)o1 2139758197 ASOYMUNRBHUDQR-UHFFFAOYSA-N 281.333 2.081 10 10 CECE Cc1cccc(CNC(=O)CCNC(C)(C)C)c1O 2139760598 BMHILNQGFOKSMF-UHFFFAOYSA-N 264.369 2.095 10 10 CECE C[C@H](N[C@H](C)C(=O)N1CCCC1)c1ccc(F)cc1O 228093777 YITPEAXFEDBNAT-WDEREUQCSA-N 280.343 2.193 10 10 CECE OC[C@H](CC1CCCC1)NCc1cccc(O)c1O 1926794443 SNTLGTXTHHEUQA-ZDUSSCGKSA-N 265.353 2.129 10 10 CECE COc1ccc(N2CCC23CC(CN)C3)c(F)c1F 2136984851 JLKMHTNYILRCAD-UHFFFAOYSA-N 268.307 2.291 10 10 CECE COC(=O)[C@H](C(C)C)[C@@H](N)c1ccc(N(C)C)cc1 1927403085 YKYDWSWDJIKOSV-KGLIPLIRSA-N 264.369 2.198 10 10 CECE Oc1ccccc1CNC[C@H]1CCC(F)(F)CO1 1967824094 FDWSMKGAIQGHOX-LLVKDONJSA-N 257.280 2.296 10 10 CECE C[C@@]12CC[C@@](NCc3cc(F)cc(F)c3O)(CO1)C2 1967871528 DDERVKDCEJCHKB-KBPBESRZSA-N 269.291 2.472 10 10 CECE CCNCc1ccc(N(CCO)CC(F)F)c(C)c1 231329179 MZSCCLWVVNLCRL-UHFFFAOYSA-N 272.339 2.168 10 10 CECE CC[C@H]1OCC[C@@H]1CNC(=O)CCc1ccc(N)cc1 234130766 MIWQBOQGHJQARO-UKRRQHHQSA-N 276.380 2.133 10 10 CECE COc1ccc(N2CC[C@H](OC)C[C@@H]2CN)cc1Cl 2138247782 JHILCWZTTIKAIV-NEPJUHHUSA-N 284.787 2.291 10 10 CECE COCCOCCCN(Cc1ccc(N)cc1)C1CC1 234677305 CETRMCWFRFHTKH-UHFFFAOYSA-N 278.396 2.286 10 10 CECE Cc1ccc(CN2CCC(F)(F)C[C@H]2C(=O)O)c(O)c1 1968201942 SNCMSFRYFFCUBB-NSHDSACASA-N 285.290 2.385 10 10 CECE CC[C@@H]1CN(c2ccc([C@@H](C)O)cc2F)C[C@H]1CO 2140786863 QDPLSYCWNRNSNG-WZRBSPASSA-N 267.344 2.334 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3CCC[C@H](O)[C@H]3C2)c(F)c1 2150979991 YMLUICRPNXLAIF-LESCFKLSSA-N 279.355 2.476 10 10 CECE OC[C@H](NCc1c(O)cccc1Cl)C(F)(F)F 1942832393 UMORLFNGSNLCSM-VIFPVBQESA-N 269.650 2.058 10 10 CECE NCc1ccc(N2CCO[C@@H]3CCC[C@@H]32)c(F)c1F 236259709 YHRJBRIMFWSHPM-CMPLNLGQSA-N 268.307 2.181 10 10 CECE CC1(C)[C@H]2CNC[C@H]2CN1Cc1c(O)cccc1Cl 128346962 RWYNQDMYJFLUFR-JQWIXIFHSA-N 280.799 2.475 10 10 CECE CN(C)CCCN(C)c1ccc(OCCN(C)C)cc1 2143363364 QNMGJFTUVZNUAF-UHFFFAOYSA-N 279.428 2.015 10 10 CECE Nc1ccc(CCC(=O)Nc2ccnn2C2CC2)cc1 2143568219 FZQBUEIQQKGEFQ-UHFFFAOYSA-N 270.336 2.372 10 10 CECE COC(=O)[C@@H]1CCN[C@H]1c1ccc2ccccc2c1O 1952792482 HRCQCYDDIPYDFT-KGLIPLIRSA-N 271.316 2.369 10 10 CECE CC(C)N(CC1CC1)c1ccc2c(c1)N(C)C(=O)[C@H]2N 131373697 BUDZCKAQQZXZKZ-HNNXBMFYSA-N 273.380 2.288 10 10 CECE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(CCN=[N+]=[N-])C2 1954208830 UHQDMFHMNARNPA-QWRGUYRKSA-N 281.360 2.380 10 10 CECE N[C@H]1CCCC[C@@H]1CNCc1ccc2c(c1)CCO2 1971076755 IZWLMAOBMDQKEK-CABCVRRESA-N 260.381 2.229 10 10 CECE Cc1cc([C@H](N)[C@H](O)c2ccc3c(c2)CCN3C)co1 2147959753 CANYTJVFIRLSFM-JKSUJKDBSA-N 272.348 2.314 10 10 CECE COc1cccc(O)c1CN1CCCC[C@@H](C(=O)O)C1 1972910118 SQORCILDOWDHLK-LLVKDONJSA-N 279.336 2.088 10 10 CECE CN[C@@H](c1ccccc1O)[C@@](C)(O)c1ccc(O)cc1 2148146355 DAQITLQENHANDZ-HOTGVXAUSA-N 273.332 2.266 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@H]3C[C@H]32)cc1Cl 2004447141 QQYMFOCNECSRQE-WQHBLYJGSA-N 253.729 2.371 10 10 CECE COc1ccc([C@H](C)NCc2cccc(O)n2)c(O)c1 2144606645 PPMGJKZJFDVZMQ-JTQLQIEISA-N 274.320 2.352 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H]3C[C@H]2CC[C@@H]3O)cc1O 2144887584 CUSQJQZNTNXSPX-BLTAXRJOSA-N 276.380 2.022 10 10 CECE COC[C@@H](CF)NCc1c(O)cccc1Br 1981694746 ULJZWOBWGMDKNG-MRVPVSSYSA-N 292.148 2.229 10 10 CECE CCN1CCN(c2ccc(CNC3CC3)cc2F)CC1 34824224 WOYRYRYTAGUCCC-UHFFFAOYSA-N 277.387 2.220 10 10 CECE Oc1cc(Cl)ccc1CN1CCO[C@@H](CF)C1 2004633865 RQWRJMOFRMAMSY-NSHDSACASA-N 259.708 2.216 10 10 CECE NCc1ccc(N(CCc2cccnn2)C2CC2)cc1 2146215056 BTRNETHODDKROZ-UHFFFAOYSA-N 268.364 2.147 10 10 CECE OCc1ccc(N2C[C@H]3CO[C@@H](C3)C2)cc1C(F)(F)F 2152273152 ZLIRVYDNWFKWIP-CABZTGNLSA-N 287.281 2.423 10 10 CECE CCN[C@H](C)c1ccc(N2CC(C(C)(C)O)C2)cc1O 2152282676 HPRDFUYWGIRBEI-LLVKDONJSA-N 278.396 2.270 10 10 CECE COc1cc(N2C(=O)C[C@@](C)(C(C)C)C2=O)ccc1N 41157249 BUQITYJAEBSGSZ-HNNXBMFYSA-N 276.336 2.203 10 10 CECE CNCc1ccc(OC)c(COC[C@@H]2OCC[C@H]2C)c1 2152442469 ZLHITRFKPGHUKC-WBMJQRKESA-N 279.380 2.356 10 10 CECE CC[C@@H]1CCOC[C@@H]1NCc1cc2c(cc1O)OCO2 2152566137 UDNUUIMFYKMEOP-PWSUYJOCSA-N 279.336 2.026 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)C[C@H]1C=CCC1 2153113561 GRACOCJKBPHMSM-ZDUSSCGKSA-N 273.380 2.495 10 10 CECE Nc1cc2c(cc1N1CC([C@@H]3CC3(F)F)C1)OCCO2 2153701678 LZSGZDSTPNLBRW-VIFPVBQESA-N 282.290 2.131 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C[C@@H]1COCCCO1 2154015117 VTVDWBGSQREGSS-MRXNPFEDSA-N 278.396 2.285 10 10 CECE CO[C@H](C1CC1)C(F)(F)CNCc1ccc(O)c(O)c1 2155496364 YUBBPFIXMGVBSC-CYBMUJFWSA-N 287.306 2.248 10 10 CECE CN(CCCCC(N)=S)Cc1ccccc1O 2017501483 GHSHCPPATDQEQP-UHFFFAOYSA-N 252.383 2.280 10 10 CECE Oc1ccc([C@H]2N[C@@H](CC(F)(F)F)CO2)cc1O 2028013346 YXFUJKFXRFSJBI-XVKPBYJWSA-N 263.215 2.037 10 10 CECE CC[C@H](CN(C)C)N[C@@H](C)c1c(O)cccc1O 2029859886 FQCYGJGBOYHDSB-WDEREUQCSA-N 252.358 2.089 10 10 CECE CC[C@]1(O)CCN(c2ccc(CNC)c(Cl)c2)C1 2033348189 FUHNRWMGEZRHME-AWEZNQCLSA-N 268.788 2.411 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)[C@]1(C)CC1(F)F 2036119282 VCTGETPLXZMHFV-LBPRGKRZSA-N 254.280 2.273 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](OC)[C@H](OC)C2)c(Cl)c1 300180484 RTXNGWYZYLPLBS-KMUNFCNLSA-N 298.814 2.470 10 10 CECE CC12CC(NCc3ccc(O)c(O)c3)(C1)C1(CCC1)O2 2157473052 GEHDJTNDONCJTE-UHFFFAOYSA-N 275.348 2.432 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H]2[C@H]2C[C@@H]32)c(F)c1F 2041538938 CJYYTCCMHYZONY-WDCWCFNPSA-N 250.292 2.268 10 10 CECE C[C@H](NCc1cnns1)c1cc(F)ccc1O 400254929 XTOTVZHMHLIVNE-ZETCQYMHSA-N 253.302 2.234 10 10 CECE Nc1ccc(NC(=O)CCN2CCC(F)(F)CC2)cc1 405079437 OMBYBFRHORZUJL-UHFFFAOYSA-N 283.322 2.329 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CCCO)c(F)c1 310633515 NATQOTJFSUTFQL-NSHDSACASA-N 254.349 2.315 10 10 CECE CO[C@H](COCCC(=O)Nc1ccc(N)cc1)C(C)C 312385251 HRFDSPVNFFURDZ-CQSZACIVSA-N 280.368 2.285 10 10 CECE Nc1ccc(CS(=O)(=O)N2CCC3(CCCC3)C2)cc1 312634751 IXPPQYXXOSVPMU-UHFFFAOYSA-N 294.420 2.365 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@@H]3CC[C@@H](N)[C@H]3C2)c1 312730128 SHAKOWPDOLZUNJ-LWWSYDQCSA-N 276.380 2.131 10 10 CECE Cc1cccc(O)c1CN1CCc2sc(CN)nc2C1 2160786123 MESVBNOQRHZQBB-UHFFFAOYSA-N 289.404 2.174 10 10 CECE COc1cccc(O)c1CN1CCC[C@@H]1[C@@H]1CCCN1 2160722576 GSXVNAWZLFFDKO-UONOGXRCSA-N 276.380 2.117 10 10 CECE CO[C@H]1C[C@@H](N(C)c2ccc([C@H](C)N)cc2)C[C@H]1OC 2172563530 XQPBGWOIIKRTIM-KSYCFECVSA-N 278.396 2.335 10 10 CECE CN1CC[C@]2(CCN(Cc3ccc(F)c(F)c3O)C2)C1 703457850 FUDPKBKJCOIYAM-HNNXBMFYSA-N 282.334 2.198 10 10 CECE CCC(F)(F)CN1CCN(c2ccc(N)cc2)CC1 704733400 KLHSBEVDIAGZSV-UHFFFAOYSA-N 269.339 2.436 10 10 CECE CC[C@]1(C)COCCN1c1ccc(OC)cc1N 707351046 GHQKSTXVNZZHEA-CQSZACIVSA-N 250.342 2.283 10 10 CECE CN1C[C@@H]2CC[C@H](C1)N2[C@@H]1CCc2cccc(O)c21 687262386 DHCPTJSNSYTEDB-HZSPNIEDSA-N 258.365 2.158 10 10 CECE CCc1cccc(CNCc2c(C)cnn2C)c1O 709433389 TZYQVUCJPWBDBV-UHFFFAOYSA-N 259.353 2.286 10 10 CECE C[C@@H](NCCO[C@@H]1CC1(F)F)c1ccccc1O 690724251 DQSFWHOYFDLCGS-BXKDBHETSA-N 257.280 2.467 10 10 CECE COC[C@H](CN(C)[C@H](C)c1ccc(F)cc1O)OC 691303599 WPQZOHKBWOTKEC-PWSUYJOCSA-N 271.332 2.186 10 10 CECE CN(C[C@H]1CC2(CCOCC2)CO1)c1ccc(N)cc1 712624087 KILYZYFPCJGFSX-OAHLLOKOSA-N 276.380 2.291 10 10 CECE O=C(NCC[C@H]1C[C@H]1C1CC1)c1ccc(O)c(O)c1 712843236 PYNVLKJHSBUCHQ-JQWIXIFHSA-N 261.321 2.264 10 10 CECE CN(C)c1ccc(CN[C@@]23CCCN(CC2)C3)cc1 714925746 RAVQMIRSWPZBHA-INIZCTEOSA-N 259.397 2.081 10 10 CECE CCN(Cc1cccc(OC)c1O)C1CCOCC1 716480455 QTQTXSMFNNRAKC-UHFFFAOYSA-N 265.353 2.402 10 10 CECE COc1cc([C@H](O)Cc2ccc(N)cc2)sn1 696493596 DLHYEKIDJRQXJZ-SNVBAGLBSA-N 250.323 2.010 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C[C@H]1CCCCS1 718272145 XSOVHLKBWMSMHW-GFCCVEGCSA-N 295.404 2.498 10 10 CECE CCCNCc1ccc(N2C[C@H]3COC[C@H]3C2)cc1 718223070 YVANCROPSRNGDJ-GASCZTMLSA-N 260.381 2.269 10 10 CECE CCC[C@@H](NC(=O)COc1ccc(N)cc1)C(F)(F)F 2174099923 HAGWSTMFLUSPAX-LLVKDONJSA-N 290.285 2.495 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[C@@H](O)[C@H]2C)cc1O 394975688 BVNVBKGEJGHTSE-LALPHHSUSA-N 278.396 2.412 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)CC(C)(C)C2)cc1O 395364510 KKBSYROTEAKOQL-DGCLKSJQSA-N 278.396 2.399 10 10 CECE CCCOc1cc(N2CCC3(C2)OCCO3)ccc1N 396546438 ULKGWNUNFKUQON-UHFFFAOYSA-N 278.352 2.011 10 10 CECE CC(C)N(Cc1ccc(N)cc1)c1cc(C#N)cnn1 396901359 FHYYYTMDRLXFFY-UHFFFAOYSA-N 267.336 2.345 10 10 CECE C[C@@H]1C[C@H](C(=O)O)CN([C@H](C)c2ccccc2O)C1 398839736 JTNZQXQLJCKEKX-UTUOFQBUSA-N 263.337 2.496 10 10 CECE CC(C)c1c(C(=O)N(C)C)cnn1-c1ccc(O)c(O)c1 2069759872 LNAFCXSLBMQOCN-UHFFFAOYSA-N 289.335 2.109 10 10 CECE CCN(c1ccccc1)c1ncnc2c1CCNCC2 2169059764 SUBDMGLQIRLHCB-UHFFFAOYSA-N 268.364 2.323 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@@H](CN)C(F)F 2179995482 DUAONWNICKDNMR-ZJUUUORDSA-N 286.322 2.142 10 10 CECE CC[C@@](C)(NC(=O)[C@H]1CNc2ccccc2N1)C(F)F 2179935300 IZLSDNYNSRQZMX-BXUZGUMPSA-N 283.322 2.443 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCSCC3(C)C)cc21 2170953024 UMGOJWNTFBRKBD-CYBMUJFWSA-N 292.404 2.028 10 10 CECE NCc1ccc(N2CCC[C@@H](n3cccn3)C2)c(F)c1 2171252479 CQRHGZYPFLLSDL-CYBMUJFWSA-N 274.343 2.322 10 10 CECE Oc1c(F)cccc1CNCc1ccnn1C(F)(F)F 2199752274 QHZFKMDYIJRPAS-UHFFFAOYSA-N 289.232 2.494 10 10 CECE 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YAMQNGQVDSBRNE-QWRGUYRKSA-N 252.333 2.398 10 10 CECE C[C@@H]1CCOCC[C@H]1NCc1c(O)cccc1F 2046736642 TZPMTPAALNMMPI-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@H](C)[C@H](CO)C2)c(F)c1 2194514677 QOSGPWIPTRIKIP-SCVCMEIPSA-N 285.334 2.473 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H]3CC[C@@]2(CO)C3)c(F)c1 2194506906 AAJBHEBSCBCEKE-FTGAXOIBSA-N 283.318 2.369 10 10 CECE C[C@@H](O)c1ccc(N2CC[S@@](=O)[C@H](C)C2)c(Cl)c1 2051906009 QTSSOUFZLALRTJ-CLFVBBPSSA-N 287.812 2.351 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCN(C)C3(CC3)C2)c(F)c1 2194510300 HVRYIAMFTMWERD-SNVBAGLBSA-N 282.334 2.303 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@@H](CN(C)C)C2)c(F)c1 2194695628 WILWQKOVQKTQBR-MNOVXSKESA-N 283.366 2.372 10 10 CECE C[C@H](N[C@@H]1[C@@H]2CCCO[C@@H]21)c1ccc(F)cc1O 2056356732 DWTDINSABAVUJT-DVXMNORISA-N 251.301 2.359 10 10 CECE CC(C)N(C[C@H]1CCCN1)C(=O)Nc1ccc(N)cc1 2191531425 SOZPSVKRWNRUBS-CQSZACIVSA-N 276.384 2.263 10 10 CECE C[C@H](O)c1ccc(N2CCC=C[C@H]2CO)c(F)c1 2061971357 DBVLTXODFLFADE-JQWIXIFHSA-N 251.301 2.006 10 10 CECE OCc1cc(F)c(N2C[C@@H](F)C[C@@H](F)C2)c(F)c1 2062387905 FRRCTTOFVOBCJM-DTORHVGOSA-N 263.234 2.343 10 10 CECE Cc1cc(N)cc(C(=O)NCCc2ccc(N)cc2)c1 2191749467 JQVYMYPURBCIOD-UHFFFAOYSA-N 269.348 2.132 10 10 CECE N[C@H]1CN(c2ccc3c(c2)CCC3)CC(F)(F)C1 2064312692 WINNYJPLJRLLAI-GFCCVEGCSA-N 252.308 2.348 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](O)[C@@H]2C2CC2)c(F)c1 2187153152 AIHIOQZXOAVDNV-GTTSAUCSSA-N 278.371 2.456 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@](C)(O)C2)c([N+](=O)[O-])c1 2192169931 CCQKXSDBYROGGS-QMTHXVAHSA-N 280.324 2.201 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1sccc1N 2071699566 JKFUJWAEUKJKPZ-UHFFFAOYSA-N 261.350 2.185 10 10 CECE C[C@H](OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2072111610 LVVWAWOMLPYAEO-VHSXEESVSA-N 254.334 2.491 10 10 CECE CN[C@@H](C)C(C)(C)CN(C)Cc1ccccc1O 2072467974 YPWZNSDFYQLYQA-LBPRGKRZSA-N 250.386 2.458 10 10 CECE C[C@@H](CN[C@H](C)c1ccc(O)cc1O)OC(F)F 2076281947 WUGCSESFZSYQPO-JGVFFNPUSA-N 261.268 2.376 10 10 CECE COC1CC(c2noc(-c3ccc(O)c(O)c3)n2)C1 2100430209 BDEWKDXVPKNOGV-UHFFFAOYSA-N 262.265 2.040 10 10 CECE CC(C)COC1CN(c2c(F)cc(CN)cc2F)C1 2102491380 QVMGOCFHQAWDAH-UHFFFAOYSA-N 270.323 2.285 10 10 CECE CC(C)CN1CC[C@@H](N(C)Cc2ccc(N)cc2)C1 2103744056 CKZYLDZEIDMXTF-MRXNPFEDSA-N 261.413 2.431 10 10 CECE Cc1cccc(O)c1[C@@H](NCc1cccs1)C(N)=O 2104479322 FHLRSPKBISHKHC-CYBMUJFWSA-N 276.361 2.078 10 10 CECE Oc1cccc(F)c1CN1CCC[C@H]2CNCC[C@H]21 2104488418 AQOMRDQFBJDVAQ-SMDDNHRTSA-N 264.344 2.105 10 10 CECE C[C@H]1C[C@H](OC(=O)Nc2ccc(N)cc2)CCO1 2084737953 NGQWNCPAZUWNJW-JOYOIKCWSA-N 250.298 2.385 10 10 CECE CCNCc1ccc(N2CCN(CC)C[C@@H]2C)cc1 2105201985 ANUQFARBOSJTRA-AWEZNQCLSA-N 261.413 2.327 10 10 CECE CC[C@]1(N)CCCN(c2ccc(OC)c(OC)c2)C1 2106383410 PTBIPZGFWPWXNI-HNNXBMFYSA-N 264.369 2.412 10 10 CECE CC1(C)COc2ccc(N3CCNCC34CC4)cc21 2106358743 VOXAWFVHHWLULT-UHFFFAOYSA-N 258.365 2.299 10 10 CECE CN(Cc1ccc(N)cc1)Cc1cc(C(=O)O)co1 2106421630 VDBUGMAKQHMIFC-UHFFFAOYSA-N 260.293 2.192 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)C1(COC)CC1 2106797552 BSEXORSXVOGLCD-HNNXBMFYSA-N 260.381 2.366 10 10 CECE C[C@@H]1CNC[C@]1(O)c1ccc(N2CCCCC2)cc1 2106826453 SWJJUNBAKKSORM-CZUORRHYSA-N 260.381 2.104 10 10 CECE CC(C)[C@@](C)(O)[C@H](N)c1ccc2c(c1)CCCN2C 2106942557 FBXDWDAQLTVULT-HZPDHXFCSA-N 262.397 2.476 10 10 CECE CO[C@H]1CC(N(C)Cc2ccccc2O)C[C@@H]1OC 2109824236 LHVBSKMGMBBXIE-GJZGRUSLSA-N 265.353 2.016 10 10 CECE COC1(CN(C)c2ccc(C[C@H](C)N)c(C)c2)CC1 2111580787 KLUXOXDCSQPKRV-ZDUSSCGKSA-N 262.397 2.500 10 10 CECE CC(C)C[C@H]1CCN1c1ccc2c(c1)NC(=O)[C@@H]2O 2092531378 IGBUHVUQWIFEDY-BXUZGUMPSA-N 260.337 2.297 10 10 CECE COC[C@@H]1[C@@H]2CCN(c3ccc(CN)cc3F)C[C@H]21 2093141147 STMPWYLYXCCIAQ-JHJVBQTASA-N 264.344 2.003 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC4CC3C4)c(Cl)cc21 2095416668 BIHATWLKWJEOJS-KTRLOWJHSA-N 277.755 2.151 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CCS[C@H]2CC[C@H]21 2095860685 WGUVQEPKOBDQOD-YPMHNXCESA-N 280.349 2.171 10 10 CECE F[C@H]1C[C@H](COc2ccc(N3CCNCC3)cc2)C1 2096867390 RVPIZSWDIBEKNM-JOCQHMNTSA-N 264.344 2.223 10 10 CECE CC(C)(CO)[C@H]1CCCN1c1ccc(CN)c(F)c1 2099629905 DVINYZXJWQCDCX-CQSZACIVSA-N 266.360 2.272 10 10 CECE COCCN(c1ccc(CN)cc1C)[C@H]1CCSC1 2113788569 YZZVTZAFDSDUPR-AWEZNQCLSA-N 280.437 2.412 10 10 CECE CC(C)(C)c1ncc([C@H](NCCN=[N+]=[N-])C(=O)O)s1 2114307548 QMVIVRDJBPMFMU-QMMMGPOBSA-N 283.357 2.466 10 10 CECE CC[C@H](N)c1ccc(N2CC[S@@](=O)C(C)(C)C2)cc1 2114520974 CXJWUONPVQEABI-IFXJQAMLSA-N 280.437 2.444 10 10 CECE Cc1cc(N2CC[C@@H]3CN(C)CC[C@H]32)ccc1CO 2114505757 XJCMUXOZOHOHKV-CZUORRHYSA-N 260.381 2.018 10 10 CECE NCCc1ccnc(N2CCCc3cnccc32)c1 2114813065 QQBTTYZMYJPMDJ-UHFFFAOYSA-N 254.337 2.062 10 10 CECE COc1cc(N(C)C[C@]23CO[C@](C)(C2)C3)ccc1CO 2204553997 JTPAFMLSSAFRQJ-IYBDPMFKSA-N 277.364 2.193 10 10 CECE C[C@]1(CCO)CCN1c1ccc(CNC2CC2)cc1F 2205514527 IQDFYSGXPHSOTH-MRXNPFEDSA-N 278.371 2.429 10 10 CECE C[C@H](NC(=O)[C@H]1CC[C@]1(C)C(=O)O)c1ccccc1O 2207208297 IOOMSXVBKBBDOI-ISOBSLSZSA-N 277.320 2.070 10 10 CECE CN[C@H](c1ccccc1O)C1(O)C[C@H]2C=C[C@@H](C2)C1 2270211236 RPXQTDRWCLQSGN-SLEUVZQESA-N 259.349 2.370 10 10 CECE OC[C@@]1(F)CCN(c2ccc(OC3CC3)cc2)C1 2219593150 QLHXFUXPYCOXQS-CQSZACIVSA-N 251.301 2.139 10 10 CECE COc1ccc(N2CC(O)(c3ccsc3)C2)cc1 2219629658 RJQRGSQMODNTCQ-UHFFFAOYSA-N 261.346 2.465 10 10 CECE COC(=O)C1(CN(C)Cc2ccc(N)cc2)CCC1 2230266944 IOVVDLJDKYMSQG-UHFFFAOYSA-N 262.353 2.044 10 10 CECE CN(C)c1ccc(OC[C@@H](N)c2cscn2)cc1 2221876367 PGIHKAUCFDQMRH-GFCCVEGCSA-N 263.366 2.288 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC[C@@H]2[C@H](CO)[C@@H]2C1 2232091738 KLBJJCMDLHTPAG-BEAPCOKYSA-N 261.365 2.113 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](N(C)C)C2)c(C)c1 2232026579 CMFTYYXARZEZHI-HIFRSBDPSA-N 261.413 2.416 10 10 CECE CN[C@@H](C)c1ccc(N2CC=CC[C@@H]2CO)c(C)c1 2232103846 DTVDYBALJUAUPF-DZGCQCFKSA-N 260.381 2.403 10 10 CECE COc1ccc(N2CCO[C@H]([C@H](C)N)C2)cc1C(C)C 2233169284 MMHHELHFXHZYSX-LRDDRELGSA-N 278.396 2.371 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@H](C)C[S@@](C)=O 2223933251 PYAPRYKCUGPIME-FTLABTOESA-N 268.426 2.218 10 10 CECE CN(Cc1ccccc1O)c1cccc(S(C)(=O)=O)c1 2235040072 CBWOWIIWXWVPHE-UHFFFAOYSA-N 291.372 2.432 10 10 CECE CC(C)[C@H]1[C@@H](O)CCN1c1ccc2c(c1)OCCCO2 2235128616 FELQTAVNRPTRBG-BBRMVZONSA-N 277.364 2.444 10 10 CECE CC[C@H]1CCOC[C@H]1N(C)c1ccc(OC)cc1CN 2235966595 VKAAKIABKLKSHO-BLLLJJGKSA-N 278.396 2.405 10 10 CECE CCCNCc1cc(OC)ccc1N1CC(C)(OC)C1 2235961226 FTAHFACGVFYCNI-UHFFFAOYSA-N 278.396 2.420 10 10 CECE CNCc1cc(OC)ccc1N(C)CC1CCOCC1 2235967370 FRKREXTUUNALNQ-UHFFFAOYSA-N 278.396 2.277 10 10 CECE COc1ccc(N2CCC[C@@]3(C)COC[C@H]23)c(CO)c1 2236000788 BPOQFRPLIIBASA-HOTGVXAUSA-N 277.364 2.193 10 10 CECE COc1ccc(N(CCCN)C[C@@H]2CC[C@@H]2OC)cc1 2236162139 NHYLUZHJJOKKMK-BBRMVZONSA-N 278.396 2.275 10 10 CECE C[C@H](O)[C@@H]1CCCCN1c1ccc2c(c1)OCCO2 2226778056 BKWVJSLBAFAMTB-AAEUAGOBSA-N 263.337 2.198 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OCCCO3)CC[C@@H]1O 2226812332 WXSIBSICSKLGKV-YPMHNXCESA-N 263.337 2.055 10 10 CECE Cn1ncc2cc(NCc3ccccc3O)cnc21 2226819905 QQOAUHAUMPMWAQ-UHFFFAOYSA-N 254.293 2.286 10 10 CECE COc1ccc(N2C[C@H]3[C@H](C2)C3(F)F)c(C(=O)O)c1 2227669624 FKWNZWLIKZVBHT-UWVGGRQHSA-N 269.247 2.095 10 10 CECE COc1ccc(N2CC[C@H](C)O[C@@H](C)C2)c(CO)c1 2227709174 QSKUVDKZRNNPLW-RYUDHWBXSA-N 265.353 2.191 10 10 CECE COc1ccc(N(C)C[C@@H]2CC[C@H]2OC)c(C=O)c1 2227890599 WLCFQHRDZZTVKA-XHDPSFHLSA-N 263.337 2.369 10 10 CECE CCCOCCS(=O)(=O)CCCc1ccc(N)cc1 2229795058 HIXVNGSAZDKLFX-UHFFFAOYSA-N 285.409 2.043 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3[C@@H](O)C[C@H]3C2)c(C)c1 2240743444 GEAIWZMEPFFLNN-JWDQPFGJSA-N 274.408 2.483 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)[C@H]1CCN(C)C(=O)C1 2240759795 MHJOYONJSVQQLB-OCCSQVGLSA-N 275.396 2.072 10 10 CECE CCN(c1ccc([C@H](C)O)cc1C)[C@@H]1CCCNC1=O 2240841437 HGYSNTYLHOCEQO-SWLSCSKDSA-N 276.380 2.153 10 10 CECE COC[C@]1(C)C[C@@H]1CN(C)CCOc1ccc(N)cc1 2284635162 FYTYYRQNLPBCDH-CJNGLKHVSA-N 278.396 2.252 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](O)[C@H](C3CC3)C2)cc1C 2285136282 VOUHKELABVEGFT-DQYPLSBCSA-N 274.408 2.483 10 10 CECE COc1ccc(N2C[C@@H](F)C[C@H]2CN)c(C)c1C 2256951012 BSBVNHFPXHMCNH-RYUDHWBXSA-N 252.333 2.188 10 10 CECE CSc1ncc(CNC[C@@H]2C[C@@H]3C[C@@H](N)[C@@H]3C2)s1 2257123710 FFXCNZSTNZBERK-CNVPUSNMSA-N 283.466 2.328 10 10 CECE CSc1ncc(CN[C@@H]2CN(C)C(C)(C)C2)s1 2248708038 MZDNXTLMZSXEED-VIFPVBQESA-N 271.455 2.437 10 10 CECE CCOc1cccc(CN[C@]23COC[C@H](C2)C3)c1O 2273171195 WSMKTTYDJGVAJE-FUKZOUPISA-N 263.337 2.060 10 10 CECE Oc1cc(F)ccc1CN1CCC[C@@H]2CCNC[C@H]21 2274500997 SYUFYHPPCXLDFB-BXUZGUMPSA-N 264.344 2.105 10 10 CECE CC1(C[S@@](=O)CCC(=O)Nc2ccc(N)cc2)CC1 2266466801 GZIVQGNMKBAPGB-IBGZPJMESA-N 280.393 2.146 10 10 CECE CSc1ncc(CNc2ccc(N)cc2C(N)=O)s1 2269242353 OIBSLLXVQOTSJM-UHFFFAOYSA-N 294.405 2.158 10 10 CECE CCN(CC1CN(C)C1)c1ccc([C@@H](C)O)c(C)c1 2269693173 COSIUITVQMSLJW-CYBMUJFWSA-N 262.397 2.436 10 10 CECE N[C@H]1C[C@H]2CC[C@H]1C[C@@H]2NCc1ccc2c(c1)CCO2 2284884206 VJYVDJRPLJCQGF-XRGAULLZSA-N 272.392 2.227 10 10 CECE Cc1cc(N2C[C@H](C(N)=O)CC[C@H]2C)ccc1[C@@H](C)O 2285177908 XIFWMPQYMAFIKC-JHJVBQTASA-N 276.380 2.139 10 10 CECE CCN(c1ccc([C@@H](C)O)c(C)c1)[C@H]1CCCNC1=O 2285153464 JPQJYQAOSZBCFR-DOMZBBRYSA-N 276.380 2.153 10 10 CECE CN(C)c1ccc(-c2nc3cc(N)c(N)cc3[nH]2)cc1 2285989896 PMAVURNLWIUBRI-UHFFFAOYSA-N 267.336 2.460 10 10 CECE CCNCc1cc(OC)ccc1N1CC[C@H](O)[C@@H]1CC 2288910153 NLCZHNOYAIBIBK-HOCLYGCPSA-N 278.396 2.154 10 10 CECE CCN1CCc2cc([C@@H](N)c3ncncc3F)ccc21 2289484757 DJJNKZRJOSOWJG-CQSZACIVSA-N 272.327 2.046 10 10 CECE CCN[C@H](c1ccccc1O)C1(O)CC(C)(COC)C1 2289620122 OMQGAWZFJMZJFA-QQFBHYJXSA-N 279.380 2.220 10 10 CECE COc1cc(Cl)c(N2CC([C@H](C)O)C2)c(OC)c1 2319560255 LUMQQPVRIVJFGS-QMMMGPOBSA-N 271.744 2.174 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@@H]2C[C@@H]2F)cc1O 2310647776 PZGCQHSKJQUQJM-KWBADKCTSA-N 252.333 2.467 10 10 CECE Nc1ccc(C[C@H](O)c2ccnn2C(F)F)cc1 2321472698 JINXOILQGGTPDS-NSHDSACASA-N 253.252 2.137 10 10 CECE CCN(c1ccc(CN)c(SC)c1)[C@@H]1CCOC1 2328548614 IHUYPHOHOBYJBU-CYBMUJFWSA-N 266.410 2.482 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1OCC[C@H]1C(F)(F)F 2337775691 DRJMGJIANYHEQX-SFYZADRCSA-N 280.250 2.113 10 10 CECE CCN(CCN=[N+]=[N-])CC(=O)N(C)c1ccccc1 2337779017 FRNONCPBIVWNAI-UHFFFAOYSA-N 261.329 2.282 10 10 CECE CNCc1ccc(N2C[C@H](O)C[C@@H]2C)cc1C1CC1 2339145906 DDULYXFFWDGULS-XHDPSFHLSA-N 260.381 2.243 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@H]2C[C@H]1[C@@](C)(O)C2 2339634315 MRZHIAWNQMDSOL-KNPMLCFXSA-N 260.381 2.364 10 10 CECE CNC[C@H]1CN(Cc2c(O)cccc2Cl)CC12CC2 2340454625 LHXVVSBAXQVJJS-NSHDSACASA-N 280.799 2.477 10 10 CECE O=C(O)C[C@@]12CC[C@@H](C1)N(Cc1ccccc1O)C2 2340566269 PWDSQPHQJPWPDO-SWLSCSKDSA-N 261.321 2.221 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC[S@@](=O)[C@@H](C)C2)c1C 2340858131 VMSIAPCBKHWSOX-WSHAHDTKSA-N 281.421 2.314 10 10 CECE COc1cc(Cl)c(N2C[C@H](F)C[C@@H]2CN)c(OC)c1 2342300204 NZEMUBCBJDNJES-RKDXNWHRSA-N 288.750 2.233 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc(CN)c(SC)c1 2353860321 TVEIGXFRYQYQJB-GXTWGEPZSA-N 280.437 2.464 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2C[C@@H]3CC[C@H]2O3)cc1O 2355010817 POODYGXBPYKEHR-XALPAYFRSA-N 277.364 2.449 10 10 CECE CCCCOC(=O)c1ccc(O)c(CN(C)C)c1 1718251 PYUBXKHAWDQIDA-UHFFFAOYSA-N 251.326 2.411 10 10 CECE C[C@@H](CNC(=O)CCc1ccc(N)cc1)CN1CCCC1 62079809 NDXICEQVVVFPHI-AWEZNQCLSA-N 289.423 2.050 10 10 CECE CCCCN(CCO)c1ccc(CNCCOC)c(C)c1 62737228 GEFLEYVNQVQQRU-UHFFFAOYSA-N 294.439 2.330 10 10 CECE CCOc1cccc(CN[C@H]2CC[C@@H]3C[C@]23CO)c1O 2356907184 JLLSVDMUGPRETJ-IVMMDQJWSA-N 277.364 2.042 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)C1CCCCC1 231733632 VWNDXPFLCDKDAR-UHFFFAOYSA-N 260.363 2.329 10 10 CECE C[C@@H](N[C@H]1C2CCN(CC2)[C@@H]1C)c1cc(O)ccc1O 2357533194 QMODLHVIYSJQOZ-GLKRBJQHSA-N 276.380 2.231 10 10 CECE CN(C)C(=O)c1ccc(NCc2ccc(O)c(O)c2)cc1 36955034 ZVFBZZRQLQCNFK-UHFFFAOYSA-N 286.331 2.412 10 10 CECE CC[C@H]1CN(c2ccc(/C=C\C(=O)O)cc2F)CCN1C 215406169 JPBIJULARJZLDT-VGVVRCBHSA-N 292.354 2.454 10 10 CECE CCOc1ccc(/C=C2/SC(=S)N(N)C2=O)cc1C 33430297 JXUNODQSZLPDDF-YRNVUSSQSA-N 294.401 2.469 10 10 CECE NS(=O)(=O)c1ccc(Sc2nccs2)s1 211827631 FTCRYNNCNPLMAK-UHFFFAOYSA-N 278.405 2.003 10 10 CECE CN(Cc1cscn1)c1ccc(CN)c(F)c1 135225833 UWOMSWFJZQXJHR-UHFFFAOYSA-N 251.330 2.377 10 10 CECE CC(C)(C)c1cc(N)n(C(=O)Cc2ccc(N)cc2)n1 82284209 PZHKVDAQEUHXJZ-UHFFFAOYSA-N 272.352 2.228 10 10 CECE COc1ccc(OC)c2c1C(=O)c1cc(C)cc(O)c1C2=O 196408011 IKMODHJMQKHXAH-UHFFFAOYSA-N 298.294 2.493 10 10 CECE CN(C)c1ccc(/C=C\C(=O)NC2CCOCC2)cc1 222117719 HDUQMBPYAWMJCP-YVMONPNESA-N 274.364 2.061 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H](C)[C@@H]2CO)c(F)c1 227038198 TZJNISCCFOAOEH-BFVZDQMLSA-N 252.333 2.053 10 10 CECE CNC[C@@H]1CCCN1[C@@H](C)c1cc(F)ccc1O 227724783 HNKOKWPONXHAKS-JQWIXIFHSA-N 252.333 2.276 10 10 CECE C[C@@](N)(CCO)c1cc(Cl)cc(Cl)c1O 95757390 NTQLJFHFUPGONU-SNVBAGLBSA-N 250.125 2.255 10 10 CECE COC[C@@H](C)[C@H](C)NC(=O)Nc1ccc(N)cc1 386503119 ZHXZFLIFJOJYAA-ZJUUUORDSA-N 251.330 2.061 10 10 CECE CCC(CC)N(CCO)c1ccc([C@H](C)N)c(O)c1 93671082 YIKUOCUXBLATHE-NSHDSACASA-N 266.385 2.399 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](C)[C@H](CO)C2)c(F)c1 700388105 AQTBLVRGNNTSFJ-PWSUYJOCSA-N 284.350 2.139 10 10 CECE C[C@H](N[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)O)c1ccc(O)cc1O 251546529 PQBHZXFUJLUJLO-SRLMGOEHSA-N 291.347 2.248 10 10 CECE CCN(CC)c1ccc(CNS(=O)(=O)CC2CC2)cc1 267037096 BFIYWQBEDLJJOI-UHFFFAOYSA-N 296.436 2.362 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCCOC2)c1 273624138 ZXOFPSHITNYEKL-CMPLNLGQSA-N 279.336 2.008 10 10 CECE CCOC1CN(c2ccc(/C=C\C(=O)O)c(C)c2)C1 383143496 XUYYUEUPLBJBHH-ALCCZGGFSA-N 261.321 2.318 10 10 CECE COc1ccc(CNCC2([C@H]3CCCO3)CC2)c(O)c1 2164398064 LDCNLQMHIPLTNE-OAHLLOKOSA-N 277.364 2.450 10 10 CECE CN(C[C@H]1COCCC1(F)F)c1ccc(CO)cc1F 2166671050 UTTVZNUTJAJXTE-NSHDSACASA-N 289.297 2.426 10 10 CECE C[C@@H]1CCN(c2ccc(CN)cc2Cl)C[C@H]1O 299954242 MVQNWVBFODEDQC-NOZJJQNGSA-N 254.761 2.006 10 10 CECE c1cc2c(cc1N1CC[C@@H]3NCC[C@H]3C1)OCCCO2 2162619519 CDRDRRHRGPMQHK-JSGCOSHPSA-N 274.364 2.036 10 10 CECE c1cc2c(cc1N1CCC[C@H]1[C@@H]1CCCN1)COCC2 2162638556 VVCLOQUEDLCROK-IRXDYDNUSA-N 272.392 2.480 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)c1c(Cl)cnn1C 97448503 XQFBBKHYVVVPCI-CYBMUJFWSA-N 278.787 2.448 10 10 CECE CCN1CCc2cc(N3CC[C@@H]4CCN[C@@H]4C3)ccc21 2163065231 YQKAIPPXLDMPAP-XJKSGUPXSA-N 271.408 2.257 10 10 CECE COc1ccc(C[C@H](N)c2ccc(N(C)C)cc2)cn1 2163071700 QOZSKLQVGLEQMI-HNNXBMFYSA-N 271.364 2.399 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H]3CCNC3(C)C)ccc21 2163097703 QIRQMJMSPJWPHZ-GDBMZVCRSA-N 274.408 2.491 10 10 CECE COc1cnc(N(Cc2ccc(N)cc2)C2CC2)nc1 2165616621 BJHHDNKEQYUFFA-UHFFFAOYSA-N 270.336 2.236 10 10 CECE CCCOc1cc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)ccc1N 2163568026 FRXFZLDHEJUPND-TYNCELHUSA-N 276.380 2.265 10 10 CECE O=C(NC[C@H]1C[C@H]2[C@@H](C1)C2(F)F)c1cccc(O)c1O 2163939978 XLIKQNFVYSDOKR-SLGCYQGISA-N 283.274 2.119 10 10 CECE C[C@H]1[C@@H](NCc2ccc3c(c2)CCCN3C)CCN1C 719572795 LATAPDKGMOTEKD-BBRMVZONSA-N 273.424 2.251 10 10 CECE C[C@H](N[C@@H]1CCN(C)[C@H]1C)c1c(O)cccc1F 903298265 RBAPKJIKANHODX-JBLDHEPKSA-N 252.333 2.275 10 10 CECE O=C(Cc1cc(C2CC2)no1)NCc1ccccc1O 830526049 BVABLDANJFZKIL-UHFFFAOYSA-N 272.304 2.117 10 10 CECE Nc1ccc(CCNC(=O)N2CC[C@H]2C2CC2)cc1 841956072 UDJFUNDWHBFPJL-AWEZNQCLSA-N 259.353 2.005 10 10 CECE CCC[C@H](C)[C@@H](CO)NCc1cc([N+](=O)[O-])ccc1O 844378916 MTXVFWGAMCMMPF-GXFFZTMASA-N 282.340 2.187 10 10 CECE Cc1cc(C(=O)N2CCC23COC3)c(C)n1-c1ccccn1 854837864 VWJFSQKILWPSIE-UHFFFAOYSA-N 297.358 2.104 10 10 CECE CC(C)OCCCC(=O)NCc1c(O)cccc1F 928707432 DNVLSLOKBDXGMO-UHFFFAOYSA-N 269.316 2.353 10 10 CECE O=C(NCc1c(O)cccc1F)C1(C(F)(F)F)CC1 928710407 CZVAZCPQJRMZCS-UHFFFAOYSA-N 277.217 2.490 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)C3CC=CC3)C2)cc1 855230320 GFDIXEGXNGEULZ-CQSZACIVSA-N 286.375 2.356 10 10 CECE CCOc1cccc(CN[C@H]2COC[C@H]2CC)c1O 699549747 XDELPVXKXQIISY-YPMHNXCESA-N 265.353 2.306 10 10 CECE CO[C@@H]1CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)C1 855023449 ZADQJRAARCJMPW-BXKDBHETSA-N 283.755 2.477 10 10 CECE CCO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1C)C1CC1 863405503 WYUXYPHCEUWHBF-AWEZNQCLSA-N 299.392 2.257 10 10 CECE COC(=O)NCCCN[C@@H](C)c1ccc(N(C)C)cc1 1875637426 NFFFLDZFZJENEU-LBPRGKRZSA-N 279.384 2.149 10 10 CECE C[C@H](NC(=O)N[C@H]1CCO[C@H](C)C1)c1ccccc1O 868469664 MNFZHDJGIZPVOA-WOPDTQHZSA-N 278.352 2.320 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cc(Cl)ncc1Cl 701323052 KDLSBDUAMFCUFU-UHFFFAOYSA-N 260.084 2.429 10 10 CECE CN(C[C@H]1C[C@H]1CF)C(=O)CCc1ccc(N)cc1 1875736894 VMKIRZIEGZGPTG-QWHCGFSZSA-N 264.344 2.265 10 10 CECE Cc1cc(Cl)cc(CN2CCN[C@@H](C)C2)c1O 775639268 RSHCKNALTALMPB-JTQLQIEISA-N 254.761 2.148 10 10 CECE CC(=O)N1CCC[C@@H](CNCc2ccc(F)c(F)c2O)C1 877491236 PHCFCGUJYOTLOS-NSHDSACASA-N 298.333 2.019 10 10 CECE Nc1ccc(NC(=O)N2C(=O)[C@@H]3CCCC[C@@H]32)cc1 1876152669 JHIRPPAUCBIVMV-NEPJUHHUSA-N 259.309 2.202 10 10 CECE CCc1cccc(CN2CCN3C[C@H](C)C[C@@H]3C2)c1O 1876177597 NQSIYTBMMVPOMT-CZUORRHYSA-N 274.408 2.481 10 10 CECE CO[C@H]1CCC[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 871205625 VTSSCZVLYBMIOK-YPMHNXCESA-N 275.348 2.440 10 10 CECE CCCOc1cc(N2C[C@H](CN)[C@@H](C)C2)ccc1N 1876663836 CMNCKCXHWCDTDP-RYUDHWBXSA-N 263.385 2.089 10 10 CECE COC[C@](C)(CNCc1ccc(OC)c(C)c1)OC 1895307297 DTHLAXMODORFFJ-HNNXBMFYSA-N 267.369 2.145 10 10 CECE CC[C@H](Cn1cncn1)NCc1ccc(N2CCCC2)cc1 788526319 PQKYTTPMNVUAIT-MRXNPFEDSA-N 299.422 2.447 10 10 CECE CC(C)O[C@H]1CCN(CCOc2ccc(N)cc2)C1 701711732 HPAOOUYYQLHLPH-HNNXBMFYSA-N 264.369 2.147 10 10 CECE C[C@@H]1[C@H](N(C)Cc2ccc(N)cc2)C2CCN1CC2 1877896789 NCSWOOKSEZIOJO-WBMJQRKESA-N 259.397 2.183 10 10 CECE CN1CCC[C@H](N(C)c2ccc(CO)cc2F)CC1 1877904055 CSSRFFPKPPGHEB-ZDUSSCGKSA-N 266.360 2.239 10 10 CECE C[C@H](CCO)N(C)C(=O)c1cc2cc(O)c(O)cc2s1 898295068 TVKICOOGLHRGHH-MRVPVSSYSA-N 295.360 2.155 10 10 CECE C[C@@H]1CC[C@@](N)([C@H](O)c2ccc3c(c2)CCN3C)C1 1880448116 DXYKNHCKRXFEJX-LYRGGWFBSA-N 260.381 2.230 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3COC[C@H]32)c(F)c1 1899147841 JDEFDXQLVNLLOY-IFUGULHKSA-N 264.344 2.331 10 10 CECE Cc1cccc(N(C)C=C2C(=O)OC(C)(C)OC2=O)c1 1088670233 QFARCXOWOJVLCK-UHFFFAOYSA-N 275.304 2.151 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@H]1CCCc2cccnc21 1158009341 JVCVMHOTBJINHN-ZDUSSCGKSA-N 298.342 2.229 10 10 CECE COc1cccc(O)c1CN(C)C[C@@H]1CC[C@H](C)O1 1885290352 YAICEKNVSYDEDD-RYUDHWBXSA-N 265.353 2.400 10 10 CECE COc1cccc(CN2CC[C@@H](C)[C@H](OC)C2)c1O 249203122 RIHWQKHFJLCQHP-BXUZGUMPSA-N 265.353 2.258 10 10 CECE Cc1ccc(O)c(CN2CC[C@H]3CCC[C@]32CN)c1 1889532571 UNSRHUMBJTYFNG-ZBFHGGJFSA-N 260.381 2.404 10 10 CECE CC[C@@H](CCOC)C(=O)N(C)Cc1ccccc1O 1963160900 KIHNOSSHIJPTRE-LBPRGKRZSA-N 265.353 2.413 10 10 CECE CCC(CC)[C@@H](O)CNCc1c(O)cccc1F 1964564065 KBBLUQKGQFZTPL-AWEZNQCLSA-N 255.333 2.418 10 10 CECE COc1ccc2c(c1)nc(CO)n2-c1ccc(N)cc1 76079144 ISNSYEWYRYSFNQ-UHFFFAOYSA-N 269.304 2.109 10 10 CECE CC[C@]1(C)CN(CCO)c2cc(OC)c(OC)cc2N1 76930884 MZYNIBKZBNVFQO-OAHLLOKOSA-N 280.368 2.097 10 10 CECE CNCc1ccc(N2CCC[C@@H]3COC[C@H]32)c(F)c1 690326493 LRGMADAPACDGRO-IUODEOHRSA-N 264.344 2.160 10 10 CECE C[C@@H](C(=O)O)N(C)Cc1c(O)cccc1Br 706673841 JCAGYUVYWDRGFU-ZETCQYMHSA-N 288.141 2.060 10 10 CECE CC[C@@H]1CN(c2ccc(CN)c(Cl)c2)CCN1C 110699156 LYNVHMDHORDNNM-GFCCVEGCSA-N 267.804 2.329 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@@H]2CCCC[C@H]21 712412250 AVCCKWAYYRRVNT-UMNHJUIQSA-N 252.318 2.008 10 10 CECE CC(C)[C@@H]1COC[C@@H]1N(C)c1ccc(CN)cc1F 688158681 LGQCLFNAQYJTKR-WFASDCNBSA-N 266.360 2.392 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H]1CCCCCN1 80997033 YSTJTHLARQTLND-JSGCOSHPSA-N 276.380 2.444 10 10 CECE Cc1ncc(CN[C@@H](C)c2ccc(F)cc2O)n1C 689215138 WRDMAUAHEGYSLL-VIFPVBQESA-N 263.316 2.424 10 10 CECE Nc1ccc(OCC(=O)NC[C@@]23CCCC[C@@H]2C3)cc1 693535918 UWMUECXUHOFYHX-WBMJQRKESA-N 274.364 2.344 10 10 CECE CNCc1ccc(N2CC[C@H](N(C)C)[C@@H](C)C2)cc1C 693663301 UTBLQVCMZRMYGS-YOEHRIQHSA-N 275.440 2.491 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N(C)[C@@H]3CCC3(C)C)cc21 694276866 KZHOZCIJZIMXAZ-KGLIPLIRSA-N 273.380 2.288 10 10 CECE CCN(CC(=O)Nc1ccc(N)cc1)C[C@@H]1C[C@H]1C 698403405 WJLAEASCUXXKQQ-NEPJUHHUSA-N 261.369 2.185 10 10 CECE COc1ccc(CN(C)[C@H]2CCCC[C@@H]2CN)c(O)c1 89118111 SFGHXFRLLXWVPJ-DOMZBBRYSA-N 278.396 2.350 10 10 CECE CCOC1CCN(c2ccc([C@@H](C)N)c(O)c2)CC1 93670643 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2.415 10 10 CECE C[C@H](NCc1ccc(O)cc1O)c1nccs1 70942394 MAKHXTIDDOJCAR-QMMMGPOBSA-N 250.323 2.405 10 10 CECE CC[C@H](NCCOCCCN)c1ccc(N(C)C)cc1 863544787 AWDHOMSYGJRZEM-INIZCTEOSA-N 279.428 2.159 10 10 CECE CC(C)[C@@]1(C)CC(=O)N1C(=O)Nc1ccc(N)cc1 1876170752 AGOHSAJSSZLSKF-CQSZACIVSA-N 261.325 2.448 10 10 CECE CO[C@H](CNCc1ccc(Cl)cc1O)[C@@H]1CCOC1 1560927517 SSZOGEFCKDDRFB-BXUZGUMPSA-N 285.771 2.187 10 10 CECE C[C@@H]1C[C@@H](COC(=O)c2cc(O)cs2)CCO1 783609149 WGBDYQUZFMPUJF-BDAKNGLRSA-N 256.323 2.426 10 10 CECE Cc1nc(NN)sc1CN(C)Cc1ccccc1O 1877523459 FXXTWXLGMYOMRL-UHFFFAOYSA-N 278.381 2.075 10 10 CECE COC[C@@H](NCc1cccc(C)c1O)[C@@H]1CCCOC1 895855897 UPLOGNKWTFJNGO-HUUCEWRRSA-N 279.380 2.232 10 10 CECE CCN[C@@H](C)c1cc(F)c(N2CC[C@@H](O)C2)c(F)c1 1880962156 HDCVPMDWAZWQCK-GXSJLCMTSA-N 270.323 2.206 10 10 CECE CCCN=c1nc(Sc2nccs2)s[nH]1 1957601828 IARIFQHIDMLANJ-UHFFFAOYSA-N 258.397 2.390 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3C[C@@H](C2)C3)c([N+](=O)[O-])c1 1899781817 VXAWLUCDUSJJAB-MXWKQRLJSA-N 262.309 2.494 10 10 CECE C[C@@H]1CC[C@H](CN(C)c2c(F)cc(CO)cc2F)O1 1885285045 UBZKIECNFMAONH-MWLCHTKSSA-N 271.307 2.461 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)NCCN=[N+]=[N-])C1 1885562729 JWBOWMHOWMORLE-VHSXEESVSA-N 297.359 2.106 10 10 CECE Oc1ccc2c(c1)[C@@H](c1ccc(O)c(O)c1)NCC2 83595488 WEGDYXAUSIKPMW-OAHLLOKOSA-N 257.289 2.039 10 10 CECE O=C(c1cccs1)[C@@H]1NCCc2cc(O)c(O)cc21 83724817 CVEVWHINVBXABT-CYBMUJFWSA-N 275.329 2.229 10 10 CECE CNCc1ccc(N2C[C@@H]3CN(C)C[C@@]3(C)C2)cc1Cl 702419176 ZXVRYNUHUPUDME-BBRMVZONSA-N 293.842 2.447 10 10 CECE Nc1ccc(CC(=O)N[C@@H](C(F)F)C2CCC2)cc1 1893195104 VCPHCCGFXSGNQB-CYBMUJFWSA-N 268.307 2.361 10 10 CECE CC[C@@](C)(N)C(=O)N(C)[C@H](C)c1ccccc1O 94235703 SCUCGXQCOSYBRN-QMTHXVAHSA-N 250.342 2.039 10 10 CECE CC[C@@H]1CN(c2ccc(CNC)c(Cl)c2)C[C@H]1O 399931618 ACLPVVVJXOZAAL-QMTHXVAHSA-N 268.788 2.267 10 10 CECE Cc1ccc(CN2CC(C)(C)C[C@H]2C(=O)O)c(O)c1 1964728888 SXNGKBHFLHGAJN-LBPRGKRZSA-N 263.337 2.386 10 10 CECE C[C@H](O)CN(c1ccc(CO)c(Cl)c1)C1CC1 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[N-]=[N+]=NC1CCN(C[C@@H]2CC3(CCOCC3)CO2)CC1 1912159319 GODKURUXYYBDTK-ZDUSSCGKSA-N 280.372 2.347 10 10 CECE [N-]=[N+]=NC1CN(C(=O)[C@@H]2Cc3ccccc3S2)C1 1912158866 ACPISMJOHKMIQO-NSHDSACASA-N 260.322 2.225 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(CC(=O)Nc2cccnc2Cl)C1 1912196118 SOUSVQWWVUIIIH-SECBINFHSA-N 294.746 2.448 10 10 CECE Cc1cccc(OCC(=O)N2CC[C@@H](N=[N+]=[N-])C2)c1 1912163885 PEAXEFABHQYTTM-LLVKDONJSA-N 260.297 2.285 10 10 CECE CC(C)OC[C@H](O)CN1CCCC[C@H](CN=[N+]=[N-])C1 1912191684 UWSPNLOSPIDYDX-CHWSQXEVSA-N 270.377 2.185 10 10 CECE Cc1cnc2c(S(=O)(=O)NCCN=[N+]=[N-])cccc2c1 1912207431 OCZOUILZNFNEBX-UHFFFAOYSA-N 291.336 2.132 10 10 CECE C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)N(C)CCN=[N+]=[N-] 1912209700 BQPYNPRLSFQQDP-GMTAPVOTSA-N 253.350 2.016 10 10 CECE Cc1ccnc(C(=O)N(C)Cc2ccccc2O)c1 1912387045 UMONUAFETSFOFW-UHFFFAOYSA-N 256.305 2.368 10 10 CECE CCC(=O)N(CC)CCNCc1ccc(OC)c(C)c1 1668339237 YVDPWAXZHGUXPA-UHFFFAOYSA-N 278.396 2.352 10 10 CECE C[C@@H]1CCC[C@@H]1S(=O)(=O)N(C)Cc1ccccc1O 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266.385 2.270 10 10 CECE COc1ccc(N(C)[C@@H]2CCO[C@@]3(CCOC3)C2)cc1 2279053667 IWYJFAMZYMLFAW-ZBFHGGJFSA-N 277.364 2.470 10 10 CECE CSc1ncc(CNC(=O)[C@H]2CCNC3(CC3)C2)s1 2269093014 AQPWFEVXIWVWDD-VIFPVBQESA-N 297.449 2.013 10 10 CECE CCOC1CC(NC(=O)NCc2cccc(C)c2O)C1 2280161008 IWHZJEYWBLKVPN-UHFFFAOYSA-N 278.352 2.067 10 10 CECE CO[C@@]1(CN(C)c2ccc([C@@H](C)O)c(C)c2)CCOC1 2285160102 ZTSOEWRHZLXUJH-CZUORRHYSA-N 279.380 2.290 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)ccc1[C@H](C)O 2285166288 SXJPZMZESXNGQD-BQZKTKNUSA-N 273.376 2.254 10 10 CECE COc1ccc(CN=c2[nH][nH]c3ccccc23)c(O)c1 2296378127 OMCOJENIUKEIEM-UHFFFAOYSA-N 269.304 2.311 10 10 CECE NC[C@@H]1CC(F)(F)CN1c1ccc2c(c1)OCCCO2 2296496520 JBCADNSJCAIPFQ-NSHDSACASA-N 284.306 2.021 10 10 CECE CN(C)c1ccc(CNC[C@@H](O)COC(C)(C)C)cc1 1253475379 AONFDSLQCIDCDV-OAHLLOKOSA-N 280.412 2.018 10 10 CECE C[C@@]1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])CCCCO1 2312334487 XVVRZVMMCJQLIE-SCVCMEIPSA-N 252.318 2.293 10 10 CECE CCN(CCN=[N+]=[N-])S(=O)(=O)C1[C@@H]2CCCC[C@@H]12 2315992877 SPYOVUFGBLRDLP-NXEZZACHSA-N 272.374 2.137 10 10 CECE CCN1CCc2cc([C@H](CC3(C)OCCO3)NC)ccc21 2328101289 RLIZDZPLVZCVSM-HNNXBMFYSA-N 290.407 2.483 10 10 CECE CSc1cc(N2CC[C@]2(C)CCO)ccc1CN 2328538085 HAJSMZFJPNRVDI-CQSZACIVSA-N 266.410 2.218 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@@H]2C[P@](C)(=O)C[C@H]2O)c1 2330863752 LHKKXBXNHWETGH-OFHFECEISA-N 283.308 2.087 10 10 CECE C[C@H](NC[C@H]1[C@@H]2CCOC[C@@H]21)c1cc(O)ccc1O 2331249398 IQXAQQIWKOFGGS-RETIQXCHSA-N 263.337 2.031 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@H](O)[C@H](C)C3)ccc21 2331550614 IZOKGTIBPVATTC-XFBWCDHKSA-N 260.381 2.100 10 10 CECE CO[C@@H](C)[C@H](NCc1cccc(O)c1O)C(F)(F)F 2336428853 BFRCRCWBYGWKCA-CPCISQLKSA-N 279.258 2.153 10 10 CECE CC[C@]1(C)[C@H](O)CCN1c1ccc([C@H](C)N)c(O)c1 2336753376 JVSMAUCIIFAGOH-COLVAYQJSA-N 264.369 2.152 10 10 CECE OCc1ccc(N2CCc3nccn3CC2)cc1Cl 2337174618 GBYKWWUUTZQRJN-UHFFFAOYSA-N 277.755 2.092 10 10 CECE OCCCN(c1ccc(CO)c(C2CC2)c1)C1CC1 2339159473 FCJLOIQGRBHXDM-UHFFFAOYSA-N 261.365 2.408 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@@H](F)[C@@H](CO)C2)c1C 2340848169 JYSNGXHOUNCUQR-YRGRVCCFSA-N 267.344 2.123 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CCN(C)[C@@H]3C[C@@H]32)c1C 2340848618 ZLUGSNXDTJONAU-WQVCFCJDSA-N 260.381 2.249 10 10 CECE Cc1c([C@@H](C)N)ccc(N2CC=C[C@@]2(C)CO)c1C 2340861401 JNAUYKCHIZHYGT-CJNGLKHVSA-N 260.381 2.450 10 10 CECE COc1cc(Cl)c(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c(OC)c1 2342285993 URQLYBVQFDPRIZ-URLYPYJESA-N 283.755 2.032 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@@H](O)C3)c(F)c1F 2349981670 GSQLVPOGQKUZPK-QXEWZRGKSA-N 269.291 2.323 10 10 CECE CN(Cc1cc2c(cc1O)OCO2)C[C@H]1C[C@@H](F)C1 2352530469 FYVQTJJEWOKGHT-JGZJWPJOSA-N 267.300 2.301 10 10 CECE CC[C@](C)(CO)CN1CCN(c2ccc(OC)cc2)CC1 51292101 ROQOLSKLIVMUPF-KRWDZBQOSA-N 292.423 2.226 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H](O)C2)c(Cl)c1 61696779 IMDFOZPUCBXSMC-KOLCDFICSA-N 254.761 2.321 10 10 CECE CN1CCc2cc([C@]3(O)C[C@@H]4[C@H]3[C@@H]3CC[C@H]4O3)ccc21 2356889415 TYKUJMMNUKGPFI-PYIOCPRISA-N 271.360 2.064 10 10 CECE COc1cccc(CN[C@@H]2C[C@H]3C[C@@H](OC)C[C@H]32)c1O 2357079950 VDHOIKJHHKWVMM-AAVRWANBSA-N 277.364 2.304 10 10 CECE COC[C@H]1CCN([C@H](C)c2c(O)cccc2O)C1 300438364 ARWKORMSHGATPY-MNOVXSKESA-N 251.326 2.127 10 10 CECE COc1cc(O)c(C2(N)CC2)c(OC)c1Br 219145428 DIVINTGWPONNQC-UHFFFAOYSA-N 288.141 2.120 10 10 CECE CCN1C(=O)CC[C@H](N)[C@H]1c1ccc2c(c1)CCCN2C 70985471 UIGAAAKSKFEHHR-WMLDXEAASA-N 287.407 2.080 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CC1(C(=O)O)CCCC1 2223148577 NHHOIMKVQUYTJQ-JTQLQIEISA-N 252.318 2.406 10 10 CECE CNC(=O)[C@H](CC(C)C)N[C@@H](C)c1ccc(OC)cc1O 37160599 JHMNNZRYGWWCBK-FZMZJTMJSA-N 294.395 2.212 10 10 CECE CN[C@@H](C)c1ccc(N2CCS(=O)CC2)cc1Cl 78905848 GNPOYFIQSUGPRX-JTQLQIEISA-N 286.828 2.189 10 10 CECE CC(C)N(CCCO)c1ccc([C@H](C)N)cc1F 42509168 HELCLWLLFPANAW-NSHDSACASA-N 254.349 2.443 10 10 CECE c1cn(CCNCc2ccc(N3CCCCC3)cc2)nn1 136318641 XRABUKGZRONDAD-UHFFFAOYSA-N 285.395 2.058 10 10 CECE COc1ccc(N2CCNC[C@@H]2C(C)C)cc1F 83393389 REBOWTAPVUPEDJ-CYBMUJFWSA-N 252.333 2.269 10 10 CECE CCc1cnc(CNCc2ccc(O)cc2O)s1 230706455 NUMRCLNPJMNXQD-UHFFFAOYSA-N 264.350 2.407 10 10 CECE COc1ccc(N(C)CC[C@@H]2CCC[C@]2(N)C(=O)O)cc1 93592695 JUQIWNOKNKFOBN-BLLLJJGKSA-N 292.379 2.104 10 10 CECE C[C@H](Cc1c(O)c(O)cc(Br)c1F)C(=O)O 258429648 DVXQYNFARUSNLS-SCSAIBSYSA-N 293.088 2.263 10 10 CECE CCOC(=O)CCc1ccc(Br)c(O)c1O 260050479 DHFKWRWNYUWYBQ-UHFFFAOYSA-N 289.125 2.356 10 10 CECE CCOCc1cc(CNC(C)(C)[C@H](C)O)ccc1OC 270550148 BIBINRVOSDZQCH-LBPRGKRZSA-N 281.396 2.481 10 10 CECE Oc1ccccc1CNC[C@@H]1CCC2(CCOCC2)[C@@H]1O 282984396 ZVWRJXZTACDRNA-GOEBONIOSA-N 291.391 2.050 10 10 CECE C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1CC(=O)O 722673112 OFWOOVFTWLVHBD-GXTWGEPZSA-N 276.380 2.295 10 10 CECE N[C@@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)CC1(F)F 2162659585 MSFLKVSKNBHKFV-SNVBAGLBSA-N 292.232 2.181 10 10 CECE CCN1CCc2cc([C@H](O)[C@@]34C[C@H]3C[C@@H](N)C4)ccc21 2163062671 NBWWJBBODOUDQO-TXCZRRACSA-N 272.392 2.230 10 10 CECE CCN1CCc2cc([C@@H](O)C3CC4(CNC4)C3)ccc21 2163068301 GMRRJCJEHKEONE-MRXNPFEDSA-N 272.392 2.102 10 10 CECE COCC(C)(C)[C@@H](NN)c1ccc(N2CCCC2)cc1 2163091166 DVCWSAVYHZRBKE-HNNXBMFYSA-N 277.412 2.464 10 10 CECE Cc1nccn1C[C@@H](N)c1ccc2c(c1)CCCN2C 2163107651 TVEHFFGAYJKZKG-OAHLLOKOSA-N 270.380 2.274 10 10 CECE COc1ccc(O)c([C@@H](C)N2CC[C@@H]2CCC(=O)O)c1 2165709237 UIWJVPJISAAXOH-MNOVXSKESA-N 279.336 2.401 10 10 CECE C[C@@H](O)c1ccc(N(C)Cc2cc(Cl)n(C)n2)cc1O 2166508989 XNJISRPOADKQSO-SECBINFHSA-N 295.770 2.469 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CCO[C@@H]2C[C@@H]21 814172351 JGCFYHGVTWCOPS-WDEREUQCSA-N 257.692 2.158 10 10 CECE C[C@H](N)c1ccc(N(C)CC(=O)N2CCCC2)cc1Cl 723197196 DUPSQUJQCGRUFC-NSHDSACASA-N 295.814 2.418 10 10 CECE COc1ccc(N2CCCC[C@]2(C)CO)c([N+](=O)[O-])c1 722995630 NVCODJIIBGTUSR-CQSZACIVSA-N 280.324 2.345 10 10 CECE CCOC1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCC1 831925430 XGROZNKBGYIMQO-NSHDSACASA-N 293.363 2.104 10 10 CECE Cc1cc(CC(=O)NC2(CO)CC2)c(C)n1-c1ccccc1 831103325 LRBJIUYWGMVIBF-UHFFFAOYSA-N 298.386 2.278 10 10 CECE COc1cccc(CN2CCc3ccccc3[C@@H]2CN)c1O 843128026 GZRBMAAQYAOVNG-INIZCTEOSA-N 298.386 2.459 10 10 CECE Cc1cccc(CNC(=O)NCc2ccccc2O)n1 748459348 GALSGZMMKJOKOE-UHFFFAOYSA-N 271.320 2.095 10 10 CECE CC[C@@H](O)CC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840555935 SQJYTEZRNPHQLE-CZUORRHYSA-N 292.423 2.269 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@@H](CN)[C@@H](C)C2)c1O 923503699 LDNFUURRVMDTAZ-JQWIXIFHSA-N 294.370 2.151 10 10 CECE CCNCc1ccc(N2C[C@@H](C)C(O)[C@H](C)C2)cc1 688138248 PSZDGOASFBHENT-CHWSQXEVSA-N 262.397 2.249 10 10 CECE C[C@@H]1CC[C@@H](N)CN1Cc1ccc(Br)cc1O 700990032 GWAZQADUCCFORF-BXKDBHETSA-N 299.212 2.466 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCS[C@@H](C(=O)O)C2)c1 699289623 SPSZBBCVFRSIMN-ZWNOBZJWSA-N 281.377 2.264 10 10 CECE CCNCc1ccc(N2CC(N(CC)CC)C2)c(F)c1 697783827 UPLDOHRBBRLUTE-UHFFFAOYSA-N 279.403 2.466 10 10 CECE O=S(=O)(C1CCCCC1)N1Cc2cccc(O)c2C1 867690589 JVWBIXTVDPQKLL-UHFFFAOYSA-N 281.377 2.370 10 10 CECE O=C(N[C@H](C1CCC1)[C@H]1CCOC1)c1cc(O)cs1 871308941 YEZQQKFHPSYHMJ-GXFFZTMASA-N 281.377 2.389 10 10 CECE O=C(O)[C@H](CNCc1ccc2c(c1)CCO2)CC1CC1 1118290326 JVUKGQTXQAOSDL-AWEZNQCLSA-N 275.348 2.212 10 10 CECE Cc1cc(C(=O)NCCCCN=[N+]=[N-])nc(Cl)n1 701317683 UJPJAGARJFVFTG-UHFFFAOYSA-N 268.708 2.259 10 10 CECE NCC[S@](=O)(=Nc1ccc(N)cc1)c1ccccc1 1876349870 OCBKZBILUOKWGG-LJQANCHMSA-N 275.377 2.386 10 10 CECE C[C@@H]1CO[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 896691724 MDRWVFVOMARPGN-ZBEGNZNMSA-N 289.375 2.312 10 10 CECE CN(CCN(Cc1ccc(N)cc1)C1CC1)C1CC1 1879255401 UFJXSKHWJCGCLU-UHFFFAOYSA-N 259.397 2.327 10 10 CECE CN1CCc2cc([C@H](O)[C@@]34CCOC[C@H]3C4)ccc21 1880000111 WRYJLAXZIUBAPF-VNQPRFMTSA-N 259.349 2.139 10 10 CECE C[C@H](N)c1cc(F)c(N(C)C2(CO)CCC2)c(F)c1 1880931947 PMUBAEBHALHZMV-VIFPVBQESA-N 270.323 2.336 10 10 CECE Cc1cc(CN[C@H]2CCc3cccc(O)c32)nn1C 1964457318 OKKDBIUIOWBZHT-ZDUSSCGKSA-N 257.337 2.211 10 10 CECE CC(C)C[C@H](CO)CNCc1cc(F)ccc1O 1962902794 KZZXLDCNEBCWAP-NSHDSACASA-N 255.333 2.276 10 10 CECE Cc1cccc([C@@H]2NCCc3c(O)ccc(O)c32)n1 75799584 OBOUQTPBGPUCTQ-HNNXBMFYSA-N 256.305 2.036 10 10 CECE Nc1ccc(Cn2c(N)nc3cccc(F)c32)cc1 75948148 QMMATNNAAUDXHS-UHFFFAOYSA-N 256.284 2.388 10 10 CECE COc1ccc(CNC[C@@H](O)CC(F)(F)F)cc1C 1963438328 GOKGWFHEJSCHTQ-NSHDSACASA-N 277.286 2.407 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)CN(CC)C(=O)OC(C)(C)C 1887717311 IPSOHDXWNQAUSE-UHFFFAOYSA-N 299.375 2.402 10 10 CECE O=C(O)c1cccc(Cn2cnc3cc(O)c(O)cc32)c1 77019080 WDOOHUHCHMVRPC-UHFFFAOYSA-N 284.271 2.194 10 10 CECE OC[C@]1(CNCc2cc(F)cc(F)c2O)CC12CCC2 1963637648 WYUPQAANBYIQBV-OAHLLOKOSA-N 283.318 2.313 10 10 CECE CCO[C@H]1CCN(c2ccc([C@H](C)O)cc2F)C1 701707264 SOUPDYNXILBOHM-JQWIXIFHSA-N 253.317 2.494 10 10 CECE Nc1cc(F)cc2c1CCN[C@H]2c1ccccc1O 83628016 AILAJBQIPKFMDO-HNNXBMFYSA-N 258.296 2.349 10 10 CECE COc1cc2c(cc1Cl)N(CCN)C[C@@H](C)C2 84107286 JCVDSLHIFKNFHZ-VIFPVBQESA-N 254.761 2.306 10 10 CECE COc1ccc(O)c(CNC[C@@H](OC)C2CCC2)c1 703129828 JBLMUMNNTRTJDY-OAHLLOKOSA-N 265.353 2.306 10 10 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CC[C@H](c1ccccc1O)N(C)[C@H]1COC[C@@H]1OC 2120779040 HSQBFVDSZZDBRS-IPYPFGDCSA-N 265.353 2.189 10 10 CECE CO[C@@H]1C[C@H]2[C@H]1CCN2c1ccc([C@H](C)N)cc1F 2121832001 ODQGLTRBQUGLND-OCVOHJKQSA-N 264.344 2.459 10 10 CECE COc1ccc(C(=O)NCc2cccc(O)c2O)cc1 1643810133 WGORUNMOPURWEA-UHFFFAOYSA-N 273.288 2.036 10 10 CECE C[C@H]1CCC[C@H](S(=O)(=O)N(C)CCN=[N+]=[N-])C1 1912160916 BXVOUYCUZUKOKS-UWVGGRQHSA-N 260.363 2.137 10 10 CECE C[C@@H]1CCS[C@H]1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912154178 AJUYBYYIHTXYDF-OPRDCNLKSA-N 254.359 2.429 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(N)=O)CCCCCCC1(F)F 1912175056 HQAVHUGREHSIBA-LLVKDONJSA-N 289.330 2.490 10 10 CECE C[C@@H]1CCC[C@@H](S(=O)(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 1912143501 HBSWVHHIDSSYDY-GMTAPVOTSA-N 272.374 2.280 10 10 CECE CN(CCN=[N+]=[N-])CC(=O)NCCC1=CCCCC1 1912143700 JMSFWZQVFXPPGB-UHFFFAOYSA-N 265.361 2.235 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCO[C@H]2CCCCO2)C1 1912179235 QYPOOQKNNIBPEI-RYUDHWBXSA-N 254.334 2.162 10 10 CECE 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CC[C@@H](C(=O)O)N1C[C@@H](C(C)C)Oc2cc(CN)ccc21 251237683 SBYNXSJGYHDNSL-WFASDCNBSA-N 292.379 2.232 10 10 CECE Cc1cc2c(cc1N(C)C[C@H]1CCCCN1)OCO2 258785269 BOTXGXHLXNXFOI-GFCCVEGCSA-N 262.353 2.302 10 10 CECE CO[C@@H]1CC[C@H](N(C)c2ccc([C@@H](C)O)c(O)c2)C1 2130734277 PDTHMBWSYUATQV-NTZNESFSSA-N 265.353 2.449 10 10 CECE CCOc1cccc(CNCC(=O)OC2CCCC2)c1O 1857872718 ZBMLVJWQGCWJLJ-UHFFFAOYSA-N 293.363 2.366 10 10 CECE CCN(c1ccc([C@@H](C)NC)cc1F)C1COC1 1915657498 SWLCCYIUQCENNP-SNVBAGLBSA-N 252.333 2.331 10 10 CECE CS[C@@H]1CC[C@@H](NCc2ccc(O)c(O)c2)C1 226758960 NRMWRPSKVWOMLE-GHMZBOCLSA-N 253.367 2.472 10 10 CECE CC[C@@H]1C[C@H](N(C)c2ccc(CN)c(OC)c2)CO1 2139682561 JMURGRZBVSPEHJ-UONOGXRCSA-N 264.369 2.158 10 10 CECE CC[C@H]1COC[C@H]1N(C)c1ccc(CO)c(OC)c1 2139700372 IVNHIUUSWGTHCA-SMDDNHRTSA-N 265.353 2.049 10 10 CECE CC[C@H](NC[C@H]1C(=O)NCC[C@@H]1C)c1ccccc1O 1967509720 AKTVYANAFGAAPG-YUTCNCBUSA-N 276.380 2.205 10 10 CECE Cc1ccc([C@H](C)NC[C@H]2C(=O)NCC[C@H]2C)c(O)c1 1967512276 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2143427717 VIKWPAXTMVVGDQ-MRXNPFEDSA-N 280.412 2.080 10 10 CECE COCCOCCCN1CCc2cc(N(C)C)ccc21 2143425665 KBKYCEVCISVDME-UHFFFAOYSA-N 278.396 2.168 10 10 CECE COC(=O)C(C)(C)[C@@H](N)c1ccc(N(C)C)c(F)c1 1951878961 JSFWLWBGVXLDOK-LBPRGKRZSA-N 268.332 2.091 10 10 CECE CC(C)(C)OC(=O)Nc1ccc(O)c([C@@H]2C[C@@H](O)CN2)c1 1952344799 VCZUZUUTEZRCLR-PWSUYJOCSA-N 294.351 2.135 10 10 CECE CN(C)[C@@H](CCNCc1cccc(O)c1O)C(F)(F)F 2143712837 MBHKARXZEHZZBK-NSHDSACASA-N 292.301 2.070 10 10 CECE CCNc1cc[nH]c(=NCCc2ccc(O)c(O)c2)c1 2147997226 UYPAFMWLRXWCPH-UHFFFAOYSA-N 273.336 2.001 10 10 CECE CO[C@@H]1CC[C@@H]2CN(c3ccc([C@H](C)N)c(O)c3)C[C@@H]21 2144214320 ZAVGOFMLOGONJV-FJXFWJLJSA-N 276.380 2.273 10 10 CECE COc1cc(F)cc([C@H](O)[C@H](N)c2ccccc2O)c1 2148162876 QHAIIOJMTKCAIV-CABCVRRESA-N 277.295 2.273 10 10 CECE CN1C[C@@H](CN)C[C@H]1c1ccc(C(F)(F)F)cc1O 258617366 OINGXOVQFNSBKL-KCJUWKMLSA-N 274.286 2.363 10 10 CECE OCc1ccc(N2CCOC[C@H]2[C@@H]2CCOC2)c(Cl)c1 2144936908 KDEFCKUTVRSXKD-DOMZBBRYSA-N 297.782 2.074 10 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2.454 10 10 CECE COC[C@H]1CN(c2ccc(CO)c(Cl)c2)C[C@@H]1COC 2149259286 KZRUPACCPXTUIL-CHWSQXEVSA-N 299.798 2.178 10 10 CECE CNCc1ccc(N(C)Cc2cnn(C)c2)c(Cl)c1 163995174 UIYIEFHZVOPDJQ-UHFFFAOYSA-N 278.787 2.429 10 10 CECE CC[C@@H](NCCc1nccn1C)c1ccccc1O 40638787 CJNIZEKNOPDHBS-CYBMUJFWSA-N 259.353 2.409 10 10 CECE COC1(CN(C)c2ccc(CO)cc2Cl)CC1 2002551091 AOEGEEVUHXZTPJ-UHFFFAOYSA-N 255.745 2.448 10 10 CECE Cn1nc(CN2CCC[C@H](N=[N+]=[N-])C2)cc1Br 2002883640 QVCSLKBZIKGSJH-QMMMGPOBSA-N 299.176 2.457 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)C[C@H]1C=CCC1 2153115190 WBWBJUNTTCSWBV-OLZOCXBDSA-N 273.380 2.494 10 10 CECE COCCCOc1ccc(N2CCC[C@@H](N)C2)cc1 43470951 AKBYGSHGAHIDMI-CYBMUJFWSA-N 264.369 2.029 10 10 CECE CC1(C)C[C@H](O)CN1c1ccc(CNC2CC2)cc1F 2154826205 ANOZOLQVCXQIPM-ZDUSSCGKSA-N 278.371 2.427 10 10 CECE COC[C@@H]1C[C@H]1CNCc1cc(Cl)ccc1O 2015835322 BXMWPBJFIMUJHC-ONGXEEELSA-N 255.745 2.418 10 10 CECE Oc1c(Br)cccc1CN[C@@]12CCOC[C@H]1C2 2018538587 OMPXCJCKFXBWLU-ZWNOBZJWSA-N 298.180 2.423 10 10 CECE CCN(C(C)C)[C@H](CN)c1ccc2c(c1)CCN2C 50287071 YOLKFFMCIYFRCW-MRXNPFEDSA-N 261.413 2.409 10 10 CECE N[C@H]1CN(Cc2cc(Cl)ccc2O)C2(CCOCC2)C1 2156303887 JYRPDDUPXUHVLM-CYBMUJFWSA-N 296.798 2.128 10 10 CECE C[C@H](O)c1ccc(N(C)CP(C)(C)=O)cc1O 2021445003 ZKXVAHJZIQVOFN-VIFPVBQESA-N 257.270 2.462 10 10 CECE CCCn1nncc1CN(C)c1ccc([C@@H](C)N)cc1 2156469681 VHOSWBSWFNQLAU-GFCCVEGCSA-N 273.384 2.344 10 10 CECE CNCc1ccc(N2C[C@H](O)C2(C)C)c(Br)c1 2023146839 OGWUWKZIPFYEMB-LBPRGKRZSA-N 299.212 2.128 10 10 CECE CN(C)c1ccc(CN2CCN3CCC[C@@H]3C2)cc1 179545304 QFCPRSVMMSVIJE-MRXNPFEDSA-N 259.397 2.033 10 10 CECE CN(CCOC(F)F)c1ccc(CN)cc1Cl 2023983962 FGHUHFUZOAKWRG-UHFFFAOYSA-N 264.703 2.474 10 10 CECE COc1ccc(N2CCN(C(=O)C=C(C)C)CC2)cc1 58177310 CXAMMCAOOYORSL-UHFFFAOYSA-N 274.364 2.310 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@H](N2CCCC2)C1 300438382 BIDFTSBSAIUADM-STQMWFEESA-N 276.380 2.329 10 10 CECE O=C(O)[C@@H]1C[C@@]12CCCN(Cc1c(O)cccc1F)C2 2160779929 MDUWLGJMGUUXCT-XHDPSFHLSA-N 279.311 2.218 10 10 CECE COc1cccc(O)c1CN[C@H](C)[C@@H]1C[C@@H]2CCO[C@H]12 2160715228 WDYJDKNVPMHQHB-YRORDHRNSA-N 277.364 2.304 10 10 CECE Oc1ccc(CN[C@H]2COc3ccccc32)cc1O 70529016 MRPOTHFMUQDEGI-LBPRGKRZSA-N 257.289 2.321 10 10 CECE C[C@H]1C[C@H](N(C)c2ccc([C@@H](C)N)cc2F)CO1 401589467 VTIJFWPRQDXPHJ-UMNHJUIQSA-N 252.333 2.459 10 10 CECE C[C@@H](OCc1ccccc1)C(=O)NCc1ccc(N)cc1 404444655 ZMCZFKGNTKHERN-CYBMUJFWSA-N 284.359 2.490 10 10 CECE Nc1ccc(CNC(=O)c2ncoc2C(F)(F)F)cc1 2160334312 QNUFFLBCZGYQQU-UHFFFAOYSA-N 285.225 2.206 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@H]1CCC(=O)O 313339451 MHDOBDWKWWWJHP-MNOVXSKESA-N 279.336 2.488 10 10 CECE CC[C@H](NC)c1ccc(N2CC(N3CC(F)C3)C2)cc1 2159095833 XLMNQCJFYLHMEC-INIZCTEOSA-N 277.387 2.199 10 10 CECE C[C@H](N)c1ccc(N2CC[S@](=O)C(C)(C)CC2)cc1O 322293514 YEKIKCXFRCCVSN-YBTHPKLGSA-N 296.436 2.149 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)c1ccc(CO)cc1 701291262 LGZNDHVPQFULIM-LBPRGKRZSA-N 260.297 2.094 10 10 CECE CN(C[C@@H]1C[C@]12CC2(F)F)C(=O)c1ccc(O)c(O)c1 2172120465 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C[C@@H](NC(=O)Nc1ccc(N)cc1)[C@@H]1CCCCO1 379186681 RQEASUPWBKDLTC-MFKMUULPSA-N 263.341 2.348 10 10 CECE Oc1cccc2c1[C@H](N1CCC[C@@H]3COC[C@@H]31)CC2 690770652 HMIIATLOPYBYPE-MCIONIFRSA-N 259.349 2.490 10 10 CECE C[C@@H](NCCO[C@H]1CC1(F)F)c1ccc(O)cc1O 690739118 GELKAJNSGQHXDJ-PELKAZGASA-N 273.279 2.173 10 10 CECE COc1ccc(N2CCC[C@@H](N3CCCC3)C2)c(N)c1 382525633 ROQHIZPYGXRDNN-CYBMUJFWSA-N 275.396 2.342 10 10 CECE COCCNCc1ccc(N2CC[C@@H](SC)C2)cc1 383046267 NQTDPPGKBCZRGC-OAHLLOKOSA-N 280.437 2.364 10 10 CECE CN1CC[C@@H]2CN([C@H]3CCc4cccc(O)c43)C[C@@H]2C1 383402545 ZFMPLNIHCOHWAZ-ILXRZTDVSA-N 272.392 2.263 10 10 CECE CC1(C)CN(c2c(F)cc(CN)cc2F)[C@@H]2COC[C@H]21 384608684 LLJQILAURMJZCZ-ZWNOBZJWSA-N 282.334 2.285 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC[C@@H]3CNC[C@@H]3C2)c1 388528637 WVVXNCRMDCWHIC-BFHYXJOUSA-N 260.381 2.303 10 10 CECE CCC1(CNCc2ccc(O)cc2O)CCOCC1 389083284 LUWBGQOJKWDLNA-UHFFFAOYSA-N 265.353 2.394 10 10 CECE CCOc1cccc(CN[C@H]2CC[C@H]2OC)c1O 724187381 JFSUGHFUSCBKDL-NWDGAFQWSA-N 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C[C@@H]1C[C@@H](O)[C@@H](C)N(c2ccc([C@@H](C)N)cc2F)C1 2227606804 BYBFLSIGRLKCEK-UYUMYWFVSA-N 266.360 2.441 10 10 CECE COc1ccc(N2CC[C@H](OC)C[C@@H]2C)c(CO)c1 2227708470 IPUTUARCAQQXJH-FZMZJTMJSA-N 265.353 2.191 10 10 CECE O=C1Cc2cc(NCc3ccc(O)cc3O)ccc2N1 2238140796 RTEYPPOKCCICAL-UHFFFAOYSA-N 270.288 2.205 10 10 CECE CN(C[C@H](F)[C@@H]1CCOC1)c1ccc2c(c1)CC[C@@H]2O 2238350224 PRQDKIGHYPDCPO-KCXAZCMYSA-N 279.355 2.477 10 10 CECE CN(C)c1ccc(OC2(C(=O)O)C[C@H]3C[C@@H]3C2)cc1 2229371735 BSXVVZBQTQEOTI-GHMZBOCLSA-N 261.321 2.385 10 10 CECE C[C@H](c1c(O)cccc1O)N(C)C[C@@]1(F)CCOC1 2229941201 UTRQXTFVKOVVHE-YGRLFVJLSA-N 269.316 2.219 10 10 CECE C[C@H]1CN(c2ccc(CNC3CCC3)cc2F)C[C@H]1O 2240079611 PPFIUXFAFFVAPF-MEDUHNTESA-N 278.371 2.285 10 10 CECE CC[C@H](C)NCc1ccc(OC[C@@H]2CC(=O)N2)c(C)c1 2240225495 LGODDPHYDQVUQY-JSGCOSHPSA-N 276.380 2.150 10 10 CECE CN[C@H](C)c1ccc(N2CCC3(CN(C)C3)C2)c(C)c1 2240831100 VNEDFGPDHCQQEB-CQSZACIVSA-N 273.424 2.417 10 10 CECE N=C(N)c1cnc(S[C@H]2C3C[C@@H]4C2[C@@H]4C3)s1 2246259617 HJQCVABIOGNYKE-OYPCKFMDSA-N 251.380 2.174 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c(Cl)c1 2270722696 HIEXBTZCTUGBAX-JYAVWHMHSA-N 280.799 2.267 10 10 CECE Oc1cccc(Cl)c1CNCCN1CC[C@@H]2C[C@H]21 2261362815 VNDKKUPFJQMRFJ-ZWNOBZJWSA-N 266.772 2.229 10 10 CECE Oc1cccc(F)c1CN1CCC[C@@H]2CCNC[C@H]21 2274496747 KDAZPGSBDWRNDX-BXUZGUMPSA-N 264.344 2.105 10 10 CECE O=C(O)[C@@H]1CCN(Cc2ccccc2O)[C@@H]1C1CC1 2264692002 VQALNLIWZVGPPG-TZMCWYRMSA-N 261.321 2.077 10 10 CECE CC[C@]1(C(=O)NCc2cnc(SC)s2)CCCCN1 2269094838 VCOCRCBZDKLRPQ-CYBMUJFWSA-N 299.465 2.404 10 10 CECE Cc1cc(N(C)CCn2cccn2)ccc1[C@H](C)N 2269660948 BWZFWLBSTAMQJI-ZDUSSCGKSA-N 258.369 2.348 10 10 CECE Cc1cc(N2CC(c3nncs3)C2)ccc1[C@H](C)N 2269929271 BUJCZNKLSAOWJU-JTQLQIEISA-N 274.393 2.470 10 10 CECE CO[C@]1(CN(C)c2ccc([C@H](C)N)c(C)c2)CCOC1 2285146617 RIYBXMSZNDKBNL-BBRMVZONSA-N 278.396 2.256 10 10 CECE COc1cc([C@@](C)(N)c2ccc(N(C)C)cc2)ccn1 2286303730 XVGABWIPHNFMNG-INIZCTEOSA-N 271.364 2.378 10 10 CECE CNC[C@]1(O)CCCN(c2ccc(OC(C)C)cc2)C1 2286318488 JYUAMXXAAWWKAY-MRXNPFEDSA-N 278.396 2.025 10 10 CECE COc1cc(N)c(N(CC(C)C)C[C@H](C)O)cc1OC 2288143528 QLVAHFQSEVDUGY-NSHDSACASA-N 282.384 2.129 10 10 CECE CN(C)c1ccc([C@@H](O)C2(N)CC3(CC(F)C3)C2)cc1 2289326705 QFBRUZWGGRUEFN-WUCYIENKSA-N 278.371 2.396 10 10 CECE CCOc1cccc(CN(C)[C@@H]2CNCC2(C)C)c1O 2289960651 WBKGXIHLHYPREL-CQSZACIVSA-N 278.396 2.221 10 10 CECE COc1ccc(O)c(CNC(=O)C=Cc2ccc[nH]2)c1 2310787361 SBTIMPKBEWREAS-UHFFFAOYSA-N 272.304 2.059 10 10 CECE CCNCc1ccc(N(C)CCC[C@H](C)O)cc1 2314473110 VOXMXOSTRGNIPW-ZDUSSCGKSA-N 250.386 2.393 10 10 CECE CCN[C@@H](c1ccccc1O)[C@H]1C[C@@H]2O[C@H]1[C@H]1C[C@@H]21 2328706508 PMLHPCRLDLMLLH-GRFVHPPGSA-N 259.349 2.466 10 10 CECE Oc1cccc2c1[C@@H](NC[C@@H]1[C@@H]3CCCO[C@@H]31)CC2 2330703355 BGFYOAUQSZPDSC-ZWUHOBOKSA-N 259.349 2.394 10 10 CECE CN1CCc2cc([C@H](N)[C@@H]3COCC3(C)C)ccc21 2336170203 VYMAJCQTLSKDSP-ZFWWWQNUSA-N 260.381 2.351 10 10 CECE F[C@H]1COCCN(c2ccc(CNC3CC3)cc2)C1 2336667272 CJDVCBLJAYVGSD-CYBMUJFWSA-N 264.344 2.113 10 10 CECE CCCc1noc([C@H](C)NCc2ccc(N)cc2)n1 2337044310 RIISRGQATMXYKQ-JTQLQIEISA-N 260.341 2.455 10 10 CECE CN(CCNCc1ccccc1O)c1ccccn1 2338070625 HLZMFNUVQXMVNF-UHFFFAOYSA-N 257.337 2.013 10 10 CECE CSc1cc(N2CCO[C@H](CCF)C2)ccc1CN 2353854996 DBNHKLHMXGLYMI-CYBMUJFWSA-N 284.400 2.432 10 10 CECE Oc1cccc(CN[C@@H]2CCC[C@]34C[C@H](CO3)[C@H]24)c1O 2354168574 RIJBEKYUEOJCGA-ZNEHSRBWSA-N 275.348 2.145 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1 2355276661 MNXGGNFDAFEQJQ-XJBGLIRHSA-N 270.376 2.362 10 10 CECE COc1ccc(C(=O)O)cc1NCc1cccc(O)c1O 111310892 HZUUQVCYWGWUPQ-UHFFFAOYSA-N 289.287 2.417 10 10 CECE Clc1nc(Sc2nccs2)nc(-n2ccnc2)n1 61544198 NRBKEXYCJVZRSE-UHFFFAOYSA-N 296.768 2.318 10 10 CECE CN(c1ccc(/C=C\C(=O)O)cc1)[C@H]1CCCOC1 401330416 CFFVMTXVCLWYMS-PIZKADEWSA-N 261.321 2.400 10 10 CECE COCCNCc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1 62734303 IEAWJORUANMUQH-KBPBESRZSA-N 278.396 2.036 10 10 CECE CCOC(=O)c1ccc(N(C)Cc2ccc(N)cc2)nc1 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280263805 XJJHEXLGXUUGKH-GXTWGEPZSA-N 274.368 2.422 10 10 CECE O=C([C@@H]1CNc2ccccc2N1)N1CC[C@H](C(F)F)C1 706359633 OGVNIZIXXVUJNF-CABZTGNLSA-N 281.306 2.006 10 10 CECE COc1ccc(N2CCN[C@@H](C)C[C@@H]2C)c([N+](=O)[O-])c1 2164450967 BCBVJXXHCZSUCO-QWRGUYRKSA-N 279.340 2.180 10 10 CECE Cc1nn(Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 295445093 WABUPYLVKWSDPF-UHFFFAOYSA-N 260.297 2.214 10 10 CECE CC(C)(C)NCc1ccc(N2CC([C@H](F)CO)C2)cc1 2166899943 OAIOISYZNWILIB-OAHLLOKOSA-N 280.387 2.341 10 10 CECE CN1CCc2cc([C@@H](O)Cc3cc(Cl)n(C)n3)ccc21 706177121 SQXOZLRPMCELTM-AWEZNQCLSA-N 291.782 2.342 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@@H]4OCCC[C@H]43)ccc21 2163066626 NVYXFFKXTDORCR-HYVNUMGLSA-N 272.392 2.422 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H](N)CC(C)(F)F)ccc21 2163091822 KVSFGAKIQJHACR-GXTWGEPZSA-N 284.350 2.475 10 10 CECE O[C@H](C[C@@H]1COCCO1)c1ccc(N2CCCC2)cc1 2163096908 ZWQRZZHRNLKWEF-HZPDHXFCSA-N 277.364 2.126 10 10 CECE Cc1n[nH]c(C)c1[C@@H](O)c1ccc2c(c1)CCCN2C 2163108676 YODATSVBKPTDEO-INIZCTEOSA-N 271.364 2.491 10 10 CECE CC[C@H](COC)C[C@H](NN)c1ccc2c(c1)CCN2C 2163144618 SAYPWCBYNVSXEQ-WFASDCNBSA-N 277.412 2.246 10 10 CECE CCN[C@H](c1ccc(N(CC)CC)cc1)[C@H](O)COC 2163153201 CWTFAWDGEVRRFJ-HZPDHXFCSA-N 280.412 2.191 10 10 CECE CN1CCc2cc([C@H](NN)C(F)(F)C(F)(F)F)ccc21 2163157926 JLKMJJPZIGFIFT-JTQLQIEISA-N 295.255 2.381 10 10 CECE COC[C@@H]1CCCCN1C(=O)CCc1ccc(N)cc1 395933105 ATPQBQOWMCOPJZ-HNNXBMFYSA-N 276.380 2.229 10 10 CECE Cc1nc(C)c(CN[C@@H](C)c2cc(O)ccc2O)[nH]1 724680794 MIBMYTMGCIKCMO-QMMMGPOBSA-N 261.325 2.289 10 10 CECE CCOc1ccc(CN2CC[C@H](O)C2(C)C)c(O)c1 812779597 SNMREJUJOXTALV-AWEZNQCLSA-N 265.353 2.136 10 10 CECE C[C@H](N[C@@H]1CCNC[C@@H]1C)c1cc(F)ccc1O 817971956 RYTYBINHEHKXRS-OUJBWJOFSA-N 252.333 2.180 10 10 CECE CCc1cccc([C@H](CF)N2CCOCC2)c1O 575302300 HVSUULKGVCTHOJ-ZDUSSCGKSA-N 253.317 2.297 10 10 CECE Cc1cn(C)nc1CN(C)c1ccc([C@@H](C)N)cc1 723493639 SOCRQXPJDOFAES-GFCCVEGCSA-N 258.369 2.385 10 10 CECE COC[C@](C)(O)CCNCc1cc(Cl)cc(C)c1O 824559433 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CC[C@@](C)(CC(=O)N1CCC[C@H]1CN=[N+]=[N-])C(=O)O 2225796406 WXCFNYVHLUDFAD-CABZTGNLSA-N 268.317 2.179 10 10 CECE COc1ccc(N(C)C[C@@H]2CO[C@H](C)C2)c(CCN)c1 2235973810 UMYVKRGNYANOBD-CHWSQXEVSA-N 278.396 2.058 10 10 CECE CNCc1cc(OC)ccc1N(C)C[C@@H]1CC[C@@H](C)O1 2235955703 UUYCALOYBOGQAF-DOMZBBRYSA-N 278.396 2.418 10 10 CECE C[C@H]1CN(c2ccc3c(c2)COCC3)C[C@H](C)C1O 2226706620 FEQSLUFBEYJDDG-RYUDHWBXSA-N 261.365 2.212 10 10 CECE O[C@H]1CCN(c2ccc(OCC(F)F)cc2)C[C@H]1F 2226741787 XTQXYRWEYBBPSP-NEPJUHHUSA-N 275.270 2.240 10 10 CECE CC(=O)c1ccc(O)c(CN2CC(OC(F)(F)F)C2)c1 2237648831 TWKOPKNVGWDRHK-UHFFFAOYSA-N 289.253 2.315 10 10 CECE COc1ccc(N(C)[C@H]2CC[C@H](C)OC2)c(CO)c1 2227709027 OXMYXYDGARJBOZ-AAEUAGOBSA-N 265.353 2.191 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@]1(F)CCOC1 2238273736 XTGLNYUWKMEPJE-OAHLLOKOSA-N 282.359 2.098 10 10 CECE FC(F)[C@@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCOC1 2239545775 YZSVMFCAEHJDFG-OCCSQVGLSA-N 283.318 2.381 10 10 CECE CC1(CO)CN(c2ccc(CNC3CCC3)cc2F)C1 2240085956 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2285150481 VGLGLXYSYLTMJL-CYBMUJFWSA-N 276.380 2.107 10 10 CECE COc1ccc(N2CCSC[C@H]2CCO)c(OC)c1C 2295462138 ABSWPKSDMZATHP-GFCCVEGCSA-N 297.420 2.316 10 10 CECE Nc1ccc(NC(=O)CC[S@](=O)[C@H]2C[C@@H]3C[C@@H]3C2)cc1 2285654648 XWOZHDODICNVJV-OOZMQQNRSA-N 292.404 2.145 10 10 CECE CC[C@@H]1[C@@H](O)CCN1Cc1cc(F)cc(C(C)=O)c1O 2288912421 YCCQZGSVQRBKAL-KGLIPLIRSA-N 281.327 2.079 10 10 CECE COc1cc(OC)c(N(C[C@@H](C)O)C2CC2)cc1OC 2289447331 MWGTZBGAIUULKV-SNVBAGLBSA-N 281.352 2.062 10 10 CECE Cc1cccc(O)c1CN1C[C@@H](CC(=O)O)C2(CC2)C1 2289746306 FYBUNIZSURVABK-GFCCVEGCSA-N 275.348 2.387 10 10 CECE C[C@@H]1CN(C(=O)/C=C\c2cnccn2)c2ccc(F)cc2O1 491933668 UGNXLDLQHMVAAI-USEMIUTHSA-N 299.305 2.443 10 10 CECE CN(Nc1nc2cccc(Cl)c2s1)S(C)(=O)=O 2301519974 XQLAIPDVEIEXFH-UHFFFAOYSA-N 291.785 2.168 10 10 CECE COc1ccc(N(C)[C@](C)(C(=O)O)C(F)F)cc1 2324317184 LJCUAMPFMBPZEK-LBPRGKRZSA-N 259.252 2.240 10 10 CECE CSc1cc(N2C[C@@H](O)CC[C@@H]2C)ccc1CN 2328541589 WODZEIOCZCGFPD-GWCFXTLKSA-N 266.410 2.217 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H](O)[C@H](C)C2)cc1C 2334469053 XITMEEWWLUWMNW-DVOMOZLQSA-N 262.397 2.483 10 10 CECE CN[C@@H]1CN([C@H](C)c2cc(O)ccc2O)CC1(C)C 2336377455 FPZKZFVIYVNEBC-QMTHXVAHSA-N 264.369 2.089 10 10 CECE CC[C@@]1(C)[C@@H](O)CCN1c1ccc(CNC)cc1F 2336767885 YQSQBPZRGYDTIZ-GJZGRUSLSA-N 266.360 2.285 10 10 CECE C[C@@H](N[C@H]1COC2(C)CC1C2)c1c(O)cccc1O 2337723054 ZTDFMYSBFLFJQO-VQEBWTGLSA-N 263.337 2.316 10 10 CECE [N-]=[N+]=N[C@H]1CCN(CC23COC(C(F)(F)F)(C2)C3)C1 2338191753 IXIKNCZSNZDNGR-IDKOKCKLSA-N 276.262 2.483 10 10 CECE OCc1ccc(N2CC[C@@]3(O)C[C@@H]3C2)cc1C1CC1 2339162680 ATMAQIWLBXCZAC-CZUORRHYSA-N 259.349 2.017 10 10 CECE CO[C@@H]1C[C@H]2C[C@H]1CN2c1ccc([C@@H](C)N)cc1F 2340753475 ZEBPWOLQEKTCKU-JDTTZNEISA-N 264.344 2.459 10 10 CECE Cc1c([C@H](C)N)ccc(N2CCOC[C@H](F)C2)c1C 2340861862 OVDZIJOAOFZPFJ-QWHCGFSZSA-N 266.360 2.498 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC=C(CO)CC2)c1C 2341062670 AEQTWQJVDDFUON-CYBMUJFWSA-N 261.365 2.486 10 10 CECE Cc1ccc(OCc2cnc3c(c2)CCC3)c(N)n1 2342151760 BADNJQMBFQYVBR-UHFFFAOYSA-N 255.321 2.435 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](O)[C@@H](C)[C@@H]2C)c(F)c1 2344542269 HGWKUTQQRXUXDC-VEABSNGSSA-N 266.360 2.441 10 10 CECE C[C@@H](NC[C@H]1O[C@H]2CC[C@H]1C2)c1cc(O)ccc1O 2352701568 QXBVLZVKJRRWQJ-GOMXZESMSA-N 263.337 2.316 10 10 CECE CSc1cc(N2C[C@H](CO)CC[C@@H]2C)ccc1CN 2353855520 MGFFTVLBVZYAQR-NWDGAFQWSA-N 280.437 2.464 10 10 CECE O=C(C[C@H]1CC[C@@H]2C[C@H]12)NCCc1ccc(O)c(O)c1 2353999825 UQSGXPIISGAOMA-UPJWGTAASA-N 275.348 2.193 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H](C)[C@@H]2C[C@H]2C(=O)O)c1 2355489918 DDYNSFHDXROPGT-LKAMGYQZSA-N 279.336 2.161 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H]3[C@@H]4CCOC[C@@H]43)ccc21 2355954771 LNGIJVBZQPWSRB-YQFWSFKMSA-N 272.392 2.351 10 10 CECE CN[C@H]1CCCc2cc(N3CC[C@H]4[C@@H]3C[C@H]4O)ccc21 2356170471 IQQDBELZOAZDKO-LUKYLMHMSA-N 272.392 2.243 10 10 CECE COCc1ccc(C(=O)NCc2cccc(OC)c2O)o1 105652433 OOWWNRYKZRFCSA-UHFFFAOYSA-N 291.303 2.070 10 10 CECE COc1ccc(N2[C@@H]3CC[C@@H]2CC(N)C3)cc1OC 107907576 NHSBMEBAQNQFEI-VXGBXAGGSA-N 262.353 2.162 10 10 CECE Nc1ccc(OCCCN2[C@@H]3CC[C@@H]2CC(O)C3)cc1 111383760 FDNSSQFEDZEBOZ-ZIAGYGMSSA-N 276.380 2.025 10 10 CECE CCN(C[C@H](O)C(C)(C)C)c1ccc(CN)cc1 302433571 SSMZYAJNZIUZPH-AWEZNQCLSA-N 250.386 2.379 10 10 CECE CC(C)N(CC(=O)N1CCCCC1)Cc1ccc(N)cc1 35365406 LQBKWZVZKSTCIY-UHFFFAOYSA-N 289.423 2.492 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1C[C@H]2CCCC[C@@H]2N1 37823742 HDWRBWKRONVASR-VHDGCEQUSA-N 288.391 2.271 10 10 CECE COc1cc(C(F)(F)F)nn1-c1ccc(N)cc1 39172001 HCKIIZZPSIMTPD-UHFFFAOYSA-N 257.215 2.482 10 10 CECE CCCN(CC(=O)N(C)C)c1ccc(/C=C\C(=O)O)cc1 218072400 ZEEGQRUIUMMKND-YFHOEESVSA-N 290.363 2.089 10 10 CECE Oc1c(Cl)cccc1CN1C[C@@H]2CC[C@H](C1)O2 124606377 ALNPXSFQSYSFLJ-PHIMTYICSA-N 253.729 2.409 10 10 CECE CCCNCc1ccc(N(C)[C@H](C)CO)c(F)c1 122681029 HSZZRRGNODPMOF-LLVKDONJSA-N 254.349 2.142 10 10 CECE Cc1ccc(O)c(CNc2ccccc2-n2cnnn2)c1 71407588 OTAOBFMAJJWLME-UHFFFAOYSA-N 281.319 2.288 10 10 CECE CCO[C@H](C)c1noc(-c2cccc(O)c2O)n1 126866656 QIPDOTZXEZRNHO-SSDOTTSWSA-N 250.254 2.245 10 10 CECE C[C@@H](NCc1c(O)cccc1Cl)C(=O)NC(C)(C)C 134653202 RJSYYRUUJSVIGG-SECBINFHSA-N 284.787 2.438 10 10 CECE CC(C)(C)n1c(-c2cc(O)c(O)c(O)c2)n[nH]c1=S 75323878 IDUSASKBUKEZIO-UHFFFAOYSA-N 281.337 2.479 10 10 CECE CO[C@H]1CC[C@@H](NC(=O)N(C)Cc2ccccc2O)C1 190358951 XSWZRHMVCKZCBW-OLZOCXBDSA-N 278.352 2.101 10 10 CECE CC(C)(C)c1ccc(O)c([C@H]2N[C@H](C(=O)O)CS2)c1 83236618 OZPITQHVSNWKNG-JQWIXIFHSA-N 281.377 2.478 10 10 CECE COCCCCN[C@@H](C)c1ccc(OC)cc1O 44656674 MBOGJYDXQYARPC-NSHDSACASA-N 253.342 2.478 10 10 CECE CC(C)[C@H](C)NC(=O)Cn1ccc2cc(N)ccc21 49308468 PMUOCDAJQBNLRC-NSHDSACASA-N 259.353 2.384 10 10 CECE CC(C)CN[C@H](CN)c1ccc2c(c1)CCCN2C 87911576 IJBLQDBSTKNSIU-OAHLLOKOSA-N 261.413 2.314 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H](C)C[C@@H]1C 227261004 QBWUVZQSGJSSGB-NHCYSSNCSA-N 254.334 2.254 10 10 CECE CNCc1ccc(N(C)C(C)(C)CO)cc1Cl 234399035 DTPLLUZXVYPDQD-UHFFFAOYSA-N 256.777 2.267 10 10 CECE CCNCc1ccc(N2CC[C@H](CO)C2)cc1Cl 233541393 FOLBJYMYMHCUJT-NSHDSACASA-N 268.788 2.268 10 10 CECE N[C@H](c1cc(Br)cc([N+](=O)[O-])c1O)C1CC1 95768594 CGKUYAIKRRLHKY-VIFPVBQESA-N 287.113 2.473 10 10 CECE Cc1ccc(O)c([C@H](C)N[C@@H](C)[C@H](C)N2CCOCC2)c1 248530887 XOCRHWQWKABQPJ-KKUMJFAQSA-N 292.423 2.460 10 10 CECE CC(=O)N(C(=O)N1CCC[C@H](C)C1)c1ccc(N)cc1 243288274 LBUJXLGLHKGVOH-NSHDSACASA-N 275.352 2.474 10 10 CECE N[C@@H](CO)c1cc2c(c(Br)c1O)CCCC2 258677879 WJARFUCSBSBCFH-JTQLQIEISA-N 286.169 2.026 10 10 CECE N[C@@]1(N=Nc2cc[nH]n2)N=NC(O)=C1c1ccccc1 257351179 CMAVAWNMKRATEG-LBPRGKRZSA-N 269.268 2.499 10 10 CECE CC(=O)C(=O)COC(=O)CC(C)(C)c1ccccc1 808508876 NTTGOVRMNBIXOL-UHFFFAOYSA-N 262.305 2.056 10 10 CECE Cc1cc(C(=O)N2[C@H]3COC[C@H]2C3)c(C)n1-c1ccccn1 808050157 ULEMEWWTJIBXJU-ZIAGYGMSSA-N 297.358 2.102 10 10 CECE CN(C)c1ccc(CNCCSc2nccn2C)cc1 2165084092 ZHUDJEYMPYTCGW-UHFFFAOYSA-N 290.436 2.368 10 10 CECE c1cc2c(cc1N1C[C@]34CCC[C@@]3(CNC4)C1)CCO2 2162660219 YODIXIBXROBARO-IAGOWNOFSA-N 270.376 2.201 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@]2(C(=O)O)C[C@@]2(C)C1 2165498711 MQXWWJIWSFIPIH-NKZPBKNFSA-N 279.311 2.389 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(CC(N)=O)C2)cc1Cl 723182965 QAVGPRZQLCSFPI-JTQLQIEISA-N 295.814 2.322 10 10 CECE CO[C@@H]([C@@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 2163071668 QIGPIYWHQMMXGB-VNQPRFMTSA-N 278.396 2.194 10 10 CECE CCCOCC[C@H](NN)c1ccc2c(c1)CCCN2C 2163097515 OSIAMINZWUPZAF-HNNXBMFYSA-N 277.412 2.390 10 10 CECE CN(C)c1ccc([C@@H](NN)[C@@H]2CCOC(C)(C)C2)cc1 2163140677 LYSSKOPITJTUJA-UKRRQHHQSA-N 277.412 2.462 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@H](O)c1cccnc1 2163146524 UOEHRTGPBRJQBO-JKSUJKDBSA-N 271.364 2.142 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3C[C@H](N)[C@H]4C[C@H]43)ccc21 2166246590 TZQBGVRXLKRSEB-NMNMXBMNSA-N 272.392 2.086 10 10 CECE CC(=O)C(=O)COC(=O)CCCc1ccc(C)cc1 808505495 BUBKFSMTJMGKOC-UHFFFAOYSA-N 262.305 2.019 10 10 CECE Cc1nc(C)c(CN[C@H](C)c2cc(O)ccc2O)[nH]1 724680793 MIBMYTMGCIKCMO-MRVPVSSYSA-N 261.325 2.289 10 10 CECE C1=CCN(CCNCc2ccc(N3CCCC3)cc2)C1 392759115 AVAYBUZRBBZCLK-UHFFFAOYSA-N 271.408 2.248 10 10 CECE COc1ccc(O)c(CNC(=O)[C@H](OC)C2CCCC2)c1 830544081 LHOONHNDHUMMBN-OAHLLOKOSA-N 293.363 2.222 10 10 CECE C[C@@H]1CNC[C@H]1NCc1cc(Cl)cc(Cl)c1O 903960418 JOQKONUQVYHWTM-RDDDGLTNSA-N 275.179 2.397 10 10 CECE C[C@H](NC[C@@]1(O)CCOC(C)(C)C1)c1ccccc1O 2203261377 GAOQEPOWUZMMBG-BLLLJJGKSA-N 279.380 2.363 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@H]1CNCCC1(F)F 841080985 RPNJERXFSOHMAM-AWEZNQCLSA-N 283.366 2.148 10 10 CECE COc1cc(Cl)cc(CN(C2CC2)[C@@H]2CCNC2)c1O 843055396 ISLMQZWIGTYICF-CYBMUJFWSA-N 296.798 2.381 10 10 CECE CN(C)c1ccc(CNCCO[C@H]2CC2(F)F)cc1F 850365084 AUSHMXSLRAOSSS-ZDUSSCGKSA-N 288.313 2.406 10 10 CECE C[C@@H]1O[C@H](C)[C@H](NCc2cc([N+](=O)[O-])ccc2O)[C@H]1C 858284105 WYEAZZJSDAVPJZ-LFNDISMMSA-N 280.324 2.202 10 10 CECE C[C@@H]1CCC[C@@H](CNCc2cc([N+](=O)[O-])ccc2O)O1 850379812 YKBKTJSCCLVBGY-MFKMUULPSA-N 280.324 2.348 10 10 CECE CCO[C@H](CN[C@@H](C)c1cc(C)ccc1O)CN(C)C 926962647 RKLABNPWMXQYBD-UONOGXRCSA-N 280.412 2.318 10 10 CECE Nc1ccc(CCNC(=O)NCC[C@@H]2CC2(F)F)cc1 857104756 WZBANUWEDWGBJU-LLVKDONJSA-N 283.322 2.156 10 10 CECE COC(=O)NCCCN[C@@H](C)c1cc(C)ccc1O 1875637810 UXOSJUCRUAHPIV-NSHDSACASA-N 266.341 2.097 10 10 CECE CCNCC1CCN([C@H](C)c2c(O)cccc2O)CC1 233507488 CKVPEOCBIVDJPK-GFCCVEGCSA-N 278.396 2.480 10 10 CECE C[C@H](N[C@H](C)c1cc(O)ccc1O)c1ccn(C)n1 1876943100 KQSAROBDJPXYBT-ZJUUUORDSA-N 261.325 2.243 10 10 CECE CC(=O)c1cc(F)cc(CN2[C@H](C)CC[C@@H]2CO)c1O 880439047 JMSLUGAPKFDETH-NOZJJQNGSA-N 281.327 2.079 10 10 CECE CNCc1cc(F)c(N2CCC[C@H]2[C@@H](C)O)c(F)c1 1879180545 DABGRFNDUJXPMN-RNCFNFMXSA-N 270.323 2.034 10 10 CECE CCN(Cc1cn(C)nn1)Cc1cccc(Cl)c1O 781931380 UVVJHFGNCBHQHV-UHFFFAOYSA-N 280.759 2.196 10 10 CECE COc1cc(C)cc(CN(C)[C@H]2C[C@@H](OC)C2)c1O 795674995 NFKOMFUUEGUNLB-BETUJISGSA-N 265.353 2.318 10 10 CECE CCc1cccc(CN[C@@H](COC)[C@@H]2CCCOC2)c1O 895859398 QYNYMGOAYOWTLW-CVEARBPZSA-N 293.407 2.486 10 10 CECE Oc1cc(Cl)ccc1CNCC[C@@H](O)C(F)(F)F 1181497046 DGACHXBNHYWIIP-SNVBAGLBSA-N 283.677 2.449 10 10 CECE Nc1ccc(CCCNC[C@]23CCOC[C@H]2C3)cc1 1880535662 NROAQWNRKKQXSV-GDBMZVCRSA-N 260.381 2.218 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](O)C[C@H]2C)c(F)c1 1880923077 DJDMRSSDPFJNJR-YWVKMMECSA-N 270.323 2.334 10 10 CECE Cc1sccc1CC(=O)NCc1cccc(O)c1O 1153798241 NARHSFVIOJVZPQ-UHFFFAOYSA-N 277.345 2.327 10 10 CECE C[C@@H]1C[C@@H](CNCc2c(O)cccc2F)[C@@H](C)O1 1964065156 ZWYJXZWWNRWCAD-MXWKQRLJSA-N 253.317 2.434 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)C23CC(CCO2)C3)CC1 1886796166 PIYNPTSEESMJHD-UHFFFAOYSA-N 264.329 2.104 10 10 CECE Oc1cc(F)ccc1CNC1([C@H]2CCCO2)CC1 1964592756 YYHCNXVDOXHRKX-CYBMUJFWSA-N 251.301 2.333 10 10 CECE COc1cccc(O)c1CN(C)C1CCOCC1 1963442710 XFCGBZJSKHUTOE-UHFFFAOYSA-N 251.326 2.012 10 10 CECE O=C(Cn1ccc2ccccc21)NCc1ccc(O)cc1O 1162279236 WWMXWKMWDCNGQH-UHFFFAOYSA-N 296.326 2.369 10 10 CECE Oc1ccc(O)c([C@H]2NCCc3c(F)cccc32)c1 83596834 FAUHRJIKZUHCKC-HNNXBMFYSA-N 259.280 2.472 10 10 CECE COc1ccc2c(c1)[C@@H](c1cc(O)ccc1O)NCC2 83619190 BDXGSQDDOGWSHG-INIZCTEOSA-N 271.316 2.342 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COc1cc(Cl)cc(CNCCc2cn(C)cn2)c1O 313256953 ACVWSPVCLVTGCW-UHFFFAOYSA-N 295.770 2.120 10 10 CECE COc1cccc(CNOCCC(F)(F)F)c1O 315630747 WIOFLDJZBDFJTR-UHFFFAOYSA-N 265.231 2.374 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)C[C@H]1CO[C@H](C)C1 2159426960 OBDPPPDIWHFXHR-OCCSQVGLSA-N 276.380 2.432 10 10 CECE CCN1CCc2cc([C@H](O)C[C@]3(N)CCSC3)ccc21 2163076185 LSPIECSPUPKSBD-HZPDHXFCSA-N 292.448 2.327 10 10 CECE CCN1CCc2cc([C@@H](Cc3cscn3)NN)ccc21 2163130251 GDMMQPUVTGPSQB-CQSZACIVSA-N 288.420 2.273 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@]1(O)CCC1(C)C 2163141049 QDLCARBDNMXRQN-DOTOQJQBSA-N 274.408 2.491 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@H](O)Cc2ccccc2)cc1 2163138355 MEYJSZXWOXAGMP-DLBZAZTESA-N 270.376 2.356 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H]3C[C@H]4C[C@H]4CO3)ccc21 2163107932 QURGFSZNQGNZAO-OHFALNGGSA-N 272.392 2.494 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@]2(C)CNC[C@]2(C)C1 702581279 ZPXKBQRPCFUHCL-LYRGGWFBSA-N 276.380 2.090 10 10 CECE Cc1c(CN2C[C@H](N)C[C@H]2C)n(C)c2ccccc12 702642882 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279.380 2.370 10 10 CECE COC(=O)c1cnn(Cc2ccc(Cl)cc2O)c1 2069959627 DGTFUENPARLJNY-UHFFFAOYSA-N 266.684 2.077 10 10 CECE CCc1cc(CN)n([C@@H](C)c2cc(OC)ccc2O)n1 2070035348 GPYBSWKQZZQETE-JTQLQIEISA-N 275.352 2.228 10 10 CECE CC(C)c1cc(CN)n(Cc2c(O)cccc2F)n1 2070057453 FNBAMYBNHCKWPZ-UHFFFAOYSA-N 263.316 2.358 10 10 CECE CN[C@H](C)c1ccc(N(C)CCn2cncn2)cc1Cl 2170124918 FLZXPYDIKDXKQW-LLVKDONJSA-N 293.802 2.348 10 10 CECE CCCS(=O)(=O)C[C@@H](C)N[C@@H]1CCc2cccc(O)c21 2170592240 UWUBNYLSCNWHCC-DGCLKSJQSA-N 297.420 2.182 10 10 CECE CC(C)[C@@H]1CN(C)CCN1c1ccc([C@@H](C)N)c(O)c1 2170575224 LMIKULYLXJEXMR-DOMZBBRYSA-N 277.412 2.188 10 10 CECE CN1CC[C@@H]2[C@@H](CCCN2Cc2c(O)cccc2F)C1 2171232575 RUYJHPNLPKRCOW-SWLSCSKDSA-N 278.371 2.447 10 10 CECE CNCc1ccc(N2CCO[C@@H]3C[C@H]32)cc1C(F)(F)F 2171804243 CNNXQYNMIWXGQF-CHWSQXEVSA-N 286.297 2.402 10 10 CECE CCN[C@H](C)c1ccc(N2CC[S@@](=O)[C@@H](C)C2)cc1O 2171968184 GNZJYQRFFBLOAV-XXRNEEKGSA-N 296.436 2.020 10 10 CECE OCc1cnn(Cc2cc(F)ccc2O)c1C(F)F 2079037432 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[N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)[C@H]2CCC[C@@H]2F)CC1 2118880991 XXXZQEXOSLSZOL-VWYCJHECSA-N 290.364 2.372 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(S(=O)(=O)[C@@H]2CCCC[C@@H]2F)C1 2118936858 GTIFLJXULOGUSA-OUAUKWLOSA-N 290.364 2.372 10 10 CECE Nc1ccc(OCCC(=O)N[C@H]2CCC[C@H]2F)cc1 2118935937 NKSQDQJIXYHWJY-OLZOCXBDSA-N 266.316 2.045 10 10 CECE CNCc1ccc(N2CC(CCN(C)C)C2)cc1Cl 2120167098 WPCRIZUWJASOLU-UHFFFAOYSA-N 281.831 2.447 10 10 CECE CN1CCc2c1ccc1c2C[C@@H](CC(=O)O)CCO1 211902383 RUCLYSGJQGGJTP-JTQLQIEISA-N 261.321 2.095 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)OCCO3)[C@H](C)CN1 216876098 XDAPXRPCPJHTAG-NWDGAFQWSA-N 262.353 2.035 10 10 CECE C[C@H](CCO)Nc1c(N)cccc1Br 697518708 QOMQSBNWUPFLRB-SSDOTTSWSA-N 259.147 2.214 10 10 CECE Cc1ccc(O)c(CNc2ncc([N+](=O)[O-])cn2)c1 1655688128 VRUYCKJQRPSHSR-UHFFFAOYSA-N 260.253 2.011 10 10 CECE CC(C)(C(=O)N1CC[C@H](N=[N+]=[N-])C1)C(F)(F)F 1912160419 VXJZUKBJYKDGKK-LURJTMIESA-N 250.224 2.486 10 10 CECE CN1CCC(CCN2CC[C@H](CN=[N+]=[N-])C2)CC1 1912166247 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CC[C@H](C)NCc1ccc(OC)c(CN2CCOCC2)c1 13736068 BMRSMZNJHNXNTF-AWEZNQCLSA-N 292.423 2.416 10 10 CECE CCC[C@@H]1C[C@@](O)(c2ccc3c(c2)CCN3C)CO1 2129091120 HMIISYPLSGTFHR-ZBFHGGJFSA-N 261.365 2.456 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1cccc(C(F)F)c1 156075638 QPZVUNZHGXBGGX-SECBINFHSA-N 269.255 2.051 10 10 CECE CN(c1ccc2c(c1)CCO2)[C@@H]1CCNCC12CC2 2129383800 GYXWOWIEZMQQRD-OAHLLOKOSA-N 258.365 2.200 10 10 CECE Cc1ccnc(C)c1CNCc1ccc(O)c(O)c1 2129791003 XWBFTNYTRAWWJT-UHFFFAOYSA-N 258.321 2.399 10 10 CECE COc1ccc(N(C)C2CCC(O)CC2)cc1OC 258773993 LCSXAUAGZLBEDS-UHFFFAOYSA-N 265.353 2.444 10 10 CECE CNC(=O)[C@@H](Cc1ccc(N)cc1)c1cccs1 20228113 QHLLWPCOMUNRDJ-LBPRGKRZSA-N 260.362 2.403 10 10 CECE CC[C@H](N)c1ccc(N2CC3(CC(CO)C3)C2)cc1 2129992042 DEUBXZPSNUCPPX-HNNXBMFYSA-N 260.381 2.305 10 10 CECE CCOCc1nnc(CN2CCC(N=[N+]=[N-])CC2)s1 2130924910 LRSHYFKXWXYFGT-UHFFFAOYSA-N 282.373 2.349 10 10 CECE CC[C@]1(C)C[C@H](NCCc2ccc(O)c(O)c2)CO1 2132894049 HQRIJZBPWGRQFY-SWLSCSKDSA-N 265.353 2.188 10 10 CECE Nc1ccc(N(C(=O)c2cccnc2)C2CC2)cc1 1857926995 NWCXDFVNASAHOK-UHFFFAOYSA-N 253.305 2.473 10 10 CECE COc1ccc(O)c(CNC[C@@H]2C3C[C@@H]4C2[C@@H]4C3)c1 2134339324 HGYNXSRSKQKYED-OEJHWOLKSA-N 259.349 2.392 10 10 CECE C[C@H]1CN[C@@H](C)CCN(c2ccc3c(c2)OCO3)C1 219654018 HWBPEONLZZIIHD-RYUDHWBXSA-N 262.353 2.240 10 10 CECE CCCN(c1ccc([C@H](C)O)cc1F)C1COC1 1915724085 PTBRTAKBGLGIQN-JTQLQIEISA-N 253.317 2.494 10 10 CECE COc1cc(N(C)[C@@H]2CCOC[C@@H]2C)ccc1CO 2139701747 XBEVRICVDFTJOA-SMDDNHRTSA-N 265.353 2.049 10 10 CECE COc1cc(N(C)C[C@H]2CC[C@@H](C)O2)ccc1CO 2139702150 HDBCKJQWPQXWPB-BXUZGUMPSA-N 265.353 2.191 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1C[C@H]2NCc1ccc(F)cc1O 2139879011 PXCBKBOIPSTFKD-NDPMZMCLSA-N 265.328 2.170 10 10 CECE Oc1cc(F)ccc1CN1[C@H]2CC[C@@H]1[C@H]1CC[C@@H]2O1 2139804652 OMLOMTROSIVVSY-CUFDPUGPSA-N 263.312 2.426 10 10 CECE COc1cccc(CNC[C@@]2(O)CC[C@@H](C)C2)c1O 2136916615 XRQRYPTVNYYMDL-IAQYHMDHSA-N 265.353 2.042 10 10 CECE Oc1ccc2ccccc2c1CN1CC[C@]2(CCN2)C1 1923001996 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[N-]=[N+]=NCCCN[C@]1(C(=O)O)C[C@@H]2[C@H]3CC[C@@H](C3)[C@H]21 1879420379 BSPHSDZHRRKUAP-ZTVLKNOQSA-N 264.329 2.166 10 10 CECE COc1ccc(CN[C@]2(CO)CC[C@@H](C)C2)c(O)c1 1880888982 HLJAXDPMUQZGAU-IAQYHMDHSA-N 265.353 2.042 10 10 CECE O=C(c1cc(O)cs1)N1CC[C@H]2[C@@H](C1)C2(F)F 1148407843 RNEOCHNZCOFUMY-JGVFFNPUSA-N 259.277 2.181 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2CC1(C)COC1 1898535715 VIVNQQVEUXTFMW-GFCCVEGCSA-N 260.381 2.495 10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1885562237 CLWMJHILPUREKL-ZJUUUORDSA-N 297.359 2.201 10 10 CECE CCc1nc[nH]c1C(=O)NCc1cc(Cl)ccc1O 1300395672 BBAJARLSLRCICL-UHFFFAOYSA-N 279.727 2.261 10 10 CECE COc1cccc(O)c1CN[C@H]1CCC[C@H](OC)C1 1963442251 RGZJARSQUHOEHH-RYUDHWBXSA-N 265.353 2.448 10 10 CECE O=C(NCc1c(O)cccc1F)c1ccccc1O 1178410041 JWZLSCHSNIJVBM-UHFFFAOYSA-N 261.252 2.167 10 10 CECE CC[C@H]1CN(Cc2cc(Cl)ccc2O)CCN1 83407723 LEOJDIGIBUMZJP-LBPRGKRZSA-N 254.761 2.229 10 10 CECE Cc1cccc(CN[C@H]2c3ccccc3C[C@H]2O)c1O 83514121 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Cc1cc(N(C)C[C@@H]2[C@H]3CCO[C@@H]23)ccc1[C@H](C)N 2269668716 WKNSUHNHEOTMIU-AEAUEXCSSA-N 260.381 2.486 10 10 CECE Cc1cc(N2CC[C@H](C3(O)CC3)C2)ccc1[C@@H](C)N 2269661833 IFYREJHTTQGGLI-OLZOCXBDSA-N 260.381 2.366 10 10 CECE Cc1cc(N2CC[C@H](CO)C23CC3)ccc1[C@@H](C)O 2269674326 XHSKAXUCWMKGRS-CHWSQXEVSA-N 261.365 2.400 10 10 CECE Cc1cc(N(C)Cc2cn(C)cn2)ccc1[C@@H](C)N 2269667485 XIJJEVQUMTUWMM-GFCCVEGCSA-N 258.369 2.385 10 10 CECE CCc1nonc1CN(C)Cc1ccc(N(C)C)cc1 2290114521 SNXJADPGILGDAQ-UHFFFAOYSA-N 274.368 2.330 10 10 CECE CC1(C)OCCN(c2ccc(OC3CC3)cc2)[C@H]1CO 2282799572 KYOHWUPZTYOAAC-HNNXBMFYSA-N 277.364 2.204 10 10 CECE Cc1cc(N2C[C@@H](CO)OCC2(C)C)ccc1[C@@H](C)O 2285171573 YCZCDJUHKVLVAK-OCCSQVGLSA-N 279.380 2.024 10 10 CECE O[C@@H](c1ccc(N2CCNCC2)cc1)[C@@H]1[C@H]2CCC[C@H]21 2286066655 VYHKACJWYYEXEA-HZMVEIRTSA-N 272.392 2.176 10 10 CECE C[C@H](N[C@H]1CCCN(C2CC2)C1)c1c(O)cccc1O 2288810718 SDVPVEJSZMBAJX-RYUDHWBXSA-N 276.380 2.375 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nc(C)ns2)cc1O 2288842253 KRBRTBWRZMTBBL-VIFPVBQESA-N 292.408 2.469 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@@]23CCCC[C@H]2CC3)cc1 2289122108 JBVGLJTYGUXYIW-DZGCQCFKSA-N 294.420 2.411 10 10 CECE C[C@H]1SCCN(C(=O)C=Cc2ccc(O)c(O)c2)[C@@H]1C 2307987667 CLNPJDARGOSYSJ-GHMZBOCLSA-N 293.388 2.463 10 10 CECE OCc1ccc(N2[C@H]3CC[C@@H]2[C@H](CO)C3)cc1Cl 2308532621 APTUYWJHTNFPPJ-COPLHBTASA-N 267.756 2.182 10 10 CECE COCCNCc1cnc(SCC[C@@H](C)OC)s1 2315287555 VZYDBBYQZIAHKN-SNVBAGLBSA-N 290.454 2.396 10 10 CECE COc1cc(N=NN2CCOCC2)cc(OC)c1 2330246345 QUBQAEHRBPWTEY-UHFFFAOYSA-N 251.286 2.035 10 10 CECE CO[C@H]1C[C@@H]2C[C@@H](N(C)c3ccc(CN)cc3)[C@@H]2C1 2332000803 PHZSPLYSWONORI-SLBVQIDZSA-N 260.381 2.395 10 10 CECE N[C@H]1C[C@@H]2C[C@H](C1)N(c1ccc3c(c1)COCC3)C2 2332112325 QEVLDAZYHBHGFM-DIOULYMOSA-N 258.365 2.075 10 10 CECE N[C@@H]1[C@@H]2CC[C@H]1N(c1ccc(OCC(F)F)cc1)C2 2332309836 NDTJBUUBFXOKKR-GAJTVXKRSA-N 268.307 2.256 10 10 CECE Cc1cc(N2CC[C@@H](O)[C@@H]3CC[C@@H]32)ccc1[C@@H](C)N 2334468069 KKWLTYSTWBFQAR-BQDHKBFISA-N 260.381 2.364 10 10 CECE COc1ccc(N2CC(F)(F)[C@](C)(N)C2)c(C)c1C 2336883791 CHOJASPWCCRPGY-CYBMUJFWSA-N 270.323 2.485 10 10 CECE COc1cccc(CN[C@H]2CO[C@]3(C)C[C@H]2C3)c1O 2337755275 UZHDONUWVGQUPN-SLEUVZQESA-N 263.337 2.058 10 10 CECE CNCc1ccc(N2C[C@@H](O)[C@H](C)C2)cc1C1CC1 2339146943 KEEVSOTUQCTWHZ-BDJLRTHQSA-N 260.381 2.100 10 10 CECE CC1(C)CN(c2ccc(CN)c(C3CC3)c2)[C@@H]1CO 2339159164 BFONQFPAMVGPAU-OAHLLOKOSA-N 260.381 2.230 10 10 CECE O=C(O)[C@@]12CC[C@@H](C1)N(Cc1cc(Cl)ccc1O)C2 2339612261 LQKLEMNEZDVHAM-FZMZJTMJSA-N 281.739 2.485 10 10 CECE CO[C@@H]1C[C@H]2C[C@H]1CN2[C@@H](C)c1c(O)cccc1O 2340772065 BLOFLCGYTJNFFF-KZWBYHQPSA-N 263.337 2.268 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC3(CC[C@@H]3O)C2)c1C 2341062175 SFSGPYFKSYUNFN-WFASDCNBSA-N 260.381 2.284 10 10 CECE CCOC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1C[C@H]2C[C@@H]1C2 2341995398 HBSSURXCVIHRFA-WRWGMCAJSA-N 266.345 2.254 10 10 CECE Nc1ccc(NC(=O)CCOCC2CC(F)C2)cc1 2352457237 QXAHSAOBBXSPCG-UHFFFAOYSA-N 266.316 2.362 10 10 CECE C[C@@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@@H]2C(=O)O 2353888033 UDKRFCBZPYLOQD-VLEAKVRGSA-N 277.320 2.096 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H]2[C@@H]2C[C@@H]32)c([N+](=O)[O-])c1 2354424002 LDXCMUIVIAKEHU-XVXKCHKCSA-N 274.320 2.493 10 10 CECE CCNCc1ccc(N2[C@H]3CC[C@H](C3)[C@H]2CO)c(C)c1 2355773499 HAVJDFVUYBTLBU-HLLBOEOZSA-N 274.408 2.454 10 10 CECE CC(C)CN1C(=O)C[C@@H](N)[C@@H]1c1ccc(N(C)C)cc1 62209870 QERZGBOLNWAXAR-ZBFHGGJFSA-N 275.396 2.009 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H](C)[C@H](CO)C3)ccc21 2356172979 OWZGJXOLLAEAAP-IFIJOSMWSA-N 274.408 2.348 10 10 CECE CCN(c1ccc([C@H](C)N)cc1F)[C@@H]1CCOC1 310915876 RORMFMCBIVBTQO-CMPLNLGQSA-N 252.333 2.461 10 10 CECE CC(=O)Nc1ccc(-c2cnnn2-c2ccc(N)cc2)cc1 62429674 LXAZGJDOQJULGA-UHFFFAOYSA-N 293.330 2.475 10 10 CECE Cc1cc(C)c(O)c(CN2CCN3CCC[C@@H]3C2)c1 178892511 RHRGKFRBBSJEDJ-OAHLLOKOSA-N 260.381 2.289 10 10 CECE CN1CCCc2cc([C@@H](CN)N3CCCC3)ccc21 34936234 KLUAUWBSSNPNSI-MRXNPFEDSA-N 259.397 2.165 10 10 CECE Cc1cc(N)c(Cl)cc1N1C(=O)[C@@H](C)[C@@H](C)C1=O 235747671 ABXDFXBRBQWHEY-OCAPTIKFSA-N 266.728 2.376 10 10 CECE COc1cc(Cl)cc(CN(C)[C@H]2CCN(C)C2)c1O 311716703 WUBYJRQKBBJOCR-LBPRGKRZSA-N 284.787 2.190 10 10 CECE COCC1CCN([C@@H](CN)c2ccc(N(C)C)cc2)CC1 70080414 SPSMAENURMMNSR-KRWDZBQOSA-N 291.439 2.111 10 10 CECE C[C@H]1CCC[C@H]1NC(=O)c1ccn(-c2ccc(N)cc2)n1 71205137 PUOAOJWEIQCRKG-SMDDNHRTSA-N 284.363 2.373 10 10 CECE Cc1ccc(C(=O)Nc2ccc(O)cc2C(=O)O)cc1O 48846965 JYIIPQIKTDQZLX-UHFFFAOYSA-N 287.271 2.357 10 10 CECE CC[C@H](C)[C@H](C)NS(=O)(=O)Cc1ccc(N)cc1 42551443 AYERYURGGYFLSM-QWRGUYRKSA-N 270.398 2.123 10 10 CECE C[C@H](N[C@H]1CCCCC[C@@H]1O)c1ccc(O)cc1O 135637321 QFHXVAJGEYAESN-BPNCWPANSA-N 265.353 2.442 10 10 CECE CCCNCc1ccc(N(C)CC(=O)NCC(C)C)cc1 228291932 AKLSLTRYFXVJCZ-UHFFFAOYSA-N 291.439 2.395 10 10 CECE CN(C)c1ccc(/C=C\C(=O)N[C@@H]2CCCC[C@@H]2O)cc1 220693213 IIFQCYAWCLDKAE-GXIIQHASSA-N 288.391 2.186 10 10 CECE Cc1cc(Cl)cc([C@@H]2N[C@@H](C(=O)O)CS2)c1O 83236685 AKAJBVMHLCLUAM-PSASIEDQSA-N 273.741 2.142 10 10 CECE COc1cccc([C@H](NN)c2ccc(N(C)C)cc2)c1F 97774310 HSNBTJDUTUBLKB-MRXNPFEDSA-N 289.354 2.453 10 10 CECE CSc1ccc([C@](C)(NCCN=[N+]=[N-])C(N)=O)cc1 90258045 RZZKOQONXKAZCX-LBPRGKRZSA-N 279.369 2.009 10 10 CECE CNCc1ccc(N(C)[C@H]2CCCN(C)C2)c(F)c1 53246547 HUJSVRMWUDGNNM-ZDUSSCGKSA-N 265.376 2.076 10 10 CECE C[C@H](C(=O)O)c1c(Br)cc(O)c(O)c1F 258814234 ZIMVNBYXRAQABR-VKHMYHEASA-N 279.061 2.188 10 10 CECE Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)cnn1 276328688 GOKNERXSESZIOJ-UHFFFAOYSA-N 297.358 2.299 10 10 CECE CC[C@H](NC(=O)/C=C/c1ccc(N(C)C)cc1)[C@@H](C)O 387331729 SESNEPABNCDJKO-SLSOJXQNSA-N 276.380 2.041 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@@H]1CCN2CCC[C@H]1C2 2164425819 MYSKZYYGRCBOAE-XJKSGUPXSA-N 277.387 2.205 10 10 CECE O=C(NCc1ccccc1O)c1ccnc2ccncc12 806717513 IRQDKDNSBJSQMG-UHFFFAOYSA-N 279.299 2.265 10 10 CECE CN(C)c1ccc(CN2[C@H](CN)C[C@@H]3CCC[C@H]32)cc1 2164806939 OKELXZPPFFGVIS-BHYGNILZSA-N 273.424 2.454 10 10 CECE N[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C2(CCC2)C1 2162641152 YPRRSXYBZRQGTC-VIFPVBQESA-N 282.290 2.468 10 10 CECE CN(C)c1ccc([C@@H](N)c2ccn3nccc3c2)cc1 2165314835 DSOGXLJJOKWBPR-MRXNPFEDSA-N 266.348 2.448 10 10 CECE C[C@H]1CCN(c2ccc(CN)cc2Cl)C[C@H]1O 299954244 MVQNWVBFODEDQC-TVQRCGJNSA-N 254.761 2.006 10 10 CECE CCN[C@@H]1CCC[C@@](O)(c2ccc3c(c2)CCN3C)C1 2163073755 MCUVUBHWGBIGOE-WBVHZDCISA-N 274.408 2.419 10 10 CECE CCN1CCc2cc([C@H](O)c3nc(C)c(C)[nH]3)ccc21 2163072769 CIDQRIIBMPYVHU-HNNXBMFYSA-N 271.364 2.491 10 10 CECE CN1CCc2cc([C@]3(O)CCN4CCC[C@@H]4C3)ccc21 2163076496 OBBXXLDUGSOOIR-WBVHZDCISA-N 272.392 2.125 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3CC(C)(C)CN3)ccc21 2163078991 LQFRGQRWCHCWOJ-HOCLYGCPSA-N 274.408 2.491 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)C12CC(CN1)C2 2163108793 VELMQQIECQYTLB-BLDCVEFLSA-N 272.392 2.462 10 10 CECE CN(C)c1ccc([C@@H](N)[C@@]2(O)CCOC(C)(C)C2)cc1 2163131042 NJEWSPFUCLZPLL-GDBMZVCRSA-N 278.396 2.073 10 10 CECE NCCC1(C(=O)NCc2ccccc2O)CCCCC1 2163226144 RYUMPTVVQPSNGX-UHFFFAOYSA-N 276.380 2.308 10 10 CECE Cc1cc(Cl)cc(CN2CC[C@@H]3CN(C)C[C@@H]32)c1O 814173406 LDDRBYFARIUUOT-RISCZKNCSA-N 280.799 2.490 10 10 CECE CC1(C)CC(CS(=O)(=O)NCCc2ccc(N)cc2)C1 723792864 MTUPIEJRHCBYFP-UHFFFAOYSA-N 296.436 2.167 10 10 CECE CC12CCC(C(=O)N3CC[C@H](N=[N+]=[N-])C3)(CC1)CO2 2133558523 JLFSMMGCKHCDIX-PKSQDBQZSA-N 264.329 2.247 10 10 CECE C[C@@H](CC(F)(F)F)C(=O)NCc1ccc(O)c(O)c1 837483502 BFLXESVPFKZEFT-ZETCQYMHSA-N 277.242 2.303 10 10 CECE CCOc1cccc(CN2CC3(CCCOC3)C2)c1O 839137668 DPTNXTBFXFQCTI-UHFFFAOYSA-N 277.364 2.403 10 10 CECE CCc1nc(CNC(=O)c2cc(O)cs2)cs1 732289939 MILLQURDWISCIO-UHFFFAOYSA-N 268.363 2.403 10 10 CECE CCN(CC)c1ccc(CN2CC[C@H](N)[C@@H]2C)cc1 841025632 DCGCTEUEOGFIKA-BBRMVZONSA-N 261.413 2.454 10 10 CECE CN(C)c1ccc(/C=C\CNCC2(N)CCC2)cc1 841049481 SCLOCNBAHZACOI-HYXAFXHYSA-N 259.397 2.237 10 10 CECE CO[C@H]1CCC[C@H](C(=O)NCc2c(O)cccc2F)C1 928706856 XINUQBULDWOROH-QWRGUYRKSA-N 281.327 2.353 10 10 CECE Cc1cc(C)c([C@H](C)NCCN2CCC(N)CC2)c(O)c1 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CN1CCc2cc([C@@](C)(O)[C@H]3C[C@H]4CC[C@H]3O4)ccc21 2163064476 XBOSVWWFRNNMLS-YALNPMBYSA-N 273.376 2.454 10 10 CECE c1cc2c(cc1N1CCCN[C@@H](C3CC3)C1)CCO2 383714401 IYPRQQRWHWMCJY-OAHLLOKOSA-N 258.365 2.200 10 10 CECE NN[C@H](C[C@@H]1CCCO1)c1ccc(N2CCCC2)cc1 2163104664 FVUYIGMTRYDFTI-JKSUJKDBSA-N 275.396 2.360 10 10 CECE C[C@H](N)c1ccc(N2CC(O)(C3CC3)C2)cc1Cl 384045057 LAZJYVUAVWTPJB-VIFPVBQESA-N 266.772 2.321 10 10 CECE C[C@@H]1CO[C@@H]([C@H](NN)c2ccc(N3CCCC3)cc2)C1 2163161420 WGGZONNEQYIYPU-APHBMKBZSA-N 275.396 2.216 10 10 CECE CCNCc1ccc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c(Cl)c1 384886621 KVCVYTVGNMOQNL-VIKVFOODSA-N 293.842 2.446 10 10 CECE COc1cccc(CN(C)[C@@H]2C[C@H](C)O[C@@H]2C)c1O 384886201 JTCHOPPQNSNMNF-DMDPSCGWSA-N 265.353 2.399 10 10 CECE CCNCc1cc(F)c(N(C)CCCCO)c(F)c1 385153008 PWWVSNHOZUAZIZ-UHFFFAOYSA-N 272.339 2.283 10 10 CECE C[C@@H]1CCSCCN1Cc1cc(N)ccc1O 385526752 XJWBYZUDTVRTNP-SNVBAGLBSA-N 252.383 2.302 10 10 CECE C[C@H](O)c1ccc(N2CCS[C@@H](CO)C2)cc1Cl 720032588 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CC(C)[C@@H]1CNCCCN1[C@@H](C)c1cc(O)ccc1O 2159168482 OCNBGAOCGBDPOO-WFASDCNBSA-N 278.396 2.479 10 10 CECE C[C@@H](N[C@H]1C[C@H]2CC[C@H]1N(C)C2)c1c(O)cccc1O 401662118 PXWDEEYGMXGLOY-FVCCEPFGSA-N 276.380 2.231 10 10 CECE COc1cccc(CN[C@H](CO)C2CCCCC2)c1O 72927439 ZHWALXGECVEDCI-CQSZACIVSA-N 279.380 2.432 10 10 CECE CCCSC[C@H](N)C(=O)N(C)[C@@H](C)c1ccccc1O 2157830889 CYHZBUUWFIIQCJ-AAEUAGOBSA-N 296.436 2.382 10 10 CECE CNCc1cc(F)c(N(C)C2CCC(O)CC2)c(F)c1 2160136574 XHPBYGRODYSOEY-UHFFFAOYSA-N 284.350 2.424 10 10 CECE CC(C)(C)[C@@H]1OCCC[C@@]1(O)[C@H](N)c1ccccc1O 2160253894 OFEZBHAFDCJZJD-IJEWVQPXSA-N 279.380 2.348 10 10 CECE Oc1cccc(F)c1CN(CC1CCCC1)C1CNC1 2160786643 SGTBYIWJKQQZLO-UHFFFAOYSA-N 278.371 2.495 10 10 CECE COc1ccc(N(C)[C@@H]2CCC[C@@H]2CN)c([N+](=O)[O-])c1 89112960 AYDDLEJIKCDGCF-ZYHUDNBSSA-N 279.340 2.167 10 10 CECE CCN[C@@H](C)c1ccc(N2CC=CC[C@@H]2CO)cc1O 2176341377 GVPDRISXYMOOSJ-GXTWGEPZSA-N 276.380 2.190 10 10 CECE Nc1ccc(O)c(CN2CCC[C@@H](n3cccn3)C2)c1 2171250662 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CN(C)c1ccc([C@H](O)C2(N)CC(C(F)(F)F)C2)cc1 2163071831 RUYXBSFWLKVGRN-YDGIUTOCSA-N 288.313 2.456 10 10 CECE Cc1cnc([C@H](N)c2ccc(N3CCCC3)cc2)cn1 2163108084 WBBHSRJXPNLGRT-MRXNPFEDSA-N 268.364 2.433 10 10 CECE CCOC1CN(c2ccc(CN)cc2C(F)(F)F)C1 382768927 KBUSFIOUBWMHPL-UHFFFAOYSA-N 274.286 2.389 10 10 CECE CC1(C)CN(c2ccc(CN)cc2F)[C@H]2COC[C@@H]21 384578572 UQQYRBWGIYUXQM-FZMZJTMJSA-N 264.344 2.146 10 10 CECE C[C@H](N[C@H]1C[C@@H](C)O[C@@H]1C)c1c(O)cccc1O 384629635 RBMJUROIIRRUEA-YTWAJWBKSA-N 251.326 2.314 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2C[C@H](C)O[C@@H]2C)c1 384849512 BDWCQTCODJQOEX-MISXGVKJSA-N 265.353 2.399 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1C[C@H]2CCCN(C2)C1 717123516 DMEURIWEDWUEIN-BXUZGUMPSA-N 264.344 2.105 10 10 CECE CC[C@H](O)[C@@H](C)N[C@@H](C)c1ccc(OC)cc1O 386709262 PBKURKXOXDONFX-CWSCBRNRSA-N 253.342 2.211 10 10 CECE COCCN(CCF)c1ccc(C[C@@H](C)N)c(C)c1 697328084 VTGNMCNJLOMWIW-CYBMUJFWSA-N 268.376 2.307 10 10 CECE CO[C@]1(CN[C@H](C)c2ccc(O)cc2O)CCSC1 719275652 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OC1(CCNCc2ccc3c(c2)CCO3)CCCC1 404182029 JTIRDXFRYWULPW-UHFFFAOYSA-N 261.365 2.406 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])C[C@@H](C)c2ccccc21 312527706 FPKOHZDJQUPCBM-YGRLFVJLSA-N 274.324 2.462 10 10 CECE CC1(C)CN(CCCOc2ccc(N)cc2)CC[C@@H]1O 312975177 PSKFSJOOTKOOBB-HNNXBMFYSA-N 278.396 2.131 10 10 CECE Cc1nc([C@@H]2CCN2c2ccc([C@H](C)O)c(O)c2)no1 2160460215 PWCXUINDWJQETM-UFBFGSQYSA-N 275.308 2.088 10 10 CECE COc1cccc(O)c1CN[C@H]1CC[C@@H](C(=O)O)CC1 2160722438 GFGMVMKDSBFUHQ-PHIMTYICSA-N 279.336 2.134 10 10 CECE CN(Cc1ccc(C(=O)O)o1)Cc1c(O)cccc1F 2160812231 VBSYFAFYFVJWMN-UHFFFAOYSA-N 279.267 2.455 10 10 CECE COCCCOc1ccc(N2CCC[C@H](N)C2)c(F)c1 87439558 CZVICPZAJWMZIQ-LBPRGKRZSA-N 282.359 2.169 10 10 CECE CC[C@@H](N)c1ccc(N2CCn3c(C)nnc3C2)cc1 2170359209 TWONTZLQZUXAKE-CQSZACIVSA-N 271.368 2.017 10 10 CECE CCCO[C@@H]1CCN(c2ccc([C@@H](C)O)c(O)c2)C1 701719702 MQPSOOYKSJYGSS-DGCLKSJQSA-N 265.353 2.451 10 10 CECE COCC(COC)N(C)[C@@H](C)c1ccc(F)cc1O 702051465 URZTWJZDMSJVAF-JTQLQIEISA-N 271.332 2.186 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3CN(C)C[C@]3(C)C2)cc1 702262457 ODHOYWZCEPWWKO-IVMMDQJWSA-N 260.381 2.128 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)cc1 702262464 ODHOYWZCEPWWKO-XPKDYRNWSA-N 260.381 2.128 10 10 CECE CCn1cc(CN(C)c2ccc(CO)cc2C)cn1 703607842 AFWYTMOIZCPZDR-UHFFFAOYSA-N 259.353 2.340 10 10 CECE CN[C@H](C)c1ccc(N(C)CCN2CCCC2=O)cc1 2171070355 NMQDNPZXNAJLBK-CYBMUJFWSA-N 275.396 2.026 10 10 CECE C[C@@H]1NCCN([C@@H](C)c2ccc(N(C)C)cc2)[C@H]1C 379464523 GSUDBAFLEKTVPV-IHRRRGAJSA-N 261.413 2.496 10 10 CECE CC1(C)[C@@H]2CN(C(=O)CCc3ccc(N)cc3)C[C@H]21 379535196 VQMWDNNBRNXLQS-ZIAGYGMSSA-N 258.365 2.316 10 10 CECE Cc1ccc(OCc2cn(C)nc2Br)c(N)n1 714081533 HBBQBMMWBAVEGC-UHFFFAOYSA-N 297.156 2.047 10 10 CECE CN([C@@H]1C[C@H]2CC[C@H]1C2)S(=O)(=O)Cc1ccc(N)cc1 382286099 PEYIHBUZQSPAGY-KCQAQPDRSA-N 294.420 2.219 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@H](C)[C@H](O)C1 388107468 UEBFSODVBTWVLG-XJKSGUPXSA-N 262.397 2.310 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](OC)C[C@@H]2CO)c(Cl)c1 383383169 NZVPLSYOYISRAZ-RAIGVLPGSA-N 298.814 2.206 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2C[C@@H](C)O[C@H]2C)c1 384849513 BDWCQTCODJQOEX-UHIISALHSA-N 265.353 2.399 10 10 CECE C[C@@H]1[C@H](CO)CCN1c1ccc(CN)c(Cl)c1 385623421 HMTKCNDUOXDPDC-KOLCDFICSA-N 254.761 2.006 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H](C)CCOC 386155394 JQASKXCUFYMLSF-GFCCVEGCSA-N 264.369 2.290 10 10 CECE NCc1ccc(N2CCC[C@](O)(C(F)(F)F)C2)c(F)c1 718911765 WNLAWSDZNPRQKV-GFCCVEGCSA-N 292.276 2.178 10 10 CECE COc1ccc(O)c([C@H](C)NCCCN2CC=CC2)c1 392846913 GLOAUXJOWFPARU-ZDUSSCGKSA-N 276.380 2.313 10 10 CECE CCOC(=O)[C@](C)(CCCOC)NCCCN=[N+]=[N-] 395392563 YULGDDNZEVDVDO-LBPRGKRZSA-N 272.349 2.025 10 10 CECE Cc1ccc(CN[C@H](C)c2cc(F)ccc2O)nn1 396665546 ZVZKADSBGXRQLU-SNVBAGLBSA-N 261.300 2.481 10 10 CECE C[C@@H](N)c1ccc(N(C)CC[S@](C)=O)cc1Cl 399229854 GHPUSJWWSDBKKR-XLFHBGCDSA-N 274.817 2.174 10 10 CECE CC[C@@H]1C[C@@H](C)CN1S(=O)(=O)Cc1ccc(N)cc1 399491358 IBHVLOUEVSLYJX-BXUZGUMPSA-N 282.409 2.219 10 10 CECE CCc1nnc(CN(C)c2ccc(OC)cc2)n1C 844353248 IYMRHRWDSRRTAV-UHFFFAOYSA-N 260.341 2.023 10 10 CECE C[C@H](CCNC(=O)[C@@H]1CNc2ccccc2N1)C(F)F 2166590219 WUKXCVBCTHJRNB-SKDRFNHKSA-N 283.322 2.300 10 10 CECE CCCN(Cc1cn(C)nc1OC)c1ccc(N)cc1 2167900508 ZEHJFIVPZVOJTF-UHFFFAOYSA-N 274.368 2.428 10 10 CECE CN(CCC1(C)CC1)c1ccc2c(c1)N(C)C(=O)[C@H]2O 2179761776 AFQWJWMURVVICR-AWEZNQCLSA-N 274.364 2.323 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2[C@@H]3COC[C@@H]32)c(F)c1 2174643383 LVADWCYZJMWTLY-RUZUBIRVSA-N 278.371 2.435 10 10 CECE Cn1ncc2cc([C@@H](O)Cc3ccc(N)cc3)ccc21 2177981179 KFUCGZQOONIKPV-INIZCTEOSA-N 267.332 2.432 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@H](CO)c2cscn2)c1 2175639618 TWKRNBFXBGSSRX-BXKDBHETSA-N 294.376 2.242 10 10 CECE Nc1ccc(CCCN2CCC3(CC[C@H]3O)CC2)cc1 2187423181 SCEIEUNUHSBMLS-MRXNPFEDSA-N 274.408 2.438 10 10 CECE CN[C@H](C)c1cc(F)c(N2CCN(C)C[C@H]2C)c(F)c1 2194711585 YNHAMZAWNCXAQN-GHMZBOCLSA-N 283.366 2.386 10 10 CECE C[C@H](c1ccccc1O)N(C)Cc1nsc(C(=O)O)n1 2192596291 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CN[C@H]1CCc2cc(N3CC[C@H](N4CCC4)C3)ccc21 2184711065 MZQJMBKIYUPREI-RDJZCZTQSA-N 271.408 2.178 10 10 CECE CN(C[C@@H]1C[C@H]2C[C@H]2CO1)c1ccc2c(c1)CC[C@H]2N 2184724788 DYOZSYCGGZYTPB-RPCCPQHDSA-N 272.392 2.494 10 10 CECE OC[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3O)CCC1(F)F 2184730119 RISMBHSZPPOSQI-FZMZJTMJSA-N 283.318 2.120 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H](C)[C@@H](O)C[C@H]3C)ccc21 2184711932 XZKLJHCROYRVGK-SONRMIBWSA-N 274.408 2.489 10 10 CECE C[C@H](NCc1c(O)cccc1Cl)[C@H]1C[C@@H]1C(=O)O 2054525611 YEHKTMVSMAZORR-YIZRAAEISA-N 269.728 2.244 10 10 CECE O[C@H]1C[C@@H]2CN(c3ccc4c(c3)CCC[C@H]4O)C[C@@H]2C1 2185081683 CETJFRHCXQMRIX-RPCCPQHDSA-N 273.376 2.263 10 10 CECE COC[C@H]1CN(Cc2cc(F)ccc2O)C[C@@H]1C 2054832388 OJQPMWWMYYXFIY-CMPLNLGQSA-N 253.317 2.246 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CO[C@@H](C(C)(C)C)C1 2185631796 LAVPFCWGEJDUIZ-ZWNOBZJWSA-N 284.360 2.023 10 10 CECE CCC[C@@H]1C[C@](O)([C@@H](N)c2ccc(N(C)C)cc2)CO1 2185604879 OXRCFCRTWIGRQL-OWCLPIDISA-N 278.396 2.073 10 10 CECE CO[C@@H]1CCC[C@@H](C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C1 2062716748 GIRIGSZTACBAGK-GMTAPVOTSA-N 252.318 2.103 10 10 CECE Oc1cccc(Cl)c1CNCc1cccn2nncc12 2185947401 AJCPDMBVMDKRBG-UHFFFAOYSA-N 288.738 2.378 10 10 CECE Nc1ccc(C[S@](=O)CCCOCC2CC2)cc1 2065054966 FKQLNPNEFNKTAE-GOSISDBHSA-N 267.394 2.334 10 10 CECE COC[C@@H]1C[C@H]1CN[C@H](C)c1cc(F)ccc1O 2069651464 VEYWADLPYWNHBG-VWYCJHECSA-N 253.317 2.464 10 10 CECE C[C@@H](NCc1ccn(C2CC2)n1)c1ccc(O)cc1O 2186853114 SBRGDROGPYILHO-SNVBAGLBSA-N 273.336 2.480 10 10 CECE CN1CCCc2cc(CN[C@]34CCOC[C@H]3C4)ccc21 2194415592 DTRQRAULSWWIGU-WBVHZDCISA-N 272.392 2.338 10 10 CECE CCCN1[C@@H](C)CN(Cc2cc(N)ccc2O)C[C@H]1C 2186948890 FNMRUFWXLSMPHU-BETUJISGSA-N 277.412 2.279 10 10 CECE CCN(c1c(F)cc([C@H](C)O)cc1F)C1COC1 2074076469 LYFGNKCDMLZOJG-QMMMGPOBSA-N 257.280 2.243 10 10 CECE Nc1ccc(Oc2ccccc2N2CCNCC2)cc1 2198918410 XVGNNNMJKQJKDF-UHFFFAOYSA-N 269.348 2.471 10 10 CECE COc1ccc(O)c(CN[C@H]2CCC[C@](C)(O)C2)c1 2102066523 QGQXEDZXWOXOFD-WFASDCNBSA-N 265.353 2.184 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@@]23CC[S@@](=O)C3)cc1 2102252282 SCPKBTDTKWTPGF-VRHCTWJESA-N 279.405 2.231 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3CCN(C)[C@@H]3C2)cc1 2102331159 TWMKCOCMUDSQDA-IVMMDQJWSA-N 260.381 2.270 10 10 CECE Cc1ccc(O)c(CNC2CC(O)(C(F)(F)F)C2)c1 2102591298 QOZOJDBPHXDOFR-UHFFFAOYSA-N 275.270 2.246 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3CCC[C@]3(CO)C2)cc1 2103167688 GNQRHWAXYSRNCG-XNRPHZJLSA-N 261.365 2.339 10 10 CECE Cc1nc([C@@H]2CCN2c2ccc([C@H](C)O)cc2)no1 2104173090 FLARVKNSDKFBIR-ZANVPECISA-N 259.309 2.383 10 10 CECE Cc1ccc(CN(C)C[C@H]2OCC[C@@H]2F)c(O)c1 2084088320 QVLXUXFGGACQTI-GXTWGEPZSA-N 253.317 2.259 10 10 CECE CCc1nc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)c(C)o1 2104311504 SBSLUJVUGRBGBI-VIFPVBQESA-N 263.301 2.318 10 10 CECE Cc1cccc(O)c1CN1CCC[C@H]1[C@@H]1CCCN1 2104484820 ZWXOYOYJOJLCMQ-GJZGRUSLSA-N 260.381 2.417 10 10 CECE c1cc2c(cc1N1CC[C@@H]([C@H]3CCCN3)C1)CCO2 2106393219 WXDZAOZTEYYHFF-UKRRQHHQSA-N 258.365 2.200 10 10 CECE CN1CCc2cc([C@@H](O)[C@@]3(C)CCCNC3)ccc21 2106797684 CZGMFNKTMJRWIY-CVEARBPZSA-N 260.381 2.102 10 10 CECE CCc1ocnc1[C@H](O)c1ccc2c(c1)CCN2C 2106792756 HCQGZMQBDOYYHU-OAHLLOKOSA-N 258.321 2.311 10 10 CECE CN1CCCc2cc([C@]3(O)C[C@H]4OCC[C@@H]43)ccc21 2106828868 REMGJDQNASFPOJ-NUEKZKHPSA-N 259.349 2.065 10 10 CECE CN1CCc2cc([C@H](O)C3(CCN)CCC3)ccc21 2106800666 JUQUPXREOIYQMV-HNNXBMFYSA-N 260.381 2.231 10 10 CECE NCCSC[C@H](O)c1ccc(N2CCCCC2)cc1 2106821991 ANSYZDNXWDTOGE-HNNXBMFYSA-N 280.437 2.402 10 10 CECE Cc1cc(O)nc(CNCc2c(O)cccc2Cl)n1 2106922653 AGIOBZGNYCDDSX-UHFFFAOYSA-N 279.727 2.139 10 10 CECE COc1ccc(CNC2(CO)CC(C)(C)C2)c(O)c1 2107262591 OTOQTAMNMAXPMR-UHFFFAOYSA-N 265.353 2.042 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C[C@H]3O)C2)cc1 2107282125 HUMVFTVQGFVZNX-CQJJVWNLSA-N 260.381 2.174 10 10 CECE Cc1cc(C(=O)c2cccc3c2NCC3)c(C)nn1 2107702974 WOPYLROOEMWAJH-UHFFFAOYSA-N 253.305 2.292 10 10 CECE COc1ccc(N2[C@H](CO)C[C@H]3CCC[C@H]32)c(N)c1 2108593932 YBTWKUCGMWHSCN-UHIISALHSA-N 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COCCCC[C@H](NN)c1ccc(N(C)C)cc1 304500320 UYHHVTXLKLBOHD-AWEZNQCLSA-N 251.374 2.074 10 10 CECE C[C@@H](NC(=O)c1cc(O)cs1)c1cncc(F)c1 782132066 IUZRLKKILZNWQJ-SSDOTTSWSA-N 266.297 2.479 10 10 CECE Oc1cc(Oc2c(O)cccc2O)cc(O)c1O 82312347 DDZGGVIBSMYGHU-UHFFFAOYSA-N 250.206 2.007 10 10 CECE CN(C)CC[C@@H]1CCN(CCCc2ccc(N)cc2)C1 701428627 XZTJCUIAINRCKN-MRXNPFEDSA-N 275.440 2.475 10 10 CECE Oc1ccc(O)c([C@H]2NCCc3c2ccc(F)c3O)c1 83656611 KLZBGBRBIXXVFX-AWEZNQCLSA-N 275.279 2.178 10 10 CECE O=C(NCc1cc(Br)ccc1O)N1CCCC1 796639834 LGLZPWNINXKQLI-UHFFFAOYSA-N 299.168 2.460 10 10 CECE CCCN(CC(=O)O)[C@@H](C)c1ccc(F)cc1O 86776181 VUHFUWVEOYKUGJ-VIFPVBQESA-N 255.289 2.389 10 10 CECE COC1CC(C[C@H](NN)c2ccc(N(C)C)cc2)C1 704192814 DMJCTQOCKGGYPB-KWCHVYNWSA-N 263.385 2.072 10 10 CECE CCSC[C@@H](C)N(C)c1cc2c(cc1N)OCC(=O)N2 706414764 BCZGPHCONQQDIA-SECBINFHSA-N 295.408 2.178 10 10 CECE C[C@H]1N(c2ccc(CN)c(F)c2)CCOC1(C)C 687991970 ZKWMDMBUYVSATL-SNVBAGLBSA-N 252.333 2.288 10 10 CECE 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2.216 10 10 CECE O=C(NCc1cc(O)ccc1O)C1(Oc2ccccc2)CC1 1303225681 NAHUQVDOJPDMSQ-UHFFFAOYSA-N 299.326 2.326 10 10 CECE Cc1csc([C@H](C)C(=O)NCc2c(O)cccc2O)n1 1304053967 YBJPYMPZWKBEOF-SECBINFHSA-N 292.360 2.283 10 10 CECE CNCc1ccc(N(C)CC2[C@@H]3COC[C@@H]23)cc1C 2118008501 DBOZJDINRNOIHB-HOTGVXAUSA-N 260.381 2.043 10 10 CECE C[C@@]12C[C@@H](CO1)N(c1ccc3c(c1)CCC[C@@H]3O)C2 2128273208 JXFAMSIFTIQBPV-BPUTZDHNSA-N 259.349 2.424 10 10 CECE N[C@@H]1CCc2cc(N3CCO[C@H](CCF)C3)ccc21 2128294577 LDLDKJQFYLXORA-UKRRQHHQSA-N 264.344 2.197 10 10 CECE COCCOCCN(C)c1cc(Cl)c(CN)cc1F 2120882033 SCXQCDHTQMEHDM-UHFFFAOYSA-N 290.766 2.037 10 10 CECE COC[C@H]1CCCN(c2ccc3c(c2)CC[C@H]3N)C1 2128311748 YXXXCXBIWYGFSD-BLLLJJGKSA-N 260.381 2.495 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@@H]1CO[C@H]2C[C@@H]1C2 2126702906 FBLTUWNUDPIZRT-GBIKHYSHSA-N 268.307 2.037 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CC(=O)N(C)C2)c(Cl)c1 2131958365 PEJIGROCIAUYIK-ONGXEEELSA-N 281.787 2.027 10 10 CECE CNCc1ccc(N2C[C@@H]3CC[C@]3(CO)C2)c(Cl)c1 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CC[C@](C)(OC)C(=O)N1CCC(CN=[N+]=[N-])CC1 1912173572 OBIUUWBEJXEKIR-LBPRGKRZSA-N 254.334 2.350 10 10 CECE COC(=O)[C@@]1(NCCCN=[N+]=[N-])CC[C@@H]2CC[C@@H]21 1912198559 ICVNSJKPSLNBFU-JBLDHEPKSA-N 252.318 2.008 10 10 CECE C[C@H]1C[C@@](NCCN=[N+]=[N-])(C(N)=O)c2ccsc2S1 1912186475 DUBBBJFWKOQYAG-CPCISQLKSA-N 297.409 2.213 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)c2ccnc(F)c2F)CC1 1912182505 CGQDCPCCBALWQZ-UHFFFAOYSA-N 267.239 2.275 10 10 CECE C[C@@H](CC(=O)N1CC[C@@H](N=[N+]=[N-])C1)C(F)(F)F 1912200115 CEYSQFZFBNXWJW-NKWVEPMBSA-N 250.224 2.486 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C[C@H]2CCCC(=O)N2)C1 1912206422 JSMUHVBCWKJTRF-VXGBXAGGSA-N 265.361 2.068 10 10 CECE Cc1ccc(C)c(NC(=O)CN(C)CCN=[N+]=[N-])c1 1912211302 VHEKPBJVZNMGIW-UHFFFAOYSA-N 261.329 2.484 10 10 CECE CC1(C)C[C@@](C)(CO)CN1c1ccc(CO)cc1F 2134828711 IOMZHAODKKLXOL-OAHLLOKOSA-N 267.344 2.305 10 10 CECE Oc1ccc(CN[C@@H]2C[C@@H]2C2CCOCC2)cc1O 2135450951 HRHWJJILYWZWEQ-CHWSQXEVSA-N 263.337 2.003 10 10 CECE CC[C@H]1CN(c2ccc(CNC3CC3)cc2)CCN1C 110730767 TVXRVGONFKVVPH-INIZCTEOSA-N 273.424 2.469 10 10 CECE CCc1onc(C)c1NC(=O)Cc1ccc(O)c(O)c1 1295085494 SGSRIYMDWZXIHA-UHFFFAOYSA-N 276.292 2.138 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC=C[C@@H]1C(=O)O 2136387257 MVIUBBSIRBZWOW-JOYOIKCWSA-N 265.284 2.307 10 10 CECE O=C(NCc1cc(Cl)ccc1O)c1nccs1 1469876113 BBSRHWIEUJQOKC-UHFFFAOYSA-N 268.725 2.432 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H](O)CC(C)(C)C2)cc1O 1923160951 NVVSOQJCEKBSLQ-ZYHUDNBSSA-N 264.369 2.009 10 10 CECE CC(=O)c1ccc(O)c(CN(CCCO)C2CCC2)c1 228418565 ZZKGEGKKOHUWRB-UHFFFAOYSA-N 277.364 2.332 10 10 CECE CN(C)c1ccc([C@@](C)(O)[C@H]2CC[C@@H](N)CC2)cc1 2137395560 YEJWOUZXUDGFDO-BJJXKVORSA-N 262.397 2.478 10 10 CECE Cc1csc(C(=O)NCc2cccc(O)c2O)c1 1558161108 GUZCIUVWNVGKCM-UHFFFAOYSA-N 263.318 2.398 10 10 CECE Cc1ccccc1OCC(=O)NCc1ccc(O)cc1O 1639441392 SSVWUJCIVPGIPN-UHFFFAOYSA-N 287.315 2.101 10 10 CECE C[C@H](CC(=O)O)N(C)Cc1c(O)cccc1Cl 1926916131 DQZHKXCUPRTGMK-MRVPVSSYSA-N 257.717 2.341 10 10 CECE CCOC(=O)[C@@H](CC)[C@@H](N)c1ccc2c(c1)CCN2C 1927418467 KIYBJWQKNLFYQY-ZFWWWQNUSA-N 276.380 2.268 10 10 CECE O=C(NCc1cc(Cl)ccc1O)C1=C[S@@](=O)CCC1 1640924295 KSVFCLDGYTWNNM-IBGZPJMESA-N 299.779 2.088 10 10 CECE Cn1cc(C(=O)NCc2c(O)ccc3ccccc23)cn1 1645440620 LHFNVOFARSFACE-UHFFFAOYSA-N 281.315 2.209 10 10 CECE Cc1cc(N2C(=O)[C@H]3CCC[C@H]3C2=O)c(C)cc1N 232073553 IOQSBYWOVNLGBI-PHIMTYICSA-N 258.321 2.175 10 10 CECE Cc1ccc(CN2CCOc3ncccc32)c(O)c1 2139805480 WPGLHUMHOYMPQZ-UHFFFAOYSA-N 256.305 2.495 10 10 CECE Cc1cc(C=O)c(C)n1-c1ccc(S(C)(=O)=O)cc1 19440076 RMVOGRJJBWOMIU-UHFFFAOYSA-N 277.345 2.310 10 10 CECE OCc1ccc(N2CCC(C3(O)CCC3)CC2)cc1 2140258530 KZVRCTRFWJTODK-UHFFFAOYSA-N 261.365 2.310 10 10 CECE C[C@H](CC(=O)O)[C@@H]1CCCN(Cc2ccc(O)cc2O)C1 155910590 RFDVLRZYXOXDGJ-VXGBXAGGSA-N 293.363 2.421 10 10 CECE CNCCCCN(C)c1ccc2c(c1)CCC(=O)N2 259014847 YDRXEUBEHVQVLG-UHFFFAOYSA-N 261.369 2.007 10 10 CECE O=C1C[C@H](c2cc(O)c(O)c(O)c2)Oc2cc(O)ccc21 14728183 RZPNYDYGMFMXLQ-CYBMUJFWSA-N 288.255 2.216 10 10 CECE biogenic C[C@@H]1C[C@@H]2CN(c3ccc([N+](=O)[O-])c(CO)c3)C[C@@H]21 2141491936 OTTMPUVYKIQFMT-GIPNMCIBSA-N 262.309 2.179 10 10 CECE Nc1ccc(OCCN=c2nc(Cl)cc(Cl)[nH]2)cc1 2141656195 MCFGBNYDZQOMKG-UHFFFAOYSA-N 299.161 2.278 10 10 CECE NCC1CCC(NCc2ccc3c(c2)CCO3)CC1 817901992 GHBFSLXZIXMQMB-UHFFFAOYSA-N 260.381 2.229 10 10 CECE CC[C@H](NC[C@@H](OC)[C@H]1CCOC1)c1ccccc1O 850485155 YCDBVEORJZBNSN-DUVNUKRYSA-N 279.380 2.484 10 10 CECE CCc1occc(=O)c1OCCOc1ccc(N)cc1 1857908579 BWCCFJNNKGBKQK-UHFFFAOYSA-N 275.304 2.242 10 10 CECE CC[C@H](N)Cc1cnn(C)c1Sc1nccs1 1944924415 IDGJGTRCQBXZCL-VIFPVBQESA-N 268.411 2.308 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@H]2C[C@]21C(=O)O 2143929982 WFMZSUYVWYMZEH-HFBDOXOYSA-N 277.320 2.098 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@](C)(O)C2)cc1C 1876952725 YZRWMUWVEJVTLM-XJKSGUPXSA-N 262.397 2.312 10 10 CECE C[C@@H]1[C@@H](N(C)c2ccc(CO)cc2)C2CCN1CC2 1877881626 LCGIJCBXDXSGMY-MLGOLLRUSA-N 260.381 2.098 10 10 CECE Cc1nccnc1CNCc1ccc2c(c1)CCCO2 1963092469 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260775892 UJQDRRNKNGXQPP-JTQLQIEISA-N 285.315 2.191 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1cccnc1 35361215 ROWWQKHHUSWTEY-UHFFFAOYSA-N 255.321 2.326 10 10 CECE CN(Cc1cccs1)c1cc2c(cc1N)OCC(=O)N2 35716817 NQBLGJIWJFYISE-UHFFFAOYSA-N 289.360 2.298 10 10 CECE O=C1Nc2cc(N3CC4CC3(CF)C4)c(Cl)cc2[C@H]1O 2146900057 UEJSUZQYAMSNIM-BWQPLIALSA-N 296.729 2.264 10 10 CECE CCNCc1ccc(N2CC[C@H]([C@@H](C)O)C2)c(F)c1 162191092 XUDWLZWVNXYPPM-YPMHNXCESA-N 266.360 2.142 10 10 CECE CCC1(CC)CN(C(=O)c2cccc(O)c2O)CCO1 2152701863 QMIRFLWFFHPEBO-UHFFFAOYSA-N 279.336 2.129 10 10 CECE C[C@@H]1CN(Cc2ccc(O)c(O)c2)[C@H](C)C[C@H]1C(=O)O 2153774820 YIWHJRLMSLLRGL-CKYFFXLPSA-N 279.336 2.029 10 10 CECE C[C@@H](C(=O)NCC1(CN=[N+]=[N-])CC1)C(F)(F)F 2009554302 HCVBMPXMHNKILN-LURJTMIESA-N 250.224 2.392 10 10 CECE CO[C@H]1CCO[C@@H](CNCc2ccc(N(C)C)cc2)C1 2154192356 CMHBVKMBUWBQHB-JKSUJKDBSA-N 278.396 2.036 10 10 CECE C[C@@H]1CCCN(C(=O)CN2CCC[C@H](N=[N+]=[N-])CC2)C1 2155561941 AJGWRCZFRKIFGW-OLZOCXBDSA-N 279.388 2.410 10 10 CECE Cc1nn(C)c([C@@H](N)c2ccccc2O)c1Br 2017355560 GPJKQWNLHOLEHG-NSHDSACASA-N 296.168 2.245 10 10 CECE C[C@@H](NS(=O)(=O)C1(Cl)CC1)c1ccccc1O 2017521889 DTHXXWCRNLXAHO-MRVPVSSYSA-N 275.757 2.102 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(C)(N(C)C)C2)cc1O 2160657943 JLEGRQHDOIPWCM-LBPRGKRZSA-N 277.412 2.203 10 10 CECE CN[C@@H](C)c1ccc(N(C)C2CN(C)C2)cc1Cl 2028793228 HCMOLMCWMMZAAT-JTQLQIEISA-N 267.804 2.371 10 10 CECE CN[C@@H](CC(=O)N(C)[C@@H](C)c1ccccc1O)C(F)F 2156821841 VUQGOWRXAJTSEE-ONGXEEELSA-N 286.322 2.155 10 10 CECE COc1ccc([C@@H](C)NCc2cnc(C)cn2)c(O)c1 61320323 QZCNXZGPJIBFLH-LLVKDONJSA-N 273.336 2.350 10 10 CECE COc1ccc(CN(C)c2ccc(CN)cc2F)cn1 2157147738 GSQGLZZTKZWELY-UHFFFAOYSA-N 275.327 2.324 10 10 CECE Nc1ccc(OCCN2CC(C(F)(F)F)C2)cc1 2034860816 WMTXHFYHHHLNEV-UHFFFAOYSA-N 260.259 2.142 10 10 CECE COCCC1CC(NCc2ccc(O)c(O)c2)C1 2034962910 LNNDLJHYVWYHOP-UHFFFAOYSA-N 251.326 2.003 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CC12CC(N)C2 2157437268 BCQOLYXYWGIMOP-VIHGGKNESA-N 274.364 2.039 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2[C@H]3CC[C@@H](CN3)[C@H]2C1 2160786441 RHOFSEPMCPWGNX-LCGIIJARSA-N 272.392 2.130 10 10 CECE CNCC[C@@H]1CCCCN1Cc1ccc(O)c(O)c1 70190793 UDMPOHXQWWPMCF-ZDUSSCGKSA-N 264.369 2.062 10 10 CECE Nc1ccc(OCCC(=O)OCCOCC2CC2)cc1 400772817 PBUPCYHKAGIOOP-UHFFFAOYSA-N 279.336 2.008 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 403975833 MQESGLHCSBYCHI-SNVBAGLBSA-N 274.280 2.330 10 10 CECE COc1cccc(O)c1CNC[C@H]1CCC[C@@H]1N(C)C 2160711871 FJBIFKKMQQEJJO-OCCSQVGLSA-N 278.396 2.221 10 10 CECE COC(=O)C(C)(C)CN[C@H](C)c1ccc(OC)cc1O 312221079 DUPCOQAADGTDHQ-SNVBAGLBSA-N 281.352 2.251 10 10 CECE CNCc1ccc(N2CCC[C@@]23CC[S@@](=O)C3)cc1C 2158454798 QEIPNDSPBYCACZ-OXJNMPFZSA-N 292.448 2.206 10 10 CECE CN[C@H](C)c1ccc(N2CC(F)(F)C[C@H]2CO)c(F)c1 2159051040 WXYGYFYCGMVWGU-KOLCDFICSA-N 288.313 2.312 10 10 CECE Cc1ccnc([C@H](N)[C@H](O)c2ccc(N(C)C)cc2)c1 2159149443 RKOWWPGMUXIXPM-JKSUJKDBSA-N 271.364 2.189 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])c1ccc(O)cc1 90257430 FCNAZEDSTXMXMM-CYBMUJFWSA-N 278.312 2.070 10 10 CECE CN(C)C[C@@H]1CCN(c2ccc(CN)cc2Cl)C1 688546123 BAVBNGJXVAIRNH-LBPRGKRZSA-N 267.804 2.187 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2CCC[C@@H]3CC[C@H]32)cc1 2172406324 HXNRQQVMGYZRKM-KCPJHIHWSA-N 274.364 2.343 10 10 CECE CCOC[C@@H]1CN(c2ccc3c(c2)CCCN3)CCO1 705869318 AUOCPBJCNBGIQI-HNNXBMFYSA-N 276.380 2.286 10 10 CECE Nc1ccc(NC(=O)N2CC[C@H](C(F)F)C2)cc1 707020756 KPXGFOHJAKJCSK-QMMMGPOBSA-N 255.268 2.388 10 10 CECE C[C@H](N)[C@@](O)(c1ccc2c(c1)CCCN2C)C(F)(F)F 2163111771 VPUDJAIFYUPOGL-TVQRCGJNSA-N 288.313 2.166 10 10 CECE CN(C)c1ccc([C@H](N)[C@@]2(O)C[C@@H]3CSC[C@@H]3C2)cc1 2163132195 ZCKJWYDFSILSEU-XRGAULLZSA-N 292.448 2.257 10 10 CECE CN1CCc2cc([C@@H](N)[C@](C)(O)c3ccco3)ccc21 2163131018 NDVRMKAPVQRAIO-HZPDHXFCSA-N 272.348 2.179 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@@H](CO)C(C)(C)C)cc1O 689311044 MLOSWGNELVOSFJ-YGRLFVJLSA-N 267.369 2.289 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](CO)C(C)(C)C)cc1O 689311043 MLOSWGNELVOSFJ-QMTHXVAHSA-N 267.369 2.289 10 10 CECE CC[C@@H](CO)N(C)c1ccc(CN)cc1C(F)(F)F 379203525 ZJLRBYISWRIURQ-JTQLQIEISA-N 276.302 2.371 10 10 CECE CN[C@H](C)c1ccc(N2CCO[C@@H](C)[C@@H]2C)cc1O 380489234 AZPUHBLXBLWFPX-WOPDTQHZSA-N 264.369 2.286 10 10 CECE CN(C)c1ccc(CNC[C@@H]2CCN2C2CC2)cc1 691833694 JOXOKNCSDWMXSX-INIZCTEOSA-N 259.397 2.079 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC[C@@H](C)[C@@H](C(=O)O)C1 693430512 MGCDSTURGIZKOG-NRUUGDAUSA-N 279.336 2.201 10 10 CECE CCN(C[C@@H](C)OC)[C@@H](CN)c1ccc(N(C)C)cc1 383222850 OJYLVVTVDLXYRY-CJNGLKHVSA-N 279.428 2.109 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC(O)(C2CC2)C1 384048833 MEZLXWKROSQHQV-UHFFFAOYSA-N 274.408 2.454 10 10 CECE CC1(C)CO[C@H](CNCc2cc(F)ccc2O)C1 717394991 MTONAYKLLBKDHL-LBPRGKRZSA-N 253.317 2.436 10 10 CECE COC1(OC)CC[C@H]1CN[C@@H](C)c1cc(O)ccc1O 2173382165 NZZBDJVRBQNAEZ-QWRGUYRKSA-N 281.352 2.148 10 10 CECE CC(C)(C)C[S@@](=O)CCC(=O)Nc1ccc(N)cc1 718781870 GTXUEZYHXDFKJA-IBGZPJMESA-N 282.409 2.392 10 10 CECE C[C@@H]1CCN(c2c(F)cc(CN)cc2F)CCO1 720480569 DQSAIEMCBRGIIE-SECBINFHSA-N 256.296 2.039 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCO[C@H](C(C)(C)C)C1 721531123 OLNGMNUBFCVQNX-GWCFXTLKSA-N 284.360 2.023 10 10 CECE C[C@H](NCc1cccc(F)c1O)C1CCN(C)CC1 396472288 YOYRKTJKZWLHRU-NSHDSACASA-N 266.360 2.351 10 10 CECE C[C@@H]1CC[C@H](CN[C@H](C)c2cc(O)ccc2O)O1 398181292 XHSQDWIUIXMJFW-CKYFFXLPSA-N 251.326 2.316 10 10 CECE CNC(=O)CCCNCc1c(C)c2ccccc2n1C 398400298 NFEZAMPLNRVEAX-UHFFFAOYSA-N 273.380 2.103 10 10 CECE Cc1sc2nc3n(c(=O)c2c1C)CCC3=Cc1cnn[nH]1 2062143105 NVBUFDWLNNMLNH-UHFFFAOYSA-N 299.359 2.137 10 10 CECE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](C)CC[C@H]3C)c2n1 2063194853 AEQYLXSOSFIOBT-GXSJLCMTSA-N 288.351 2.004 10 10 CECE Cc1cc(N2CCN(CCF)CC2(C)C)ccc1CN 2175034574 QKWVBBPZFFFSAK-UHFFFAOYSA-N 279.403 2.324 10 10 CECE Cc1cccc([C@H](C)n2cc(CN(C)C)c(O)n2)c1O 2070711165 XCMVVKZKHKSMBP-NSHDSACASA-N 275.352 2.274 10 10 CECE CCNC(=O)[C@@H]1CCCN1c1ccc([C@@H](N)CC)cc1 2169610011 XHUVJSOSHVWHGN-GJZGRUSLSA-N 275.396 2.201 10 10 CECE CCN(C)C[C@@H]1CCN(c2c(F)cc(CN)cc2F)C1 2170240041 ZVCOESYBSBLQNR-NSHDSACASA-N 283.366 2.202 10 10 CECE C[C@@H]1CC[C@@H](C(=O)O)CN1CCCc1ccc(N)cc1 2179652673 VALFWMGVALIBED-TZMCWYRMSA-N 276.380 2.387 10 10 CECE COc1ccc(O)c(CN2CC=C(CC(=O)O)CC2)c1 2181677180 GMSOLWYNCNYAAH-UHFFFAOYSA-N 277.320 2.008 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H](O)[C@@H](O)CC2(C)C)cc1Cl 2188677101 HVTFCZUBOBRTOX-IIMNLJJBSA-N 299.798 2.104 10 10 CECE O=C(NCC[C@H]1CC=CCC1)c1cc(O)c(O)c(O)c1 2188868677 VIYRCWKJZCHHMR-JTQLQIEISA-N 277.320 2.280 10 10 CECE COCCNCc1ccc(N2CC[C@@H]2[C@H](C)O)c(Cl)c1 2182240681 NEGVTZYJVIZWFZ-SMDDNHRTSA-N 298.814 2.036 10 10 CECE FC[C@H]1COCCN1c1ccc(CNC2CC2)cc1F 2182600949 CJHOCCQHVCEKIF-ZDUSSCGKSA-N 282.334 2.252 10 10 CECE O=C(c1cccc(O)c1O)N1C[C@H]2CC(F)(F)C[C@H]2C1 2182835460 HQQJOKDLRMFFRU-DTORHVGOSA-N 283.274 2.215 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@]23C[C@H](CCO2)C3)cc1O 2193655009 IFXPJHWPHMASOR-HSMVNMDESA-N 277.364 2.451 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3NCCSC3(C)C)ccc21 2193903263 WMGJMZFYPJFAEA-LSDHHAIUSA-N 292.448 2.196 10 10 CECE CN(C)c1ccc(CN(C)[C@@H]2CC(F)(F)C[C@@H]2O)cc1 2189826066 USRDKWHMZWYVNL-KGLIPLIRSA-N 284.350 2.343 10 10 CECE COC[C@@H]1C[C@H]1CN1CCc2cc(OC)c(OC)cc21 2190088646 FEPZBULSSWUWDC-STQMWFEESA-N 277.364 2.349 10 10 CECE CCc1cccc(CNC2CC(n3ccnn3)C2)c1O 2184109330 GOHGNVSKFYOVCG-UHFFFAOYSA-N 272.352 2.039 10 10 CECE N[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CC(F)(F)C1 2184232470 CCJUYLCWHGHAEP-ZETCQYMHSA-N 292.232 2.181 10 10 CECE CN(Cc1cc(N)ccc1O)C[C@H]1C[C@]12CCCOC2 2198226867 GFUXYVVQQRFTEJ-CJNGLKHVSA-N 276.380 2.223 10 10 CECE O[C@H]1CCc2cc(N3CC(OCC(F)(F)F)C3)ccc21 2184741625 MGIVEYKFTYQBKH-ZDUSSCGKSA-N 287.281 2.434 10 10 CECE CN[C@H]1CCc2cc(N3C[C@H](CO)C4(CC4)C3)ccc21 2184727171 TYBYXBFBPWBCOB-CJNGLKHVSA-N 272.392 2.102 10 10 CECE O[C@H]1CCc2cc(N3CC[C@H]4CC[C@H](O)[C@H]3C4)ccc21 2184731210 FMSADWVIADHSGP-JKEMJCCQSA-N 273.376 2.406 10 10 CECE O[C@H]1CCc2cc(N3C[C@H]4CC[C@@H](O)C[C@@H]4C3)ccc21 2184732364 SWIUIGVTCSDLNF-SMKXDYDZSA-N 273.376 2.263 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](O)CC3(CC3)C2)c(F)c1 2194516881 WNQAQXNNSLWTIL-ONGXEEELSA-N 283.318 2.369 10 10 CECE CN1CCc2cc([C@H](NN)[C@H]3[C@H]4[C@H]5C[C@@H]3C[C@H]54)ccc21 2190933402 LWXWNFCKVOQGOH-QLCXEISLSA-N 269.392 2.085 10 10 CECE C[C@H]1CCO[C@H]1CCNCc1c(O)cccc1F 2042599022 HTIAPACKPKRUFD-HZMBPMFUSA-N 253.317 2.436 10 10 CECE NCC[C@@H]1CCCCN1Cc1c(O)cccc1F 2042632481 HCSKCCFSOTVOAS-NSHDSACASA-N 252.333 2.235 10 10 CECE Nc1ccc(CCNc2nc(Cl)nnc2Cl)cc1 2044031057 VKBNOHJQYMDMRW-UHFFFAOYSA-N 284.150 2.415 10 10 CECE N[C@@H]1[C@H]2C[C@H]1N(c1ccc(OC(F)(F)F)cc1)C2 2044342596 OKYPRGPBDJCQIY-WHGOUJPWSA-N 258.243 2.121 10 10 CECE CN1CCc2cc([C@@](C)(N)c3cncs3)ccc21 2044710546 JOQMNPMXDCAGTK-CQSZACIVSA-N 259.378 2.358 10 10 CECE CCn1nc(CN(C)CCc2ccc(N)cc2)cc1C 2185746037 KMYYRERZNDWWMQ-UHFFFAOYSA-N 272.396 2.468 10 10 CECE CN(C)c1ccc(CN[C@@H]2CC[C@]23CCCNC3)cc1 2186129224 ZOOLVRFUBYTRRX-SJORKVTESA-N 273.424 2.374 10 10 CECE Nc1ccc(CCNc2ccc(N)cc2C(=O)O)cc1 2191691000 XKLVQEXGJGNGDR-UHFFFAOYSA-N 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CCOC(=O)[C@H]1CCN[C@@H](c2cccc(OC)c2O)C1 1952453250 WOVXRZYHSLMYBV-CMPLNLGQSA-N 279.336 2.005 10 10 CECE COc1ccc(O)c(CN(CC(=O)O)c2ccccc2)c1 86739396 ZQKCMFHKACLTRM-UHFFFAOYSA-N 287.315 2.492 10 10 CECE Cc1occc1CN(C)C[C@@H](O)COc1ccc(N)cc1 48912060 PCVUCMFVUVAQII-OAHLLOKOSA-N 290.363 2.042 10 10 CECE CC[C@H](O)[C@H](N)c1c(O)c(Br)cc(F)c1F 95805577 IHOZGGDCZMXQOT-RCOVLWMOSA-N 296.111 2.204 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCC(C)(C)C1 90256803 CSYMNNPFQJHCKL-GFCCVEGCSA-N 254.334 2.398 10 10 CECE CCN(c1ccc(OC)cc1N)[C@@H](C)CN(C)C 232246520 POIKBMOPESRIQD-NSHDSACASA-N 251.374 2.054 10 10 CECE C[C@](F)(C(=O)O)c1cc(O)c(O)cc1Br 257861110 VNEHNOZLBHRHAZ-SECBINFHSA-N 279.061 2.130 10 10 CECE [N-]=[N+]=N[C@@H]1CN(C(=O)OCc2ccccc2)CC[C@@H]1O 202912528 PWVDWURTOBCLJW-NEPJUHHUSA-N 276.296 2.069 10 10 CECE C[C@H](NCC[C@H](C)N(C)C)c1c(O)cccc1O 700488595 IJIMGXSYCSKLAO-QWRGUYRKSA-N 252.358 2.089 10 10 CECE COC(=O)[C@]1(C)C[C@@H](N=[N+]=[N-])CN1C(=O)OC(C)(C)C 383711488 KJXORGSKMFPFFR-PELKAZGASA-N 284.316 2.238 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@H]1CCCCN1C 2163069576 QTJXLMTZMMJUMU-IAGOWNOFSA-N 273.424 2.424 10 10 CECE CCN1CCc2cc([C@@H](NC)c3ccnnc3)ccc21 2163073216 HBCKBTBNJQRTAU-MRXNPFEDSA-N 268.364 2.168 10 10 CECE CCn1ccc([C@@H](N)c2ccc3c(c2)CCCN3C)n1 2163110629 KDMFAKCVRNEGDJ-INIZCTEOSA-N 270.380 2.334 10 10 CECE C[C@@H](N)[C@](O)(c1ccc(N2CCCC2)cc1)C(F)(F)F 2163110011 FDMOMYNSRIESII-MFKMUULPSA-N 288.313 2.384 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)C[C@@H]4CCC[C@H]43)ccc21 2163140206 GYJOJIQLNSKNAG-FSDCSDTHSA-N 272.392 2.230 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)[C@H]1[C@H]2CCCC[C@H]21 2167216445 YCTFAIFUYGQNQB-JJLQDPRZSA-N 275.348 2.193 10 10 CECE COC[C@@]12CN(c3ccc(CCN)c(C)c3)C[C@]1(C)C2 2165447209 WPVQZQAHDXQICT-DLBZAZTESA-N 274.408 2.359 10 10 CECE CN(Cc1ccccc1O)C(=O)CNCc1ccccc1 701239885 RRKRBOCNACWGNW-UHFFFAOYSA-N 284.359 2.140 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCCN2C)[C@H]1C=CCN1 2164252951 UETMEWOEXUILJC-WBVHZDCISA-N 271.408 2.248 10 10 CECE COc1cccc(CNCC2([C@H]3CCCO3)CC2)c1O 2164393235 CLIKLMIOZXRFKV-CQSZACIVSA-N 277.364 2.450 10 10 CECE COc1cc(C)c(N2C[C@@H](N)C[C@]23CCOC3)cc1C 2162633678 AODQCGYYCBXEQN-BBRMVZONSA-N 276.380 2.009 10 10 CECE N[C@H]1CN(c2ccc3c(c2)OC(F)(F)O3)CC12CCC2 2162666683 FVWDASOPLSHQNA-LBPRGKRZSA-N 282.290 2.326 10 10 CECE C[C@@H](N)c1ccc(N2CCN3CCC2CC3)c(F)c1 722783748 SFMPHOMFIFBKLV-LLVKDONJSA-N 263.360 2.130 10 10 CECE O=C1N[C@@H](c2cc(O)ccc2O)[C@@H](C2CCCC2)O1 575250915 VRDXKWHPBOQTIM-QWHCGFSZSA-N 263.293 2.438 10 10 CECE COC(=O)Cc1ccc2scc(O)c2c1/C=C/C(=O)O 725413087 KABHKVBCHKHZOM-HWKANZROSA-N 292.312 2.420 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2ccc3nncn3c2)C1 2131251253 ZPSPPCLRCFINKS-NSHDSACASA-N 257.301 2.004 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@H]3CC[C@@]32CN)c1O 903853979 IDCUYGKVVHMFAO-MLGOLLRUSA-N 292.354 2.047 10 10 CECE COC[C@](C)(O)CCN[C@@H](C)c1cc(C)ccc1O 834844944 WILMXXGOOMYBDD-SWLSCSKDSA-N 267.369 2.139 10 10 CECE Oc1cccc2c1[C@@H](N[C@H]1CCc3nc[nH]c3C1)CC2 834808232 YPFPJXSCJCUKFI-AAEUAGOBSA-N 269.348 2.250 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@H]1CCC[C@@H]2C[C@H]21 910944175 SWKRJYKBCKULLS-OASPWFOLSA-N 261.321 2.150 10 10 CECE Oc1ccccc1CN1CCO[C@]2(CCSC2)C1 843417391 FIFIQWVDPANNLN-CQSZACIVSA-N 265.378 2.100 10 10 CECE C[C@H](NCc1cnn(C)n1)c1ccc(Cl)cc1O 841758354 SKAJOBSQWIUYPZ-QMMMGPOBSA-N 266.732 2.025 10 10 CECE CCN(CC)c1ccc(CN2CCO[C@H]([C@H](C)O)C2)cc1 840978906 XAXVTOBCWGPGKA-YOEHRIQHSA-N 292.423 2.114 10 10 CECE CN(C[C@@]12COC[C@@H]1C2)c1ccc(CNC2CC2)cc1 689288643 YDSKVVRAIUIMEM-YOEHRIQHSA-N 272.392 2.411 10 10 CECE COC[C@@H](CC(C)(C)C)NC(=O)c1cccc(O)c1O 848313920 ZJZDYQSOHOXEMZ-SNVBAGLBSA-N 281.352 2.279 10 10 CECE Cc1ccc(O)c(CN2CC(CO)(c3ccccc3)C2)c1 840969772 KBXKPOZYPHPSRK-UHFFFAOYSA-N 283.371 2.447 10 10 CECE COC[C@@H]1CN(Cc2c(O)cc(C)cc2Cl)CCO1 840917421 KBJUHCWAFMRMBX-NSHDSACASA-N 285.771 2.201 10 10 CECE Cc1cc(O)c(CN2CC[C@@H]3CNC[C@@H]3CC2)cc1C 843127510 RYDLJOBLKGZZML-GASCZTMLSA-N 274.408 2.440 10 10 CECE C[C@H]1C[C@H](NC(=O)NCc2c(O)cccc2F)CS1 922881995 LBMWOOMXBXVZQP-IUCAKERBSA-N 284.356 2.225 10 10 CECE O=C(NCc1c(O)cccc1F)[C@@H]1CC[C@H]2CCCCN12 928709775 FYINDRVBUBGWNJ-RISCZKNCSA-N 292.354 2.164 10 10 CECE CCc1cccc(CNc2ccc(=O)n(C)c2)c1O 691516000 WXHFBEZSCGWSHI-UHFFFAOYSA-N 258.321 2.265 10 10 CECE CC/C=C(/F)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 867301649 DAPMTCFVNTUNCU-VMDVGJCFSA-N 267.300 2.408 10 10 CECE Nc1ccc(OCc2nn3c(C4CC4)nnc3s2)cc1 133472501 IVPIHOANFQDGHP-UHFFFAOYSA-N 287.348 2.224 10 10 CECE CCN(C)c1ccc(CN2CCSC[C@H]2CCO)cc1 773767120 WYCLKKWGEQQZKE-MRXNPFEDSA-N 294.464 2.443 10 10 CECE O=C(NCCCSc1nccs1)[C@H]1[C@H]2OCCC[C@@H]21 780512279 VNQOCONVUFWXPC-MXWKQRLJSA-N 298.433 2.167 10 10 CECE CO[C@H](C)CN(C(=O)c1ccc(C)c(O)c1O)C(C)C 780949581 KUABJACVWOQOSG-LLVKDONJSA-N 281.352 2.292 10 10 CECE CC[C@@]1(c2cc(Cl)cc(F)c2O)COCCN1 83433308 UINPMVMEKBBYES-LBPRGKRZSA-N 259.708 2.410 10 10 CECE CC(C)(C)Cc1nnc([C@@H](N)c2ccccc2O)o1 83447378 YTBZHXJYOYGTDH-LBPRGKRZSA-N 261.325 2.412 10 10 CECE COc1cc2c(cc1Cl)N(CCN)CC2(C)C 84798963 OMGRVEODBPHFGA-UHFFFAOYSA-N 254.761 2.405 10 10 CECE CN(C)c1ccc(CNC(=O)CCC(F)F)cc1 792848530 MJKUPIYGLSPQAT-UHFFFAOYSA-N 256.296 2.414 10 10 CECE COc1ccc(CNC(=O)c2c(C)cccc2O)c(O)c1 1139032541 NAQMWZKDFXCVRV-UHFFFAOYSA-N 287.315 2.345 10 10 CECE Nc1ccc(OCCC(=O)NCC2=CCCC2)cc1 702383373 DDNFGYGCCPHGHH-UHFFFAOYSA-N 260.337 2.264 10 10 CECE CSc1ncc(CN[C@@H]2CO[C@H]3C[C@@H]2C3)s1 2243811465 RDWHXZLCBYKBKZ-KHQFGBGNSA-N 256.396 2.132 10 10 CECE COC[C@@H](C)[C@@H](C)NCc1cc(F)cc(F)c1O 708453593 JGMQMLRRNWVYAI-RKDXNWHRSA-N 259.296 2.431 10 10 CECE CCc1nc(S[C@H](C)C(=O)Nc2ccc(N)cc2)n[nH]1 713456447 SPSRHWVHINEFPT-MRVPVSSYSA-N 291.380 2.069 10 10 CECE COc1ccc(CNC(=O)C(C)(C)CCC(C)=O)c(O)c1 794373900 OGCCQLKIBXBCGA-UHFFFAOYSA-N 293.363 2.412 10 10 CECE CC(C)[C@H]1C[C@@H](N(C)C(=O)Cc2ccc(N)cc2)CO1 691362157 YWXJGNZAXHRVDA-HUUCEWRRSA-N 276.380 2.083 10 10 CECE C[C@H](N[C@@H](CO)C1CCC1)c1ccc(F)cc1O 717626900 TXCBHMWCXNUZPY-ZANVPECISA-N 253.317 2.343 10 10 CECE COc1ccc(N(C)C[C@H](N)Cc2cncs2)cc1 719029318 GSRGGEULMRHNSB-LLVKDONJSA-N 277.393 2.158 10 10 CECE COc1cccc(CN(C)Cc2ccc(N)cc2)n1 70093930 OSVNJMADKSTIPR-UHFFFAOYSA-N 257.337 2.304 10 10 CECE COc1ccc(N(C)CC[C@@](C)(CO)NC(C)C)cc1 70338526 WTWOUPMJKTXNJR-INIZCTEOSA-N 280.412 2.271 10 10 CECE CC(C)(C)N1CC[C@@H](NCc2cccc(O)c2O)C1 693892054 TXBPIXYUWSIMKK-GFCCVEGCSA-N 264.369 2.060 10 10 CECE CCN1CC[C@@H](N(CC)c2c(F)cc(CO)cc2F)C1 695349765 DUTVMZIJZOROSO-GFCCVEGCSA-N 284.350 2.378 10 10 CECE CC[C@H]1CNCCN1c1ccc2c(c1)OC(F)(F)O2 86176937 FIRJRMYBMBGTFU-VIFPVBQESA-N 270.279 2.196 10 10 CECE Nc1ccc(CCC(=O)NCC2C[C@H]3C[C@@H]3C2)cc1 698035769 WPKJDYWNDYJOAG-KBPBESRZSA-N 258.365 2.364 10 10 CECE CCCN(CC[C@@H]1COCCO1)c1ccc(N)cc1 1916662003 YMCXKMPLUPLCPZ-OAHLLOKOSA-N 264.369 2.291 10 10 CECE CNCc1ccc(N2CC[C@@]3(CCC[C@H]3O)C2)cc1 1918914987 FKOVSIJXXXHHBL-CVEARBPZSA-N 260.381 2.147 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1Cc1nnc2ccccn12 2123020053 NWNKYOGIEWKWTA-SNVBAGLBSA-N 257.301 2.004 10 10 CECE CCC[C@H](C)NC(=O)[C@@H](C)N1CCC[C@H]1CN=[N+]=[N-] 2123020701 WNMNRRNOIUWJJM-TUAOUCFPSA-N 267.377 2.454 10 10 CECE COc1cc(N)c(N2C[C@@H]3C[C@@H]3[C@@H]3C[C@H]32)cc1OC 2117418236 FJDZNYPBBMRKAB-QFOLPQNPSA-N 260.337 2.131 10 10 CECE Nc1ccc(N2C(=O)[C@H]3CC(F)(F)[C@@H]3C2=O)cc1Cl 2117913925 KRGHINPTYHFAIQ-RCOVLWMOSA-N 286.665 2.067 10 10 CECE O=S(=O)(Nc1ccc(O)c(F)c1)c1cccc(O)c1 2118183953 XBIADZNHENBCCE-UHFFFAOYSA-N 283.280 2.038 10 10 CECE Nc1ccc(CCC(=O)Nc2cnc(Cl)nc2)cc1 2118282126 QPFYPUZRXDLVQN-UHFFFAOYSA-N 276.727 2.284 10 10 CECE CC[C@@H](N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21)C(N)=O 2119075543 CXVLDZASELDSAV-GMTAPVOTSA-N 262.353 2.102 10 10 CECE C[C@@H](N)c1ccc(N2CC(=O)NCC2(C)C)c(Cl)c1 2119117341 LRZBYIHGDWYGFG-SECBINFHSA-N 281.787 2.075 10 10 CECE CCNCc1ccc(N2C[C@@H](CO)[C@@H](F)C2)c(Cl)c1 2120632394 VSZXBDAPNINARY-AAEUAGOBSA-N 286.778 2.216 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@@H](OC)C[C@H]32)c(C)c1 2121833048 RGTSVKDSXRAKEI-IMJJTQAJSA-N 260.381 2.328 10 10 CECE C[C@@H](O)[C@H]1CCN1c1ccc(CNC2CC2)cc1F 2125820363 FRBGGNXRTLRUQQ-QMTHXVAHSA-N 264.344 2.037 10 10 CECE Nc1ccc(CN(C[C@@H]2OCC[C@H]2F)C2CC2)cc1 2122522990 AHAIFWBJTQFFOX-CABCVRRESA-N 264.344 2.360 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](CO)C3)c(N)c1 2128250856 QSBXEJSAGIXQEY-CNDDSTCGSA-N 262.353 2.017 10 10 CECE O[C@H]1CCCc2cc(N3CCOCC34CC4)ccc21 2128268304 DYJJSBWQTPYPJO-HNNXBMFYSA-N 259.349 2.426 10 10 CECE CN[C@@H]1CCc2cc(N3CC(OC(F)F)C3)ccc21 2128313020 ODHOBSNDQKCZKD-CYBMUJFWSA-N 268.307 2.321 10 10 CECE CCN[C@@H]1CCc2cc(N3CC(O)(CC)C3)ccc21 2128315859 XFYVYULIBHPHNH-OAHLLOKOSA-N 260.381 2.245 10 10 CECE N[C@H]1CCc2cc(N3CC[C@@]4(CCOC4)C3)ccc21 2128329663 WTYMDIJSODXORE-JKSUJKDBSA-N 258.365 2.249 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CC[C@H]3O)C[C@@H]1CO 2128318119 JOCPNFPYZDGTTO-AXAPSJFSSA-N 261.365 2.121 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CC[C@]3(CO)C2)cc1 1903835211 JBQLVBUNPNUFAQ-IVMMDQJWSA-N 260.381 2.176 10 10 CECE C[C@H]1C[C@H](NCCOCCCO)c2c(O)ccc(F)c21 1345427397 QGNAXDWRUQQSTA-JQWIXIFHSA-N 283.343 2.068 10 10 CECE CCCC1(CNC(=O)c2cc(O)c(O)c(O)c2)CC1 2132348041 CKAABGZLRKIGAT-UHFFFAOYSA-N 265.309 2.114 10 10 CECE CCC[C@@H](NS(=O)(=O)Cc1ccc(N)cc1)C(F)F 2133476137 VCBQGUIKVWNNTG-LLVKDONJSA-N 292.351 2.122 10 10 CECE Cc1noc(C2CC2)c1C(=O)NCc1cccc(O)c1O 1347542536 NOJHPSBFLWFFOJ-UHFFFAOYSA-N 288.303 2.202 10 10 CECE COc1ccc2c(c1)NC(=O)[C@@]13CC[C@@](C)(CN21)C3 1911389595 INWKOJMJFUEAHA-CABCVRRESA-N 258.321 2.396 10 10 CECE CO[C@H]1CCN(c2ccc(CO)cc2Cl)[C@@H]1C 1914273961 DSUHVUDMRIIEQH-RNCFNFMXSA-N 255.745 2.446 10 10 CECE CC(C)CCNC(=O)[C@H](C)N1CCC(N=[N+]=[N-])CC1 1912155993 RXSDDIIWLLPAKH-NSHDSACASA-N 267.377 2.312 10 10 CECE Cc1csnc1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912153689 CXHLVUGRJAJTIH-MRVPVSSYSA-N 251.315 2.366 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCOCC(F)(F)F)C1 1912199279 QJWYHHNVIYNBGB-QMMMGPOBSA-N 252.240 2.198 10 10 CECE CC(C)c1nnsc1C(=O)N1CC[C@@H](CN=[N+]=[N-])C1 1912168716 WIKSWCZOCBMSLS-QMMMGPOBSA-N 280.357 2.434 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(CC(=O)Nc2ccccc2)C1 1912154665 DAEGAZWKDFWLMQ-LLVKDONJSA-N 259.313 2.257 10 10 CECE CC(C)S(=O)(=O)CCCN1CCC[C@@H](CN=[N+]=[N-])C1 1912158547 YBPYXWBZRDUKAC-LBPRGKRZSA-N 288.417 2.222 10 10 CECE C[C@H](C(=O)N1CCCCC1)N(C)CCCN=[N+]=[N-] 1912174982 HBUBUMGMNZMQSU-LLVKDONJSA-N 253.350 2.020 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@H]2CC[C@H]21 1912196862 YWSCLXKYOOEXDX-FOGDFJRCSA-N 252.318 2.008 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(S(=O)(=O)CC2CCCC2)C1 1912161730 MVVNPKCEXCQTNJ-NSHDSACASA-N 272.374 2.139 10 10 CECE COc1ccc(CN2CC[C@@H](OC)[C@@H]2C)c(O)c1 1914342999 DMWZFFZQSQDEIP-IINYFYTJSA-N 251.326 2.010 10 10 CECE CN1CCc2cc(CNCCOCC(F)(F)F)ccc21 108942830 GLTSVWSXLABWOD-UHFFFAOYSA-N 288.313 2.347 10 10 CECE CCNCc1ccc(N2CCC3(COC3)C2)cc1C 1915808864 LXYLRAJSOIICFC-UHFFFAOYSA-N 260.381 2.331 10 10 CECE COC(=O)c1ccccc1C(=O)N(C)Cc1ccccc1O 1445653259 WIKBRZDSGGLOCU-UHFFFAOYSA-N 299.326 2.451 10 10 CECE CCCNCc1ccc(N(C)[C@@H](C)C(=O)NC)c(Cl)c1 1916836309 AOKVILPNSRPVDF-NSHDSACASA-N 297.830 2.410 10 10 CECE O=C(c1cc2cnccc2[nH]1)N1Cc2cccc(O)c2C1 1455038133 ZTJPKKMDHDTOQI-UHFFFAOYSA-N 279.299 2.425 10 10 CECE C/C(=C\c1cccnc1)C(=O)N(C)c1nccnc1C 1611001758 JLZJKDCWGGOBHI-PKNBQFBNSA-N 268.320 2.246 10 10 CECE C[C@@H]1CN[C@H](C)CN(Cc2ccc3c(c2)CCN3C)C1 1921508087 LWZSTCLZTQZRND-ZIAGYGMSSA-N 273.424 2.109 10 10 CECE COc1cc(Cl)cc(CN2CC[C@@H](C)[C@@H]2C(=O)O)c1O 227152064 WHXGMSPXBCIVHY-PRHODGIISA-N 299.754 2.349 10 10 CECE COc1ccc(N(C)CCNC(=O)C2CC2)cc1Cl 1616055487 APYKUBHKKHFKGM-UHFFFAOYSA-N 282.771 2.311 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@@H](N)CC1(C)C 1925255965 FVZVLLYPAWDITB-ONGXEEELSA-N 252.333 2.404 10 10 CECE COc1cc(Cl)cc(CNC[C@@H]2CCC[C@@H]2O)c1O 228675714 AGAGCXADXKPLSI-CABZTGNLSA-N 285.771 2.305 10 10 CECE Cc1cc(C)c(CNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 1629924770 XYRIDYJYBLHJFM-GQCTYLIASA-N 298.342 2.439 10 10 CECE COc1ccc(CNC/C=C\CNC(=O)C(C)C)cc1C 1568817984 OARQIGNCRFZZQX-WAYWQWQTSA-N 290.407 2.422 10 10 CECE COc1ccc(CN[C@@]2(C)CCO[C@H]2C)c(O)c1 230152377 SULGWTHOYIBDOJ-HZMBPMFUSA-N 251.326 2.058 10 10 CECE COc1cc(NCCOc2ccc(N)cc2)ccn1 122544675 QEHGGTZVGCKXRG-UHFFFAOYSA-N 259.309 2.163 10 10 CECE C[C@H](C(=O)NCc1c(O)ccc2ccccc12)N(C)C 1645443587 QBYVFHMWWOBFCR-LLVKDONJSA-N 272.348 2.112 10 10 CECE N[C@@H]1CCC2(CCC2)N(Cc2ccc(F)cc2O)C1 2139771630 CNAPBHLJBJFPHK-CYBMUJFWSA-N 264.344 2.377 10 10 CECE CN(Cc1ccc(F)cc1O)[C@H]1CN(C)C(C)(C)C1 2139790231 KZYMXELVLIGZAO-CYBMUJFWSA-N 266.360 2.446 10 10 CECE CCOC[C@H]1CCCN1c1ccc(CO)c(OC)c1 2139704576 NQCAYMIZMCLHBZ-CQSZACIVSA-N 265.353 2.193 10 10 CECE CCC1CC(=O)N(Cc2cccc(C)c2O)C(=O)C1 2139746624 UZQXRWREARIOEX-UHFFFAOYSA-N 261.321 2.376 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CC[C@H](C(C)(C)N)C1 2139878442 BPXHAECVAFNNNL-MNOVXSKESA-N 264.369 2.218 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@]12C[C@H](CO1)C2 2140285873 RYZPNDNFRFXCFP-VBNZEHGJSA-N 259.349 2.499 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2CC(=O)N(C)C(C)C 162141342 GHFPALGMTRYTTJ-ZDUSSCGKSA-N 289.423 2.196 10 10 CECE CC(C)[C@H](O)CC(=O)NCc1ccc2c(c1)CCCN2C 158281464 OEBLEFDMULOCQD-MRXNPFEDSA-N 290.407 2.092 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2CCO[C@@H]2C)c(O)c1 234967780 IMZLSWPPFPQCRC-TUAOUCFPSA-N 265.353 2.476 10 10 CECE CC[C@H](NC)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 234039290 HBZJWYNXDNGRGD-HIFRSBDPSA-N 275.396 2.059 10 10 CECE C[C@@H]1CCN([C@H](C)c2c(O)cccc2O)[C@@H](CN)C1 235320139 SBTGVPJCNBRQDI-IJLUTSLNSA-N 264.369 2.218 10 10 CECE C[C@@H](Cn1cccn1)N[C@@H](C)c1c(O)cccc1O 235132032 OTZIYUBAODHEFH-QWRGUYRKSA-N 261.325 2.034 10 10 CECE Oc1cccc2c1[C@H](N[C@@H]1COC[C@@H]1C1CC1)CC2 903441168 YJMAWVJKXLDFIG-MGPQQGTHSA-N 259.349 2.394 10 10 CECE C[C@@]1(N)CCCN(Cc2cc(Br)ccc2O)C1 1940606479 SPYXVSAEJRYSOL-CYBMUJFWSA-N 299.212 2.468 10 10 CECE COC1CCC(NCCc2ccc(O)c(O)c2)CC1 1255448528 XBSRROMEXVPJKH-UHFFFAOYSA-N 265.353 2.188 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1C[C@@]12CCCOC2 1896391727 XVYCSOOLZXMTGE-TZMCWYRMSA-N 269.291 2.329 10 10 CECE CC1([C@H](CO)NCc2c(O)cccc2Cl)CC1 1945346223 KUACCMPPTWQXCD-LBPRGKRZSA-N 255.745 2.296 10 10 CECE Nc1ccc(CNC(=O)C2Cc3ccccc3C2)cc1 236375042 ZVWUPKOGUYMTJR-UHFFFAOYSA-N 266.344 2.300 10 10 CECE Oc1cc(Br)ccc1CN[C@@H]1C[C@@H]2OCC[C@@H]21 1946506342 DGDLRTXCCTXJSU-WZRBSPASSA-N 298.180 2.422 10 10 CECE C[C@H](NC(=O)C[C@@H]1CCCCN1)c1ccccc1O 1877588684 XGMZFJYYZJCIJG-RYUDHWBXSA-N 262.353 2.102 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cc(N)c(N)cn1 1877545622 PLZJBHPSCFVFFA-SECBINFHSA-N 258.325 2.149 10 10 CECE Cc1cc(N(C)C[C@]23CCOC[C@@H]2C3)ccc1CN 1880556513 NOJDEUQGSDEEQL-GOEBONIOSA-N 260.381 2.317 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@H]3CCN[C@@H]3C2)c1 2143784100 LNEXBYARICJLJM-YWPYICTPSA-N 276.380 2.146 10 10 CECE Cc1ccc([C@@H](C)NCCCOC(=O)N(C)C)c(O)c1 1964505942 ANAZMEDGJXANRV-GFCCVEGCSA-N 280.368 2.440 10 10 CECE COc1cccc(O)c1CNCC1(F)CCOCC1 1964573494 LDTQITDNTLBHBA-UHFFFAOYSA-N 269.316 2.009 10 10 CECE Nc1ccc(NC(=O)NC23CCC(CC2)OC3)cc1 1885113328 LINZHBDVYAINTL-UHFFFAOYSA-N 261.325 2.102 10 10 CECE FC(F)(F)Oc1ccc(N2CC(C3CNC3)C2)cc1 1886853271 HGQCLPXEXLNKGM-UHFFFAOYSA-N 272.270 2.241 10 10 CECE CN[C@@H](c1ccns1)[C@H](O)c1ccc2c(c1)CCN2C 2147851544 FVSGOCGMAVPDNM-LSDHHAIUSA-N 289.404 2.130 10 10 CECE C[C@H](NCc1ccc2c(c1)CCO2)c1cncn1C 1965946218 HFIYJWQEPCZHAV-NSHDSACASA-N 257.337 2.206 10 10 CECE CC(C)(C)OC(=O)CSCC(=O)Nc1ccc(N)cc1 166758983 GBZVZTCUZHVSCK-UHFFFAOYSA-N 296.392 2.282 10 10 CECE Cc1cccc(CNC[C@H](CO)C(C)(C)C)c1O 1967699583 OIBKBLDKLSEWAI-CYBMUJFWSA-N 251.370 2.445 10 10 CECE Oc1ccc(CCN=c2ccc3c([nH]2)CCC3)cc1O 2148017745 YMADMMCLNBCKFC-UHFFFAOYSA-N 270.332 2.058 10 10 CECE CC(C)(C)n1cc([C@@H](O)[C@H](N)c2ccccc2O)cn1 2148166349 WRXSVICSENHTEY-ZIAGYGMSSA-N 275.352 2.077 10 10 CECE Cc1nn(Cc2ccccc2O)c(C)c1CCCN 258033913 QOWKEBBDOIBBAD-UHFFFAOYSA-N 259.353 2.145 10 10 CECE COc1cc(O)c(O)c(C2(CN)CCCCC2)c1F 258624127 QNMRMFFTCBFSBQ-UHFFFAOYSA-N 269.316 2.406 10 10 CECE C[C@@H](NC(=O)CCOc1ccc(N)cc1)[C@@H]1CCSC1 2146125870 DWNGYDZIGBBWEG-VXGBXAGGSA-N 294.420 2.296 10 10 CECE [N-]=[N+]=NC1CN(C[C@H](O)c2ccc(Br)cc2)C1 2003669878 ADTUOAWHYRMUNA-NSHDSACASA-N 297.156 2.477 10 10 CECE [N-]=[N+]=NC1CN(C[C@@H](O)c2cccc(Br)c2)C1 2003671104 MYDBZPLZVWVEIK-LLVKDONJSA-N 297.156 2.477 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1nnsc1Cl 1984486158 XKQOAISZWNFYPG-LURJTMIESA-N 258.738 2.466 10 10 CECE COC(=O)Cc1sc2c(OC)cccc2c1O 261010819 YGYSKXSTUQVBIB-UHFFFAOYSA-N 252.291 2.331 10 10 CECE Nc1ccc(Oc2nc(Br)cnc2N)cc1 1986745601 XQLYKJJDXLAQCQ-UHFFFAOYSA-N 281.113 2.196 10 10 CECE CN(C1CCCCC1)S(=O)(=O)Nc1ccc(N)cc1 36283861 XGJKZBQFCCJQCO-UHFFFAOYSA-N 283.397 2.190 10 10 CECE COC(=O)[C@@](C)(NCCCN=[N+]=[N-])c1cnccc1C 2159967145 IAFADXVARLPKJK-ZDUSSCGKSA-N 277.328 2.068 10 10 CECE O=C1Nc2cc(N3CCC[C@@H]4CC[C@@H]43)c(F)cc2[C@@H]1O 2151786316 STBUSDLDWWUXLH-XOZVTBISSA-N 276.311 2.190 10 10 CECE C[C@@H](C(=O)O)C1CN([C@H](C)c2ccc(N(C)C)cc2)C1 166037772 JOZNMXBWJUAGAQ-VXGBXAGGSA-N 276.380 2.466 10 10 CECE Cn1c(C2=CC[C@@H](N)C2)nc2cncc(Br)c21 2008250033 VNUKOECITLQPOC-MRVPVSSYSA-N 293.168 2.235 10 10 CECE C[C@H](NC[C@@H]1CCCCN1C)c1ccc(O)cc1O 44561633 OJNHBWOLFCEWOS-RYUDHWBXSA-N 264.369 2.233 10 10 CECE CCn1cc(Br)c(=NCc2ccc(N)cc2)[nH]1 2010550182 OAULXSZHKYBDES-UHFFFAOYSA-N 295.184 2.282 10 10 CECE CNCc1ccc(OC)c(CN2C[C@H](C)O[C@H](C)C2)c1 50124224 SQPDKBXEDNRHPR-BETUJISGSA-N 278.396 2.024 10 10 CECE CC[C@@H]1CN(Cc2cc(CNC)ccc2OC)CCO1 50124828 URNHBYYRMALLTQ-OAHLLOKOSA-N 278.396 2.025 10 10 CECE NCc1ccc(N2CCC3(CCC(O)CC3)C2)cc1F 2156008234 NTEJPKYTHYLVGD-UHFFFAOYSA-N 278.371 2.416 10 10 CECE C[C@@H](NCCc1cncs1)c1c(O)cccc1O 2029981370 YOMQHIWUESQXGI-SECBINFHSA-N 264.350 2.448 10 10 CECE CN(C)c1ccc([C@@H](CC2CC(F)C2)NN)cc1 2031645506 XASXXWUQVWJTMG-MMWSSPAHSA-N 251.349 2.395 10 10 CECE CCNCc1ccc(N2CC[C@@]2(C)CO)c(Cl)c1 2036008796 VUUGMDSMCUGSFI-AWEZNQCLSA-N 268.788 2.411 10 10 CECE C[C@@H]1CCO[C@@H]1CC(=O)N1CCC[C@@H]1CN=[N+]=[N-] 2039571615 ZKLXRMCSQAEXLJ-GMTAPVOTSA-N 252.318 2.103 10 10 CECE C[C@@H]1C[C@H](O)CCN(c2ccc(CO)cc2Cl)C1 2041578795 PFKQXLPXJWVOSJ-ZYHUDNBSSA-N 269.772 2.430 10 10 CECE Nc1ccc(-n2nccc2NC(=O)[C@@]23CC[C@H]2C3)cc1 2157456337 MVSKWRSVIDXBLA-ZUZCIYMTSA-N 268.320 2.193 10 10 CECE Nc1ccc(CN(C2CC2)[C@@H]2CCC(F)(F)[C@@H]2O)cc1 2160109140 PWPDSGPFIGYWQQ-ZIAGYGMSSA-N 282.334 2.392 10 10 CECE Nc1ccc(OCCCSCC(=O)NC2CC2)cc1 311370273 FWJBMVWRPVVNFX-UHFFFAOYSA-N 280.393 2.050 10 10 CECE CN1CCC[C@@H](N(C)[C@@H]2CCc3cccc(O)c32)C1 312065787 FGJQRNPFVBRKEZ-ZIAGYGMSSA-N 260.381 2.406 10 10 CECE CC[C@H](c1ccccc1O)N(C)[C@]1(C(=O)O)CCOC1 313716209 VHJRIEXALGDTAX-IUODEOHRSA-N 279.336 2.019 10 10 CECE CC[C@H](C1CC1)N(C)c1cc2c(cc1N)OCC(=O)N2 324646481 WERHPTQSALSGHS-GFCCVEGCSA-N 275.352 2.225 10 10 CECE Nc1ccc(NC(=O)NCc2cnc(C3CC3)o2)cc1 2160638621 PCGNOGKOMLNKIB-UHFFFAOYSA-N 272.308 2.456 10 10 CECE C[C@@H](C1CCC1)N(C)CC(=O)N(C)c1ccc(N)cc1 325479271 XENMBTOITQVIKB-LBPRGKRZSA-N 275.396 2.352 10 10 CECE COc1cccc(O)c1CN[C@H]1CCC[C@H](C(=O)O)C1 2160700395 ASOFXUVFXWLDOW-QWRGUYRKSA-N 279.336 2.134 10 10 CECE Cc1cccc(O)c1CN[C@H]1CCCN2CCSC[C@@H]12 2160792610 GTLUACJJRMVNQS-GJZGRUSLSA-N 292.448 2.370 10 10 CECE CC(=O)c1c[nH]c(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)c1 701322851 GZCSFVIGRPFINZ-JTQLQIEISA-N 261.285 2.132 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cn3ccccc3n2)C1 701323163 NSPXDOGHADFFRN-JTQLQIEISA-N 270.296 2.249 10 10 CECE CNCc1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)c(C)c1 702401028 PXIVPXSCDXKQBC-WBVHZDCISA-N 273.424 2.102 10 10 CECE CN(C)c1ccc([C@@H](O)c2cn3c(n2)CCCC3)cc1 706126597 UMHWIVHTMBBSPV-MRXNPFEDSA-N 271.364 2.367 10 10 CECE Cc1cc(N2CC[S@](=O)[C@@H](C)C2)ccc1CNC1CC1 2171968717 KKHMDDWGKCCYKR-RBZFPXEDSA-N 292.448 2.204 10 10 CECE COc1ccc(N(C)[C@H]2COC[C@@H]2C(C)C)c(N)c1 688202401 YUZBDAVLRGMNLR-DOMZBBRYSA-N 264.369 2.385 10 10 CECE CCOC[C@H]1CCN(c2ccc([C@H](C)N)c(O)c2)C1 707593715 NKCHNEMQBTWEEO-RYUDHWBXSA-N 264.369 2.275 10 10 CECE c1cn(C2CN(c3ccc(CNC4CC4)cc3)C2)cn1 707679647 MEXSNAQZBXHJRA-UHFFFAOYSA-N 268.364 2.196 10 10 CECE CCNCc1ccc(N2CCNC(=O)C[C@@H]2C)c(Cl)c1 707633176 OUMZHAJHEGWPDS-NSHDSACASA-N 295.814 2.164 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])C1(C)CCC1 686136038 KCFXKOLJXKOGBW-SNVBAGLBSA-N 254.334 2.398 10 10 CECE Cc1cc(Cn2ccc3ccc(CCN)cc32)nn1C 688083105 OFBQGUJKUSVMHO-UHFFFAOYSA-N 268.364 2.233 10 10 CECE C[C@H](CNCc1cccc(F)c1O)[C@@H]1CCCO1 720601928 UMFUDEIZXFBLRT-MFKMUULPSA-N 253.317 2.436 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@]1(O)C[C@@H]2C[C@@H]2C1 2163143723 JIDKZFFCMWCWOP-FSDCSDTHSA-N 272.392 2.100 10 10 CECE C[C@@H](N)[C@@](O)(c1ccc2c(c1)CCCN2C)C(F)(F)F 2163111769 VPUDJAIFYUPOGL-NOZJJQNGSA-N 288.313 2.166 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@H]3COC[C@H]32)cc1O 690329671 PWWWZVMZMBNSOG-LALPHHSUSA-N 276.380 2.288 10 10 CECE COCCNCc1ccc(N2C[C@H]3C[C@@H]3C2)c(C)c1 379557600 KKRFVQQLOPJFFF-HUUCEWRRSA-N 260.381 2.187 10 10 CECE CNCc1ccc(N2C[C@@H]3CSC[C@H]3C2)c(F)c1 711587162 OJQFRHMVRCZMPV-VXGBXAGGSA-N 266.385 2.344 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2CCC[C@H]3CC[C@@H]32)cc1 2172406326 HXNRQQVMGYZRKM-TUKIKUTGSA-N 274.364 2.343 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@H]1CCCSCC1 692388091 CHYKTTLCHRSAEM-LBPRGKRZSA-N 295.404 2.498 10 10 CECE Oc1cccc(CN[C@@H]2CCCSCC2)c1O 692507994 NXSIMLNSURCUNZ-LLVKDONJSA-N 253.367 2.473 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1C[C@@]1(C)C(=O)O 713609684 CUGQPNDUQPYALY-XDMRBOTDSA-N 277.320 2.022 10 10 CECE C[C@H](N)c1ccc(N2CC(CN(C)C)C2)cc1Cl 382325341 COABMCRVULFPTQ-JTQLQIEISA-N 267.804 2.358 10 10 CECE CS[C@H]1CCN(c2ccc([N+](=O)[O-])c(CO)c2)C1 383026323 JISAVWGWWJPPQI-NSHDSACASA-N 268.338 2.029 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@](C)(CO)C2)cc1 694635779 MKRIHZMMRCTEKG-ZENOOKHLSA-N 262.397 2.422 10 10 CECE CNCc1ccc(N2CCO[C@H](C3CC3)C2)cc1C 694831327 KYZRYBCQZXRVFQ-INIZCTEOSA-N 260.381 2.330 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC(O)(C(C)C)C1 384111318 HIAJIQRZXRNKHU-UHFFFAOYSA-N 274.408 2.454 10 10 CECE CC(C)C[C@H]1C[C@H]1NC(=O)COc1ccc(N)cc1 385317317 PRAIPQUSVBIZMC-SMDDNHRTSA-N 262.353 2.198 10 10 CECE C[C@@H]1CCSCCN1C(=O)COc1ccc(N)cc1 385356575 AHDNZAOUHAGJRG-LLVKDONJSA-N 280.393 2.002 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc([C@@H](C)N)cc1F 385662355 MEKJMWIMNCQOOC-SCDSUCTJSA-N 266.360 2.443 10 10 CECE COc1ccc(N2CC[C@@H]2CNC(C)C)cc1F 696300473 TZSNRCQGNFJNNO-GFCCVEGCSA-N 252.333 2.411 10 10 CECE CCNCc1ccc(N2CC[C@@H](CO)[C@H]2C)cc1C 385848911 XGAPPHPVDYXCQK-HIFRSBDPSA-N 262.397 2.312 10 10 CECE CCOC1CC2(C1)C[C@@H]2NCc1ccc(O)c(O)c1 721234388 YLHOKJALTYJJON-WPBUFGDCSA-N 263.337 2.145 10 10 CECE Oc1ccc(CNCc2ncc(Cl)s2)c(O)c1 719411251 FGKGNWDBCFLWAL-UHFFFAOYSA-N 270.741 2.498 10 10 CECE CO[C@@H](C1CC1)[C@H](C)NCc1ccc(O)c(O)c1 388223273 JHHIQQMWCHVCKL-LKFCYVNXSA-N 251.326 2.001 10 10 CECE Oc1ccc(CN[C@H]2CCCC2(F)F)c(O)c1O 398226617 YFTYTFRLTBXALA-VIFPVBQESA-N 259.252 2.081 10 10 CECE NCc1ccc(N2C[C@H]3C[C@@H](O)CC[C@H]3C2)c(F)c1F 398729007 FXHBFJVGDCKQRB-TUAOUCFPSA-N 282.334 2.021 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H](C)C2)cc1O 399103435 GCWCFYZVAHYLCG-NWDGAFQWSA-N 264.369 2.145 10 10 CECE COCC1(C(=O)Nc2ccc(O)c(O)c2)CCCC1 2063013382 YYITYTLMNDTWNY-UHFFFAOYSA-N 265.309 2.243 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)C1(C)CCOCC1 2173990622 BXSLTBFSMMITIZ-CABCVRRESA-N 279.380 2.220 10 10 CECE COC[C@H]1CN(c2ccc([C@H](C)N)cc2)CC(C)(C)O1 2177736254 REKPCXXRMICGFN-SWLSCSKDSA-N 278.396 2.337 10 10 CECE COc1cc(CN(C)c2ccc(CN)c(C)c2)ccn1 2167045235 MTRFIMSNKDYPRK-UHFFFAOYSA-N 271.364 2.494 10 10 CECE COc1cc(Cl)cc(CN2[C@H]3CC[C@H]2[C@@H](CN)C3)c1O 2174294055 OZTDAQMXWFZYHJ-ICCXJUOJSA-N 296.798 2.366 10 10 CECE CC[C@]12C[C@H]1CN([C@@H](CN)c1ccc(N(C)C)cc1)C2 2167531406 HYSIROXWEBKHHZ-BHYGNILZSA-N 273.424 2.484 10 10 CECE NCc1ccc(N2CC[C@](CO)(C(F)(F)F)C2)cc1F 2167667783 OMDGMAGZABBWPQ-LBPRGKRZSA-N 292.276 2.036 10 10 CECE CNCc1cn(-c2ccc(O)c(O)c2)nc1C(C)C 2069849357 JULMWFLDTGYQSQ-UHFFFAOYSA-N 261.325 2.126 10 10 CECE COc1ccc([C@H](C)n2nc(C)cc2CO)c(O)c1 2070067221 HEKXXNXABZZIGT-JTQLQIEISA-N 262.309 2.007 10 10 CECE C[C@@H](c1cc([N+](=O)[O-])ccc1O)n1nc(O)cc1Cl 2070204266 UIZZSADBJVNTGV-LURJTMIESA-N 283.671 2.465 10 10 CECE CCCNCc1ccc(N2CCN(C)[C@@H]3C[C@H]32)cc1C 2168366789 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CCN1CCc2cc([C@H](N)[C@H](O)C(C)(C)C)ccc21 2106856213 WZGMTZHUMBTUOC-GJZGRUSLSA-N 262.397 2.476 10 10 CECE CN1CCCc2cc([C@H](N)[C@]3(C)CCOC3)ccc21 2106824487 ZPLWCVCMTOTWOQ-JKSUJKDBSA-N 260.381 2.495 10 10 CECE CCOC[C@@H](NN)c1ccc(N2CCCCC2)cc1 2106824595 ANROUUPSDMMUQN-OAHLLOKOSA-N 263.385 2.218 10 10 CECE C[C@@](O)(C1CC1)[C@@H](N)c1ccc(N2CCCC2)cc1 2106945775 SLCIOLVZFOEOSS-JKSUJKDBSA-N 260.381 2.448 10 10 CECE CO[C@@H]1CC[C@H]1N(C)c1ccc(C=CC(=O)O)cc1 2087245800 TUASFENLEJPIAA-ZIAGYGMSSA-N 261.321 2.398 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2COCCO2)c(Cl)c1 2087373552 DCPNHXIPTKTCNO-ZYHUDNBSSA-N 285.771 2.245 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H](C)CCCCO 2108747490 XZVRHCOJZVUPPB-JTQLQIEISA-N 266.341 2.018 10 10 CECE CCNCc1ccc(N2CC[C@H](CO)[C@@H](C)C2)cc1 2109027079 GWHZHCZCOLEMIK-DZGCQCFKSA-N 262.397 2.251 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@@]3(COC)C2)c(F)c1 2109178020 SLTBJJZJRLSXCF-WFASDCNBSA-N 264.344 2.018 10 10 CECE Cc1cc2n(n1)CCN(c1ccc(CO)cc1C)C2 2089963550 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10 CECE C[C@@H](c1c(O)cccc1O)N1CCNC[C@@]1(C)C1CC1 2151088112 AIKFAFSSGHKHNQ-ZBEGNZNMSA-N 276.380 2.233 10 10 CECE Cc1c(CN2C[C@H](N)C3(CC3)C2)n(C)c2ccccc12 2152176136 UPDDCIHAGWVTCI-INIZCTEOSA-N 269.392 2.410 10 10 CECE C[C@@]1(F)CCN(CCCC(=O)Nc2ccc(N)cc2)C1 2152318722 BCKFMZCBZLVUCE-OAHLLOKOSA-N 279.359 2.421 10 10 CECE Fc1cc(OC[C@H]2C[C@H](F)C2)ccc1N1CCNCC1 2153181677 KTUXEGNZEZAVJK-HAQNSBGRSA-N 282.334 2.362 10 10 CECE C[C@H](O)c1ccc(N(C)C2(CO)CC2)cc1Cl 2012613416 QZYZINFKLBASBH-VIFPVBQESA-N 255.745 2.354 10 10 CECE C[C@H](O)c1ccc(N2CC3(CC[C@@H]2CO)CC3)cc1O 2154156735 RILHGCMTOZMNRH-WCQYABFASA-N 277.364 2.187 10 10 CECE Cc1nccn1CCN(C)c1ccc([C@@H](C)N)cc1F 2159893652 GCMLZNHPKKVLGS-LLVKDONJSA-N 276.359 2.487 10 10 CECE CC[C@H](C)N1CCN(CCOc2ccc(N)cc2)CC1 55063418 WNEASPOLFDBHPI-AWEZNQCLSA-N 277.412 2.064 10 10 CECE OC[C@H]1CC[C@H](NCc2ccc(F)cc2O)CC1 293744013 XKVWPALDPFDXJA-MJHDQNEOSA-N 253.317 2.172 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@@H]1CCC[C@@H]2C[C@H]21 2155394333 JDNPMXYMVSJBFO-KCPJHIHWSA-N 274.364 2.295 10 10 CECE COc1ccc(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)cn1 2155564026 OANJOOSBQBLGEQ-NSHDSACASA-N 275.312 2.395 10 10 CECE C[C@H]1CN(c2ccc(CN)c(F)c2)[C@@H](C)CCO1 2031632017 GLHLHFLADFZXBL-QWRGUYRKSA-N 252.333 2.288 10 10 CECE C[C@@H](NCCc1nncs1)c1cc(F)ccc1O 2033512747 ZGKDDARVFOEARK-MRVPVSSYSA-N 267.329 2.276 10 10 CECE C[C@H]1CCOC[C@@H]1N(C)Cc1cc(F)ccc1O 2035119836 BXFPDSNMHIYRJV-GWCFXTLKSA-N 253.317 2.388 10 10 CECE COc1ccc(N(C)[C@H](CN)C2(C)CSC2)cc1 2036902334 CSPJSPZTPBRAAU-CYBMUJFWSA-N 266.410 2.212 10 10 CECE Oc1ccc2ccccc2c1CNC[C@@H](O)C1CC1 71299631 XQGJGMXZQGYMMY-MRXNPFEDSA-N 257.333 2.406 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H]3CC[C@H]2N(C)C3)cc1 401678901 XXPJZHPIPFJEHY-DJIMGWMZSA-N 273.424 2.325 10 10 CECE C[C@@H]1CCO[C@H]1CCN(C)C(=O)Cc1ccc(N)cc1 2157290278 JENVWSMHFMTCKE-DOMZBBRYSA-N 276.380 2.085 10 10 CECE CCCNCc1ccc(N(C)CCOCCOC)cc1 313410659 VKRBWWOFJIXSRV-UHFFFAOYSA-N 280.412 2.285 10 10 CECE Cc1ccc(OCCC(=O)NCCN=[N+]=[N-])cc1C 701270418 JOEAUXHEFPVYBK-UHFFFAOYSA-N 262.313 2.499 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)CCc2cccnc2)C1 701300575 BBPCWKNTHUBZDJ-GFCCVEGCSA-N 259.313 2.316 10 10 CECE CCn1cc([C@@H](C)NCc2ccc3c(c2)CCO3)nn1 2160562465 YZXOLSWSYFDDDZ-LLVKDONJSA-N 272.352 2.084 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ccnc(F)c2F)C1 701318168 BUZTYRKJADXJJK-ZETCQYMHSA-N 267.239 2.275 10 10 CECE [N-]=[N+]=NCCCCNC(=O)Cc1cn2ccsc2n1 701302410 ANTJOLCUEZRQAD-UHFFFAOYSA-N 278.341 2.145 10 10 CECE CC[C@H](N)c1ccc(N2CCn3c(C)nnc3C2)cc1 2170359208 TWONTZLQZUXAKE-AWEZNQCLSA-N 271.368 2.017 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1cc([N+](=O)[O-])ccc1F 701305881 LMYFPWBPLZFIOQ-UHFFFAOYSA-N 267.220 2.164 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H](C)CCS(C)(=O)=O)cc1 2160763273 KZLKEZIGYVIEPS-QWHCGFSZSA-N 298.452 2.226 10 10 CECE C[C@@H](NC1CC(N(C)C)C1)c1ccc(F)cc1O 701424904 NVUPCQCJBIKINX-OIKLOGQESA-N 252.333 2.275 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H]2CCCO2)cc1O 251523084 LHRHRQKFRZJOOE-DGCLKSJQSA-N 264.369 2.288 10 10 CECE Cc1cc(N2CC(C)(C)CC[C@H]2CO)ccc1CO 701588090 ZMHVYABJDMZBSD-HNNXBMFYSA-N 263.381 2.475 10 10 CECE CCn1ccnc1CNCc1ccc(F)c(F)c1O 703418025 RKXYRGDRVRKTNS-UHFFFAOYSA-N 267.279 2.177 10 10 CECE O=C(NCCC1(F)CCC1)c1ccc(O)c(O)c1 702470742 FGWPYBCKIPIZSK-UHFFFAOYSA-N 253.273 2.110 10 10 CECE C[C@H]1C[C@]1(C)CN(C)S(=O)(=O)Cc1ccc(N)cc1 704069507 RFNRZHXFIKPWPZ-SMDDNHRTSA-N 282.409 2.077 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@H](C)c2cn(C)cn2)cc1O 710095806 GXOVQBZKCBYSMG-GHMZBOCLSA-N 274.368 2.343 10 10 CECE O=C1CN(c2ccc(CO)c(Cl)c2)[C@H]2CCCC[C@@H]2N1 2171188474 RNTREXNAZZXEET-KBPBESRZSA-N 294.782 2.080 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)C[C@H]2C)c(C)c1 705998426 WRZODULTVBRZGA-UKRRQHHQSA-N 262.397 2.454 10 10 CECE CC1(N)CCN(Cc2c(O)cccc2Br)CC1 706884741 FXRKIJNCZZQCNM-UHFFFAOYSA-N 299.212 2.468 10 10 CECE CN(C)[C@@H]1CCN(Cc2c(O)cccc2Br)C1 707154739 LXUIQKSJQPCCGG-SNVBAGLBSA-N 299.212 2.291 10 10 CECE O=C(O)[C@@H]1CCC[C@@H]1CNCc1cc(F)cc(F)c1O 708215579 KYRZPBINVOZGLY-LDYMZIIASA-N 285.290 2.261 10 10 CECE CC(=O)c1ccc(O)c(CN2[C@@H](C)COC[C@@H]2C)c1 708376019 JDUYFIDSCNSLRI-QWRGUYRKSA-N 263.337 2.204 10 10 CECE Nc1ccc(O)c(CN=c2cc[nH]c3c2CCCC3)c1 708975508 SWVYYDSEKDXWEF-UHFFFAOYSA-N 269.348 2.282 10 10 CECE C[C@@H]1NCCN([C@H](C)c2ccc(F)cc2O)[C@@H]1C 379428404 GESNMBQZRZUROS-HBNTYKKESA-N 252.333 2.275 10 10 CECE Nc1ccc(OCC(=O)NCC2=CCCCC2)cc1 379741633 ONAIVMIEHFYXPQ-UHFFFAOYSA-N 260.337 2.264 10 10 CECE C[C@H]1C[C@H](O)CN1c1ccc(CN)cc1C(F)(F)F 384806310 ZQDSJSQDEUPKTM-WPRPVWTQSA-N 274.286 2.124 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc([C@H](C)N)c(O)c1 385829877 TVBMZUVMHMGSNX-COPLHBTASA-N 264.369 2.009 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCCC12CNC2 2163095576 SXQVHWDBMWJDDI-KRWDZBQOSA-N 272.392 2.248 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](O)C(C)(C)C2)c(F)c1 388165619 UTTNUUZMWDUOFD-CYBMUJFWSA-N 284.350 2.281 10 10 CECE CCOc1ccc(N2CCNCC23CCOCC3)cc1 2179890913 PSYUEZDRICOEJY-UHFFFAOYSA-N 276.380 2.044 10 10 CECE Cc1c(CNCCN2CC=CC2)n(C)c2ccccc12 392781644 OPGOSOWJUZBFGI-UHFFFAOYSA-N 269.392 2.448 10 10 CECE COc1ccc([C@@H](C)N[C@H](C)C(C)(C)O)c(O)c1 393964382 LEHXZLKYRBCOAI-NXEZZACHSA-N 253.342 2.211 10 10 CECE CC(C)OCCc1noc(-c2cccc(O)c2O)n1 395419031 VVRTYFWLGAJPJH-UHFFFAOYSA-N 264.281 2.115 10 10 CECE C[C@H](NC[C@@H]1C[C@H](C)N(C)C1)c1cc(O)ccc1O 396706532 NELCLGLVNXLTIQ-SRVKXCTJSA-N 264.369 2.089 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@@H]2C[C@@H]3C[C@H]3CO2)c1 2179410822 FACSDXZITGMHEP-MNXVOIDGSA-N 277.364 2.476 10 10 CECE Nc1ccc(OCCN2C[C@H](O)CCC23CCC3)cc1 2174537550 LWKKXVMIUQXSLN-CQSZACIVSA-N 276.380 2.027 10 10 CECE C[C@]1(C(F)F)CCN(C(=O)COc2ccc(N)cc2)C1 2174602681 MKPUSBICXNWFCL-AWEZNQCLSA-N 284.306 2.151 10 10 CECE CNCc1ccc(N2CC[C@H]3[C@H]2C(C)(C)[C@@H]3O)c(F)c1 2178166755 ABPKDSRMAIOPER-TUKIKUTGSA-N 278.371 2.141 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@](C)(N)CC(F)F 2175100205 MNSZNOSNXXUZON-YMTOWFKASA-N 286.322 2.284 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cnn[nH]1 2169067148 URAXDTHLJODAJR-LLVKDONJSA-N 271.368 2.038 10 10 CECE Oc1cccc(F)c1CN1CC[C@H](N2CCCC2)C1 1137837349 CCCUJHJQSDQLKS-LBPRGKRZSA-N 264.344 2.201 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NC[C@H]1CCCC12CC2 1648390371 VKXATPIOIGNTBE-GFCCVEGCSA-N 275.348 2.337 10 10 CECE C[C@H](c1ccccc1O)N(C)Cc1ccnc(NN)c1 2192591245 FNNQMDVSBMYDND-LLVKDONJSA-N 272.352 2.266 10 10 CECE C[C@H](c1ccccc1O)N(C)CCOC(C)(C)C(N)=S 2192592522 BTYQPRULVGCTBG-LLVKDONJSA-N 296.436 2.466 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC=C(CC(=O)O)CC1 2181679982 ZNJZRQJFHCXHJF-SNVBAGLBSA-N 277.320 2.266 10 10 CECE C[C@@H](NC(=O)[C@@]12CC[C@@H](C[C@@H]1N)C2)c1ccccc1O 2192621940 IHMGZOAQPRWTPA-PSHZPRKYSA-N 274.364 2.087 10 10 CECE C[C@@H](NC(=O)C=Cc1ccnn1C)c1ccccc1O 2192611729 RTFYXKITXRAVJT-LLVKDONJSA-N 271.320 2.016 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]4CC[C@H]4C3)ccc21 2188536378 QLEOBGXKFWVTAI-PGUXBMHVSA-N 271.364 2.136 10 10 CECE CN1CCCc2cc([C@H](O)CC3[C@H]4COC[C@H]34)ccc21 2188903795 FJWSODVIUKDPEW-BFYDXBDKSA-N 273.376 2.385 10 10 CECE O=C(NC1[C@H]2CCCCC[C@H]12)c1cc(O)c(O)c(O)c1 2188911802 FVNCRPBQNDEPMC-UWVGGRQHSA-N 277.320 2.112 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2ncno2)c(Cl)c1 2042284691 UFYQBIOBRPAIQK-MRVPVSSYSA-N 266.732 2.379 10 10 CECE CC(C)CO[C@H](C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1 2046888225 DJXYGHXGLYXIFQ-MNOVXSKESA-N 254.334 2.349 10 10 CECE C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2c1ccc2c(c1)CC[C@H]2O 2184740709 YIACBRJNADHBMG-GHYDKEGDSA-N 273.376 2.404 10 10 CECE N[C@H]1CCc2cc(N3CCO[C@@H](C(F)F)CC3)ccc21 2184739469 HPTUGUQSWRWKFZ-UONOGXRCSA-N 282.334 2.493 10 10 CECE CN[C@@H]1CCc2cc(N3CCN(C(C)C)CC3)ccc21 2184710677 IFTRVSHJZHSUIT-QGZVFWFLSA-N 273.424 2.424 10 10 CECE CN[C@@H]1CCc2cc(N3CCC[C@H](C)[C@H]3CO)ccc21 2184727107 NSPKBPKQDYIJAP-JCURWCKSSA-N 274.408 2.491 10 10 CECE C[C@@H](O)c1ccc(N2CC([C@H](F)CO)C2)c(Cl)c1 2048029934 NBJCUKKDACZIED-PRHODGIISA-N 273.735 2.160 10 10 CECE C[C@@H]1C[C@@H](CNCc2ccc3c(c2)CCN3C)CO1 2101853752 LBTHAJWTRSDBKB-OCCSQVGLSA-N 260.381 2.194 10 10 CECE FC(F)(F)Cn1ccnc1C=C1C[C@@H]2NCC[C@@H]12 2050591411 XVRCAIILJQYEOU-UWVGGRQHSA-N 257.259 2.211 10 10 CECE Nc1ccc(OCCN2CCCC[C@@H]2CF)cc1 2051806402 DJSLMCBZVMJJBP-CYBMUJFWSA-N 252.333 2.472 10 10 CECE CC[C@@H](Nc1c(N)cccc1C(N)=O)C(F)(F)F 2053754885 MSEATNZMECWVOW-MRVPVSSYSA-N 261.247 2.121 10 10 CECE [N-]=[N+]=NCCCCN1CC[C@H](C(F)(F)F)[C@H](N)C1 2054252329 DMKBTYJLWPVOEG-DTWKUNHWSA-N 265.283 2.288 10 10 CECE [N-]=[N+]=NCCCN1CCC([C@H]2CCCNC2)CC1 2054250299 GMZRDLIIYJLSSL-ZDUSSCGKSA-N 251.378 2.398 10 10 CECE Nc1ccc(CCOCCS[C@H]2CCOC2)cc1 2056189050 GEYNIDKHCGZNTD-AWEZNQCLSA-N 267.394 2.350 10 10 CECE C[C@H](N)c1ccc(N2CC=CC[C@@H]2CO)c(Cl)c1 2056283845 UGGGYQPMSCXFHL-CMPLNLGQSA-N 266.772 2.487 10 10 CECE CCC[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)CO1 2185632564 NDUDLTLLPXWOHZ-NWDGAFQWSA-N 279.336 2.168 10 10 CECE CCC[C@@H](CO)CN[C@@H](C)c1cc(O)ccc1O 2057123034 PHZOOHRDLGLYMR-WDEREUQCSA-N 253.342 2.157 10 10 CECE Cc1cc(N(C)[C@H]2COCC2(F)F)ccc1C[C@@H](C)N 2197017143 OXDADSBRZSJAQP-RISCZKNCSA-N 284.350 2.355 10 10 CECE CC1(C)CCOCCN1c1ccc(CN)c(F)c1 2062058527 MULSBRQBZAKCMA-UHFFFAOYSA-N 252.333 2.290 10 10 CECE 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CC[C@H](N[C@H]1CCc2cccc(O)c21)[C@H](O)C(F)F 296493883 OTRCHNQAGJIQCN-KWBADKCTSA-N 271.307 2.374 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@H](O)c1cnsc1 2163242916 NDYASKMCJUIZGC-HUUCEWRRSA-N 289.404 2.477 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCC(=O)NC2(C)C)c1 802313746 OAAJTYHRDYSKEA-HZMBPMFUSA-N 292.379 2.109 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1scnc1OC 2164138819 WJSWUWSXPNJOHS-CYBMUJFWSA-N 289.404 2.453 10 10 CECE CCOc1ccc(O)c(CN2CCC[C@@H](C)[C@@H]2C(=O)O)c1 818631498 HAGHLWFKABQAND-IAQYHMDHSA-N 293.363 2.476 10 10 CECE CC1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CCC1 819167389 BTZVRKKJGIZYFK-UHFFFAOYSA-N 288.347 2.347 10 10 CECE CN(Cc1ccc(C(=O)O)o1)Cc1ccc(O)cc1O 724888196 IDDRWQOJEATASZ-UHFFFAOYSA-N 277.276 2.021 10 10 CECE COC(=O)[C@]1(N=[N+]=[N-])Cc2ccc(Cl)cc2C1=O 725383627 OGXJJBWAWUXGTG-NSHDSACASA-N 265.656 2.301 10 10 CECE CCC[C@H](c1cc(F)ccc1O)N1CCNCC1 575266700 NNRRCFKCZOGULE-CYBMUJFWSA-N 252.333 2.278 10 10 CECE COC(=O)[C@@](C)(CCF)NCc1cc(Cl)ccc1O 827352182 ARNPOCPFFSIRJI-CYBMUJFWSA-N 289.734 2.427 10 10 CECE C[C@H]1C[C@@H](CNCc2cccc(O)c2O)C[C@@H](C)O1 724300804 NSZHXYCQLQMJQU-GDNZZTSVSA-N 265.353 2.391 10 10 CECE CC[C@@](C)(CO)NC(=O)c1cc2cc(O)c(O)cc2s1 901225570 TVRFXYTZCLLNSV-AWEZNQCLSA-N 295.360 2.203 10 10 CECE CN(C)c1ccc(/C=C/CNC2(CC(=O)O)CC2)cc1 901478019 RTYCMXXOQFFTJV-ONEGZZNKSA-N 274.364 2.363 10 10 CECE Cc1cc(O)c(CNC[C@H](N)C2CC2)c(Cl)c1 841049957 CZVGTKLVPYJDAR-LBPRGKRZSA-N 254.761 2.181 10 10 CECE Nc1ccc(Cc2noc([C@H]3CCc4c[nH]nc4C3)n2)cc1 843158492 DORGKYJBQSVYEH-NSHDSACASA-N 295.346 2.238 10 10 CECE CCNC(=O)CN(CC)Cc1c(O)cc(C)cc1Cl 840909595 JUZWDBKKMFEJPC-UHFFFAOYSA-N 284.787 2.312 10 10 CECE CCO[C@H](COC(=O)c1ccc(C)c(O)c1O)C1CC1 859534055 AHQGJQKYKLTBDM-GFCCVEGCSA-N 280.320 2.378 10 10 CECE C[C@@H](NC[C@H]1CNCCC1(F)F)c1ccc(F)cc1O 925781690 JLSKVYDHOKCDSR-NXEZZACHSA-N 288.313 2.427 10 10 CECE CCN(C)c1ccc([C@@H](C)N[C@@H](C)C(=O)N(C)OC)cc1 858578124 GZXYKJPDAQGPLM-OLZOCXBDSA-N 293.411 2.202 10 10 CECE COc1cccc([C@H](C)N[C@@H]2C[C@H](O)C23CCC3)c1O 850545423 GVUHBEIPPMYDOV-GDLCADMTSA-N 277.364 2.355 10 10 CECE Cc1nnc(C[C@@H](O)c2ccc3c(c2)CCN3C)s1 698621513 JUVVKUJJCVIGTG-CYBMUJFWSA-N 275.377 2.115 10 10 CECE Cc1ccc(C(=O)N2CCO[C@@](C)(C3CC3)C2)c(O)c1O 855295302 KPXZPIKFENHOCK-MRXNPFEDSA-N 291.347 2.047 10 10 CECE Cc1cccc(O)c1CN1CCC(C(=O)N(C)C)CC1 876541772 DRXTWSHGRYTPIB-UHFFFAOYSA-N 276.380 2.001 10 10 CECE CCOC(=O)[C@@H]1C[C@H]1CN[C@H](C)c1cc(OC)ccc1O 930216616 LZCDVXOULFARCP-UHIISALHSA-N 293.363 2.251 10 10 CECE CC(C)N[C@H]1CCCN(c2ccc3c(c2)OCO3)C1 71198615 HPKRWMARTNZHOJ-LBPRGKRZSA-N 262.353 2.382 10 10 CECE CN1C[C@@H]2CCN(Cc3cc(F)c(N(C)C)cc3F)[C@H]2C1 862375083 WTUYTEKADLLUKK-ZBEGNZNMSA-N 295.377 2.167 10 10 CECE CC1(C)CC[C@@H](CNC(=O)NCc2ccccc2O)O1 777742870 UGNRPIZONMCLGL-LBPRGKRZSA-N 278.352 2.149 10 10 CECE COc1cc(C)cc(CN2CCOCC[C@@H]2C)c1O 774660195 PBISFTHMYXOXON-LBPRGKRZSA-N 265.353 2.320 10 10 CECE COc1ccc(O)c(CNC(=O)c2nc(Cl)cs2)c1 789997078 ZFIXKSNEXNWLAP-UHFFFAOYSA-N 298.751 2.441 10 10 CECE C[C@H](N[C@@H]1[C@@H]2CCN[C@@H]2C1(C)C)c1ccccc1O 1877588073 VUGNGJLZYWZRIM-MMMKDXCPSA-N 260.381 2.429 10 10 CECE CC[C@@H](NCC(=O)O)c1cc(Br)ccc1O 36723057 YSGZOTFYQGRGFS-SECBINFHSA-N 288.141 2.280 10 10 CECE CN1CCc2cc([C@H](N)[C@@]34CCOC[C@H]3C4)ccc21 1880260726 GDDZKVRAWYZTCX-VNQPRFMTSA-N 258.365 2.105 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](O)C(C)(C)C2)c(F)c1 1880480329 VGYGULNHHGEQLY-QPUJVOFHSA-N 271.307 2.225 10 10 CECE CO[C@]1(CNCc2c(C)cccc2O)CCSC1 896573244 LKRFHGSEVSXJLD-AWEZNQCLSA-N 267.394 2.312 10 10 CECE COc1ccc(O)c([C@H](C)NC2CC(CCO)C2)c1 898010570 LVZCHZQRSKXRPP-UNXYVOJBSA-N 265.353 2.212 10 10 CECE Oc1cc(F)ccc1CN[C@H]1CCN2CCC[C@H]2C1 1964544736 LBASIUZHZFKLGA-KBPBESRZSA-N 264.344 2.248 10 10 CECE CO[C@H]1CCN(Cc2ccc(F)cc2O)C[C@H]1C 1964598388 UKYSZETTWRKDQT-YGRLFVJLSA-N 253.317 2.388 10 10 CECE CN(c1cc(Cl)c(CN)cc1F)[C@@H]1COCC1(F)F 1888226319 GREHWXFIGYTQOP-LLVKDONJSA-N 294.704 2.408 10 10 CECE CC[C@@]1(c2ccc(OC)cc2O)CO[C@H](C)CN1 83385128 CZDQWDHKTDFTAB-YGRLFVJLSA-N 251.326 2.014 10 10 CECE Cc1ccc([C@@H]2NCCc3cc(O)c(O)cc32)cn1 83724830 XRASQGHVYPSNCR-HNNXBMFYSA-N 256.305 2.036 10 10 CECE CN[C@@H]1CN(C(C)C)c2cc(OC)c(OC)cc21 84797905 MOAXRFWWWYURPE-LLVKDONJSA-N 250.342 2.193 10 10 CECE COc1cc2c(cc1OC)N(C)C[C@@H]2NC(C)C 84797907 GLGHDKRNERSEQN-NSHDSACASA-N 250.342 2.193 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](C(C)(C)O)C2)c(F)c1 721834025 REOPJPHDNBLCTQ-LLVKDONJSA-N 284.350 2.281 10 10 CECE CCOC(=O)CCCN[C@@H](C)c1ccc(OC)cc1O 81545181 PMSAVHGVNTZGKC-NSHDSACASA-N 281.352 2.395 10 10 CECE C[C@H]1COC[C@@H](C)N1Cc1ccc(F)c(F)c1O 703539415 BJXCZABQTGPTMF-DTORHVGOSA-N 257.280 2.280 10 10 CECE N[C@@]12CCC[C@H]1CN(c1ccc3c(c1)CCCO3)C2 1893670707 NWRCYKZXLJXUEB-XJKSGUPXSA-N 258.365 2.329 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@H]2CCC[C@@H]2O)cc1O 689849767 VIJUTACXFBZKHE-WDMOLILDSA-N 264.369 2.009 10 10 CECE C[C@@]12CCCC[C@@H]1CN2S(=O)(=O)Cc1ccc(N)cc1 706439575 ZGUAMYWVHKICRF-UKRRQHHQSA-N 294.420 2.363 10 10 CECE CSC[C@H]1CCN(CCOc2ccc(N)cc2)C1 706675690 UNQZUUAGPGPBBN-LBPRGKRZSA-N 266.410 2.333 10 10 CECE CC[C@H](N)c1ccc(N2C[C@@H]3CN(C)C[C@H]3C2)cc1 706997541 YCTPUYVCARTIIL-DZKIICNBSA-N 259.397 2.094 10 10 CECE C[C@H]1CN(C)CCN([C@@H](C)c2cc(F)ccc2O)C1 707527632 BFHXWFIDFKATEQ-RYUDHWBXSA-N 266.360 2.476 10 10 CECE CC[C@H](N)c1ccc(N(C)C[C@H](COC)OC)cc1 691258248 XQROROPCROECOP-CABCVRRESA-N 266.385 2.194 10 10 CECE C[C@@H]1CN([C@H](C)c2ccccc2O)C[C@@]1(C)C(=O)O 710264918 FOFDHODNLHKUCG-UEKVPHQBSA-N 263.337 2.496 10 10 CECE COC[C@H](CN(C)Cc1cc(Cl)ccc1O)OC 691300047 MWCHOAWITQXYFB-LBPRGKRZSA-N 273.760 2.139 10 10 CECE Nc1ccc(CCC(=O)N2C[C@@H]3CSC[C@H]3C2)cc1 711647747 KNUVRVBCKUOCDE-CHWSQXEVSA-N 276.405 2.023 10 10 CECE Cc1ccc(CCNC(=O)c2c(F)ccc(O)c2O)o1 1182354133 MXUQICXESNKDGH-UHFFFAOYSA-N 279.267 2.111 10 10 CECE C[C@H](O)c1ccc(N(CCO)CC2CC2)c(F)c1 688376436 DMIXKAGCUTVTLK-JTQLQIEISA-N 253.317 2.088 10 10 CECE COc1ccc(N2CCCC[C@@H]2[C@@H](C)O)c(N)c1 688617047 DVKARVBULLOYPD-ZWNOBZJWSA-N 250.342 2.017 10 10 CECE CN(C[C@H]1CCSC1)C(=O)Nc1ccc(N)cc1 718324490 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CCc1cc(CN(C)c2ccc(CO)c(C)c2)n(C)n1 2192433705 SHYLFMPAYNPEAK-UHFFFAOYSA-N 273.380 2.420 10 10 CECE C[C@@H](CC(=O)NCCc1ccc(O)c(O)c1)P(C)(C)=O 2196556843 HBPJZRXLBQSCPE-JTQLQIEISA-N 299.307 2.158 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CCOC[C@H]2F)cc1 2066653705 UGUYZQDSYGUJCL-ZLKJLUDKSA-N 253.317 2.303 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)C12CC(CCN1)C2 2192528053 NRRJISZBGVXYEB-FZWSLVFFSA-N 274.364 2.054 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@H]1[C@@H]2C[C@@H]3[C@@H]1NC[C@@H]3C2 2192603758 GHPYRTKTRFJJIW-NSBDPXMGSA-N 272.392 2.381 10 10 CECE C[C@H](Nc1cc(C(N)=O)ccc1N)c1ccccc1O 2192623554 CHSHVMPLFVNYQN-VIFPVBQESA-N 271.320 2.246 10 10 CECE C[C@H](c1ccc(F)cc1O)N(C)CC1COCCOC1 2188037567 ZFHQGHDCVSUNLA-LLVKDONJSA-N 283.343 2.187 10 10 CECE C[C@@H](CC(=O)NCc1ccc(N)cc1)P(C)(C)=O 2075778433 PBQLCIYUEGKHMZ-JTQLQIEISA-N 268.297 2.286 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@@]3(N)C2)c(F)c1 2077384131 ZJAKVUNGLRJBRS-IINYFYTJSA-N 250.317 2.152 10 10 CECE COc1ccc(N2C[C@H](N)C(C)(C)C2)c(F)c1F 2081868042 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CN(C)c1ccc([C@](C)(N)c2ncc(Cl)n2C)cc1 2109878506 OFVBHZRSJAKYPN-AWEZNQCLSA-N 278.787 2.362 10 10 CECE CCOc1ccc([C@@H](NN)c2ccccc2O)cc1 2090043295 SYVORNDRMMJFBV-OAHLLOKOSA-N 258.321 2.344 10 10 CECE CCN[C@H]1CCN(Cc2cc(Cl)cc(OC)c2O)C1 2090489941 VPHYRFRYENDUOR-LBPRGKRZSA-N 284.787 2.238 10 10 CECE Oc1ccc(CNCC(F)(F)CC2CC2)c(O)c1O 2093932840 BMFKNHGJUDIUBI-UHFFFAOYSA-N 273.279 2.328 10 10 CECE Cc1cc(CO)ccc1N1C[C@@H]2CCC[C@@H](O)[C@H]2C1 2094594580 LMRMHUGROSLEAL-OFQRWUPVSA-N 261.365 2.085 10 10 CECE CCCCN(CC(=O)O)[C@@H](C)c1ccc(O)cc1O 2095213675 VKCODJAVCHTLLG-JTQLQIEISA-N 267.325 2.346 10 10 CECE CCCNCc1ccc(N2CC(CCO)C2)cc1C 2095990875 LQRNZOHGTOSNGZ-UHFFFAOYSA-N 262.397 2.313 10 10 CECE CN(C)c1ccc([C@](C)(N)c2cnc(Cl)n2C)cc1 2098426167 XNEHBVLBTMBTLM-AWEZNQCLSA-N 278.787 2.362 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H](C(=O)O)C12CC2 2201102797 USDNSOWAZYAVPI-NXEZZACHSA-N 277.320 2.098 10 10 CECE CN(C)c1ccc([C@H](O)C(=O)[C@H]2CCC[C@H]2F)cc1 2118906334 UFZCQNGTCAUHIM-MJBXVCDLSA-N 265.328 2.493 10 10 CECE CCCNCc1ccc(N(C)C2CC(O)C2)cc1OC 2204538296 XEMMYGXWXBYUMJ-UHFFFAOYSA-N 278.396 2.154 10 10 CECE Cc1cccc(CNC(=O)[C@H]2CCCCC[C@H]2N)c1O 2204612089 UINVTDHDSLUZFC-UONOGXRCSA-N 276.380 2.224 10 10 CECE NCc1ccc(N2CCC(C3(O)CCC3)CC2)cc1F 2205166614 GLFVALDCRBWLCS-UHFFFAOYSA-N 278.371 2.416 10 10 CECE NCc1cc(F)c(N2[C@H](CO)CCC23CCC3)c(F)c1 2205680940 CRZJTMHUAFGHRJ-NSHDSACASA-N 282.334 2.307 10 10 CECE COCCC1(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])CC1 2218744872 NUWMNQHHOQXRHA-UWVGGRQHSA-N 252.318 2.151 10 10 CECE COc1ccc(N2CCSC[C@H]2CCO)cc1F 2219608588 NOIXAIZCYSZBMD-LLVKDONJSA-N 271.357 2.139 10 10 CECE CN(C)c1ccc(OC[C@@H](CN)C(F)(F)F)cc1 2221881101 XMLWTECHXKOJRJ-SECBINFHSA-N 262.275 2.269 10 10 CECE CCN[C@H](C)c1ccc(N2CC=C[C@@H]2CO)c(C)c1 2232104496 LFSILMQSQJZFJY-UKRRQHHQSA-N 260.381 2.403 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H](C)[C@@](C)(CO)C1 2232102245 IVWOWIANAAKTJZ-XJKCOSOUSA-N 262.397 2.469 10 10 CECE Cc1cn2cc[nH]c(=N[C@H](C)c3ccccc3O)c2n1 2232763844 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281.327 2.351 10 10 CECE OC[C@@H](F)C1CN(c2ccc(OC(F)(F)F)cc2)C1 2226542506 WLUIYFRJBZYYAE-LLVKDONJSA-N 279.233 2.352 10 10 CECE CCN1CCc2cc(N3CCCC[C@@H](O)C3)ccc21 2226653908 FDFFDBUJKRMWJR-OAHLLOKOSA-N 260.381 2.420 10 10 CECE CC1(C)CN(c2ccc3c(c2)OC(F)(F)O3)[C@@H]1CO 2226701966 WZTCLMZYFAYQMS-LLVKDONJSA-N 271.263 2.215 10 10 CECE COc1ccc(N2C[C@]3(C)C[C@]3(CO)C2)c(F)c1F 2226928621 DHQCFYSNGXBLCR-UONOGXRCSA-N 269.291 2.182 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@@H]2F)c(C[C@@H](C)N)c1 2227685770 KHPQJJXPGZTICX-OSMZGAPFSA-N 266.360 2.379 10 10 CECE CO[C@H]1CC[C@@H]1CN(C)c1ccc(CN)c(F)c1F 2227823985 BNCRSLUPRUPMPO-PWSUYJOCSA-N 270.323 2.285 10 10 CECE CN(C)[C@@H]1CN(c2ccc(CO)c(Cl)c2)CC12CC2 2228106355 URXNCMBCZXTBTO-CQSZACIVSA-N 280.799 2.363 10 10 CECE COc1cccc(CNC[C@H](F)C2CCOCC2)c1O 2238294860 QDCKFXSBYRTUEM-ZDUSSCGKSA-N 283.343 2.255 10 10 CECE CN[C@@H](C)c1ccc(N(C)C[C@]2(F)CCOC2)cc1O 2238285176 PYQNSNNCJFYETI-XHDPSFHLSA-N 282.359 2.237 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H](F)[C@H]2CCOC2)cc1O 2238336538 LUCQEBQBMXPFFJ-COPLHBTASA-N 282.359 2.223 10 10 CECE Nc1ccc(OC[C@@H](O)COCCCCC(F)F)cc1 2238401767 SOVIOLRDOPXVQY-LBPRGKRZSA-N 289.322 2.461 10 10 CECE CC[C@@H](C)NCc1ccc(N2C[C@@H]3[C@H](CO)[C@@H]3C2)cc1 2240043614 LMOHEFUWSQDESC-VDNDLQMASA-N 274.408 2.249 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCC(F)(F)[C@H](CO)C1 2240757530 HUWACRRADLDANU-AAEUAGOBSA-N 284.350 2.469 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@H](C)S(=O)(=O)[C@@H](C)C1 2240834717 CNYTVQAXMHUNPE-RWMBFGLXSA-N 297.420 2.060 10 10 CECE CCS(=O)(=O)CCN(C)c1ccc([C@H](C)NC)cc1C 2240835596 JZCMEBFRBLCZTQ-ZDUSSCGKSA-N 298.452 2.146 10 10 CECE Cc1cc(N2CCC(CC(N)=O)CC2)ccc1[C@H](C)N 2285145292 BUVADNDSJJKYTH-LBPRGKRZSA-N 275.396 2.107 10 10 CECE CSc1ncc(CNCC2CC3(CCNC3)C2)s1 2257123620 YBCZAIGPRAPKLE-UHFFFAOYSA-N 283.466 2.344 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1C[C@H]2CO[C@H]1C2 2249622101 RRXAEZKLZLPJPQ-WLTAIBSBSA-N 253.729 2.313 10 10 CECE C[C@H](O)CN(CC(C)(C)C)c1ccc(CO)cc1 2259766865 ACTWEKMKRNGAPP-LBPRGKRZSA-N 251.370 2.412 10 10 CECE Nc1ccc(OCCS(=O)(=O)CCC2CCC2)cc1 2270168346 PEWQYPWKQPREMN-UHFFFAOYSA-N 283.393 2.253 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cnc(C(F)(F)F)s2)C1 2260728233 ZORLEYRVAHLTAD-UHFFFAOYSA-N 277.231 2.297 10 10 CECE FCOc1ccc(N2CCC[C@H]3CNC[C@H]32)cc1 2263909456 UJWOFVYAVRCHIR-SMDDNHRTSA-N 250.317 2.181 10 10 CECE COc1ccc(O)c(CNCC2(OC)CC(CF)C2)c1 2290431463 XBINBTAKGMHYDD-UHFFFAOYSA-N 283.343 2.255 10 10 CECE N[C@@H]1CC[C@H]2CN(c3ccc(OC(F)F)cc3)C[C@H]12 2278500286 SIBOFBDPHLCALM-TVYUQYBPSA-N 268.307 2.462 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC(F)(F)C[C@@H]1CN 2278907285 OAYPFDHKAULSEG-PSASIEDQSA-N 274.286 2.261 10 10 CECE C[C@@H]1CC[C@@H](S(C)(=O)=O)CN1[C@H](C)c1ccccc1O 2279350734 GCXFHEZIZXJRIL-JHJVBQTASA-N 297.420 2.351 10 10 CECE Cc1cc(N2CC[C@H]3COC[C@@H]3C2)ccc1[C@H](C)N 2269661154 CUWWIWWBSSSUQF-IHRRRGAJSA-N 260.381 2.487 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H]3CN[C@H](C)C3)ccc21 2285616091 KVMXMNGSTBGEBC-PBFPGSCMSA-N 274.408 2.491 10 10 CECE O[C@H](C[C@H]1C[C@H](F)C1)c1ccc(N2CCNCC2)cc1 2286071256 KTNJGUFBVIDQJU-XNRPHZJLSA-N 278.371 2.268 10 10 CECE C[C@H]1CN(Cc2ccc(N3CCNCC3)cc2)CCS1 2286066887 ZYTOOSJFHAPCIL-AWEZNQCLSA-N 291.464 2.034 10 10 CECE C[C@@H]1CCN[C@@H]1CSCCC(=O)Nc1ccc(N)cc1 2288848808 ISIDMCVTIUKCKG-BXUZGUMPSA-N 293.436 2.329 10 10 CECE O=C(/C=C/c1cnccn1)N1CCc2cc(F)c(F)cc21 491151959 PLOWUNPQMFQGOA-OWOJBTEDSA-N 287.269 2.357 10 10 CECE Cc1ccc(CN2CCC[C@H]2CN)c(O)c1Br 2307476357 AFVWBWSAEKEAPF-NSHDSACASA-N 299.212 2.386 10 10 CECE Nc1ccc(N2CCC[C@H](O)[C@H]2C(F)(F)F)cc1 2320964236 BCHJNIYAEZZKOE-QWRGUYRKSA-N 260.259 2.161 10 10 CECE CO[C@@H]1CC[C@H]1N(C)c1ccc(CN)c(SC)c1 2328543939 YJBMZOUMTZMVTG-CHWSQXEVSA-N 266.410 2.481 10 10 CECE CN(C)c1ccc([C@@](C)(N)[C@H]2C[C@@H]3CCO[C@@H]32)cc1 2333169395 ULCWGJGJTJVDJZ-VCOSZWKGSA-N 260.381 2.352 10 10 CECE C[C@@H]([C@H]1C[C@@H]2CCO[C@@H]21)N(C)c1ccc(CO)cc1 2333151934 AMDKGUOIUVWUNF-YUDUHTQSSA-N 261.365 2.429 10 10 CECE CC(C)(O)C1CN(c2ccc(CN)c(C3CC3)c2)C1 2339163486 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PGLJVFXAJUZDKN-VYDXJSESSA-N 274.408 2.454 10 10 CECE CCN(C)S(=O)(=O)Nc1ccc(O)c(C(F)(F)F)c1 1970802960 TWRGKKSDOVFXBY-UHFFFAOYSA-N 298.286 2.019 10 10 CECE OC[C@@H](NCc1cc(F)cc(F)c1O)[C@@H]1CC=CCC1 1971213489 YGQFOCZRALZHOA-QMTHXVAHSA-N 283.318 2.477 10 10 CECE Cc1cc(N2CC3(CN(C)C3)C2)ccc1CNC(C)C 2152275974 YDGIUBFJTGNHMZ-UHFFFAOYSA-N 273.424 2.245 10 10 CECE CC1(C)CCN(c2c(F)cc(CN)cc2F)C[C@@H]1CO 2148680779 FVPDIHMHSWIMBB-LLVKDONJSA-N 284.350 2.268 10 10 CECE Nc1ccc(OCCCN2CC[C@@H]3COCC[C@H]32)cc1 2145009318 RVVBNSKKDUAVDT-CZUORRHYSA-N 276.380 2.149 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@]3(CCCO3)C2)cc1O 2145051653 WNVSNVZTTLDLCN-WBMJQRKESA-N 276.380 2.432 10 10 CECE CN1C[C@@H](CN)C[C@@H]1c1c(O)ccc2c1CCCC2 258493998 VUJWZBIVWTVNHL-BXUZGUMPSA-N 260.381 2.223 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@H]1CCCOCC1 2145314318 NSZYMEGLRRKIDI-CQSZACIVSA-N 276.380 2.434 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H](OC(=O)N(C)C)C2)cc1 2146486402 DTSVADMWLKHBCC-SMDDNHRTSA-N 278.352 2.017 10 10 CECE CN(C)S(=O)(=O)c1ccccc1Oc1ccc(N)cc1 38056434 BLAVYYLKGDQUMV-UHFFFAOYSA-N 292.360 2.311 10 10 CECE CN[C@@H](C)c1ccc(N(C)Cc2nnc(C)n2C)cc1 2146916071 BYISQIOMKSZNOA-NSHDSACASA-N 273.384 2.040 10 10 CECE C[C@H](NCc1c(O)cccc1F)c1csnn1 1997950458 GYWFEVPHNFHHHK-ZETCQYMHSA-N 253.302 2.234 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@H]2CCC[C@@H]2C2CC2)cc1 2150072590 OKKASJXQDMXSNS-CABCVRRESA-N 294.420 2.267 10 10 CECE Nc1ccc(OCCC(=O)NC[C@@H]2[C@H]3CCC[C@H]32)cc1 2150109039 NECSAFGROFSDED-FICVDOATSA-N 274.364 2.200 10 10 CECE N=C(CCCCNCc1ccc2c(c1)CCCO2)NO 2160559064 GOQXMGGJHLAKBO-UHFFFAOYSA-N 277.368 2.228 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CCCCO1 50964145 PGJYQHCRFOREHM-SMDDNHRTSA-N 263.337 2.481 10 10 CECE NC(=O)CN1C(=O)SC(=Cc2ccccc2)C1=S 2026926120 NKCWNKKOPNMVFT-UHFFFAOYSA-N 278.358 2.009 10 10 CECE Cc1nnsc1[C@@H](C)NCCc1ccc(N)cc1 2028690636 WUMXGSANESGNBQ-SECBINFHSA-N 262.382 2.322 10 10 CECE CCOC1([C@@H](NN)c2ccccc2O)CCCC1 2029545570 VKEWSCSZQJZLLF-ZDUSSCGKSA-N 250.342 2.246 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3C(CO)[C@@H]3C2)c(Cl)c1 2030274888 JNGADPZVWGLDGE-FBIMIBRVSA-N 266.772 2.034 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@H]2[C@@H](CO)C3)cc1O 2157232536 WODSIHWLGJGZES-FJJYHAOUSA-N 276.380 2.022 10 10 CECE C[C@]12CCO[C@H]1[C@H](NCc1cc(F)ccc1O)C2 2036585771 DMLBPENPUKNCLK-KWCYVHTRSA-N 251.301 2.188 10 10 CECE Cc1cc(NS(=O)(=O)[C@@H]2CCCC[C@H]2O)c(C)cc1O 2157741637 TUSORJNPHOCNGM-TZMCWYRMSA-N 299.392 2.054 10 10 CECE Cn1cc([S@](C)(=O)=NCCCc2ccc(N)cc2)cn1 2161194462 WEEWBCLOKJPQJF-FQEVSTJZSA-N 292.408 2.092 10 10 CECE C[C@@H]1CN([C@@H](C)c2c(O)cccc2O)CC[C@@H]1C(=O)O 312793673 GDDKTZBLVRHFJV-VWYCJHECSA-N 279.336 2.201 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CC[C@@H]2CNC[C@@H]2CC1 312808620 LIAUGCZZVCNUGZ-RWMBFGLXSA-N 276.380 2.090 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4CCCC[C@@H]4C3)ccc21 313300815 HEFJMBDCRQRPIN-HFAKWTLXSA-N 271.364 2.265 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@@H]1CCOC(C)(C)C1 2161528296 OTZYVDKBPPZESQ-LLVKDONJSA-N 279.336 2.127 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H](C(=O)O)OCC1(C)C 2160230574 LNWPJYYVDFAVNN-GXFFZTMASA-N 279.336 2.017 10 10 CECE O=C(NCc1cncc(Cl)c1)c1cccc(O)c1O 703054137 ATWVQDXGYJMLSV-UHFFFAOYSA-N 278.695 2.076 10 10 CECE CN(Cc1cc2c(cc1O)OCO2)C[C@@H](F)C(F)(F)F 2179762857 XKQHOTJCRUHSCM-LLVKDONJSA-N 295.232 2.453 10 10 CECE CO[C@H]1C[C@@H]([C@H](O)c2ccc(N(C)C)cc2)C[C@H]1OC 2174888402 MMIBVEGOLYAQBM-SLBVQIDZSA-N 279.380 2.226 10 10 CECE CN1C(=O)[C@@H](N)c2ccc(N3CCC[C@@H]3C3CC3)cc21 706623285 QSCDEZNUTRRMDQ-HIFRSBDPSA-N 271.364 2.042 10 10 CECE O=C(N[C@@H]1CC[C@H]2CCC[C@H]21)c1cccc(O)c1O 707966579 PVGSJVRWJDEDFB-CKYFFXLPSA-N 261.321 2.406 10 10 CECE COc1ccc(CN[C@H]2COC3(CCC3)C2)c(O)c1 688289021 XUFOSUSAYHUVAG-GFCCVEGCSA-N 263.337 2.202 10 10 CECE CCCC1(O)CCN(c2ccc(CN)cc2F)CC1 710251556 UMIOAYMFKBAPMO-UHFFFAOYSA-N 266.360 2.416 10 10 CECE C[C@@H]1CCN(C(=O)COc2ccc(N)cc2)CCS1 379534200 GOMGMPCLIWORLY-LLVKDONJSA-N 280.393 2.002 10 10 CECE C[C@@H](NCc1ccnc(O)c1)c1c(O)cccc1O 392753369 KULXLXNEFRHUIB-SECBINFHSA-N 260.293 2.049 10 10 CECE Cc1ccc(O)c([C@@H](C)NCCc2cc(O)n[nH]2)c1 391449816 KMEDBJNRCSIXIU-SNVBAGLBSA-N 261.325 2.023 10 10 CECE CO[C@@H]1CC(N(C)c2ccc(CO)c(Cl)c2)C[C@H]1OC 2166101602 GXXKAWRIBHJEMY-HUUCEWRRSA-N 299.798 2.461 10 10 CECE CN(C)[C@@H]1CCC[C@H](NCc2ccc(O)cc2O)C1 715526742 OTDODJKONAGOFY-QWHCGFSZSA-N 264.369 2.060 10 10 CECE Cc1cc(N2C[C@@H](O)C[C@@H]2C)ccc1CNC(C)C 384819864 ONPBMMVPVNKWEI-BBRMVZONSA-N 262.397 2.453 10 10 CECE CCc1cnc(CNCc2cc(F)cc(F)c2O)[nH]1 719120892 MYUYVUSHUXMNDE-UHFFFAOYSA-N 267.279 2.246 10 10 CECE CCN[C@H](C)c1ccc(N2CCS[C@H](CO)C2)c(F)c1 720041954 AIKNTQMXWOFWKD-YPMHNXCESA-N 298.427 2.410 10 10 CECE CN(C)C[C@H]1CCCN1[C@H]1CCc2cccc(O)c21 389179783 KOBVTVKHLMBEQQ-KGLIPLIRSA-N 260.381 2.406 10 10 CECE NC[C@@H]1CCC[C@H]1NCc1ccc2c(c1)CCCO2 904350700 PMBNRADQPGDEKX-LSDHHAIUSA-N 260.381 2.229 10 10 CECE CC(C)N(C)C[C@@H](C)N[C@@H](C)c1ccc(O)cc1O 394058486 DREPWASQVXQACZ-NEPJUHHUSA-N 266.385 2.477 10 10 CECE [N-]=[N+]=NCCCN[C@H](CC1CCCCCC1)C(N)=O 394530698 JQHWGYLOHJRZRE-GFCCVEGCSA-N 267.377 2.491 10 10 CECE CC[C@@H]1CCC[C@H]([C@@H](NCCCN=[N+]=[N-])C(N)=O)C1 394554323 HDAJHOBUMRQCKH-GRYCIOLGSA-N 267.377 2.347 10 10 CECE Cc1ncc(CN(C)c2cc3c(cc2N)OCCO3)s1 400047550 XISUIEPXLXCFIH-UHFFFAOYSA-N 291.376 2.441 10 10 CECE C[C@H](NCC[C@@H]1CCCN1C)c1cc(O)ccc1O 822128118 MMRGZOGWBRHPQT-RYUDHWBXSA-N 264.369 2.233 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)c1cc(C)ccn1 2176219111 UROLRNZWVLGFOI-HZPDHXFCSA-N 272.348 2.480 10 10 CECE CC[C@]1(CO)COCCN1c1ccc(CNC)c(Cl)c1 2169040167 WXKCMBDKTZMGGU-HNNXBMFYSA-N 298.814 2.037 10 10 CECE C[C@H](NC[C@H]1COC(C)(C)CO1)c1ccc(F)cc1O 2176649481 DUZGZLFEYPCRED-JQWIXIFHSA-N 283.343 2.376 10 10 CECE CCCc1ncc(CNCCc2ccc(O)c(O)c2)[nH]1 2169501925 PLVMWQYQZYBONI-UHFFFAOYSA-N 275.352 2.106 10 10 CECE COc1ccc(Cn2ncc(SC)c2O)c(O)c1 2070280390 GPOLFQDEEMMKQS-UHFFFAOYSA-N 266.322 2.073 10 10 CECE CCOC(=O)c1cnn([C@@H](C)c2cccc(C)c2O)c1O 2070469331 RCUFILSGVYFMJJ-JTQLQIEISA-N 290.319 2.389 10 10 CECE OCc1ccc(N2CCO[C@H]([C@@H]3CCOC3)C2)c(Cl)c1 2171691521 RZQJJMCZRQTAHW-DOMZBBRYSA-N 297.782 2.074 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1O 2178166492 YKXAOYRYFKZVPD-GGZSPTBLSA-N 276.380 2.008 10 10 CECE C[C@H](O[C@@H]1COC(C)(C)C1)C(=O)Nc1ccc(N)cc1 2172337296 DVAYYXCSFGTTOW-GWCFXTLKSA-N 278.352 2.180 10 10 CECE C[C@@H](N(C)C(=O)[C@@H]1CNc2ccccc2N1)C(C)(F)F 2178854117 IULAZTMBVNVRJB-SKDRFNHKSA-N 283.322 2.395 10 10 CECE CO[C@@H]1CCC[C@@H](NCc2ccc(O)cc2O)C1 1172917385 FZVLUVMTZQSHOB-DGCLKSJQSA-N 251.326 2.145 10 10 CECE CCN1CCc2cc([C@@H](O)CCn3ccnc3)ccc21 2163076245 MDLNBVISRSUSJK-INIZCTEOSA-N 271.364 2.389 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3CC[C@H](C)CN3)ccc21 2163070897 JSJBLUHICXATSA-MJEQTWJJSA-N 274.408 2.491 10 10 CECE C[C@H](O)c1cc(F)c(N2CCN3CCC2CC3)c(F)c1 2194512118 PDBLCNDNJNTFML-JTQLQIEISA-N 282.334 2.303 10 10 CECE Cn1nnc2cccc(NCc3cccc(F)c3O)c21 2184144436 DYJQPXTVEJFAHL-UHFFFAOYSA-N 272.283 2.425 10 10 CECE CO[C@H]1C[C@@H](CNCc2ccc(O)c(O)c2)C12CCC2 2190403042 JUHHNOBVKYBBTD-WFASDCNBSA-N 277.364 2.393 10 10 CECE CN[C@@H]1CCCc2cc(N3CC=CC[C@@H]3CO)ccc21 2184687991 WHESCPFILSJZIJ-NVXWUHKLSA-N 272.392 2.411 10 10 CECE CN[C@H]1CCCc2cc(N3CC(C[S@@](C)=O)C3)ccc21 2184687851 VFOKBCGHKZEDLM-OXJNMPFZSA-N 292.448 2.098 10 10 CECE N[C@@H]1CCCc2cc(N3C[C@@H]4C[C@@H](CO)[C@@H]4C3)ccc21 2184680179 PSUHIOAWISUTAF-WRFANHODSA-N 272.392 2.087 10 10 CECE COCC[C@H](COC)N(C)c1ccc2c(c1)CC[C@@H]2O 2184730232 SISXCACMSQDRHA-ZBFHGGJFSA-N 279.380 2.154 10 10 CECE CN[C@H]1CCc2cc(N3C[C@H](C)N(C)[C@H](C)C3)ccc21 2184711426 RHNNAIHHWLBGIG-AHIWAGSCSA-N 273.424 2.422 10 10 CECE CN1CCN(c2ccc3c(c2)CCC[C@H]3N)[C@@H]2CC[C@@H]21 2184763380 GDJIHLLHDMCFLP-IXDOHACOSA-N 271.408 2.306 10 10 CECE Cc1cc(OC[C@H]2C[C@H]2CF)ccc1N1CCNCC1 2191450726 PNFXPKSVBCPQFO-UONOGXRCSA-N 278.371 2.389 10 10 CECE CC1(C)CNCC[C@@H](NC(=O)Nc2ccc(N)cc2)C1 2191528060 BLNLHGKHVYBIPM-CYBMUJFWSA-N 276.384 2.169 10 10 CECE Cc1sc(C(=O)NCCOc2ccc(N)cc2)cc1N 2191761316 MSBNVMWHFUNNPX-UHFFFAOYSA-N 291.376 2.030 10 10 CECE CN(C[C@H]1CCN1C)c1ccc(CNC2CC2)cc1F 2186454375 QIHVFJSNUXCMIW-CQSZACIVSA-N 277.387 2.218 10 10 CECE CO[C@H]1C[C@H]([C@@H](O)CCc2ccc(N)cc2)C[C@H]1OC 2196467834 GOBIXQAPBRRUNN-QCEMKRCNSA-N 279.380 2.002 10 10 CECE CCCCN(CC(=O)O)Cc1c(O)cccc1F 2042625577 GVMIDSHYMWKFRM-UHFFFAOYSA-N 255.289 2.218 10 10 CECE C[C@@H](NCCCC[S@](C)=O)c1ccc(F)cc1O 2047833817 QWUCSQJAWVPFHH-MGNBDDOMSA-N 273.373 2.341 10 10 CECE C[C@H](N)c1ccc(N2CCN(C)[C@H]3C[C@@H]32)cc1Cl 2049378003 AOOYIISHQPRDEP-HERUPUMHSA-N 265.788 2.252 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])C1(C)CC(C)(C)C1 2050065030 DSPAJCXGDALFKS-VIFPVBQESA-N 254.334 2.254 10 10 CECE COCCN(c1ccc([C@H](C)O)cc1)[C@@H]1CCCOC1 2197228679 LCTITDDQABZZGM-XJKSGUPXSA-N 279.380 2.372 10 10 CECE CN(CCCN=[N+]=[N-])C[C@@H](O)c1ccccc1F 2050494548 KHHJVOCUPYUHKF-GFCCVEGCSA-N 252.293 2.491 10 10 CECE CC[C@H](c1ccccc1O)N1CC[S@@](=O)[C@@H](C)C1 2051936536 XGNFPMZKOIMBRP-WHWRDJHUSA-N 267.394 2.296 10 10 CECE CCc1cc(N2CCNCC2)ccc1OC[C@@H](C)OC 2197494952 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COC(=O)[C@@H](C)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 217979054 XALQIXKQKWIAKD-GMTAPVOTSA-N 263.337 2.400 10 10 CECE Cc1ccc(F)c(N)c1C(=O)NCc1ccc(O)cc1O 1643103545 ADDPYZQZQQBUGV-UHFFFAOYSA-N 290.294 2.058 10 10 CECE CC(C)C[C@@H](C)N(C)C[C@@H](O)COc1ccc(N)cc1 218078791 AHHFOAOJRJOADV-UKRRQHHQSA-N 280.412 2.375 10 10 CECE CN(c1ccc(CO)cc1)C1CC(n2ccnc2)C1 2125746432 KNHNDIXECHZMIK-UHFFFAOYSA-N 257.337 2.215 10 10 CECE CCNCc1ccc(N(C)CC2(O)CCC2)cc1C 1914599545 CKWXBMGELMMMAE-UHFFFAOYSA-N 262.397 2.456 10 10 CECE Oc1c(F)cccc1CNC1C[C@@H]2CC[C@H](C1)O2 1965959353 XXCMLAQHTKBARJ-YOGCLGLASA-N 251.301 2.331 10 10 CECE C[C@@]1(CO)CCN(c2ccc3c(c2)CCC[C@@H]3N)C1 2128272569 HCNOTFFVVXYQSV-JKSUJKDBSA-N 260.381 2.231 10 10 CECE CC1(C)[C@H](O)CCN1c1ccc2c(c1)CCC[C@@H]2N 2128275616 VORORIUGJCAQSY-LSDHHAIUSA-N 260.381 2.372 10 10 CECE CC[C@@]1(O)CCCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128319406 SRDPSCWQLBMEFS-JKSUJKDBSA-N 260.381 2.374 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2N)C1CCC(O)CC1 2128326976 CTKGZQXEKIQTKK-PXCJXSSVSA-N 260.381 2.372 10 10 CECE O[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)C2(CCC2)C1 2128324455 FMSXKQXZMXLEKQ-DZGCQCFKSA-N 259.349 2.160 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3N)[C@H](C)C[C@@H]1O 2128326467 HNNMTYSFBNGDPV-XYPYXGAPSA-N 260.381 2.228 10 10 CECE Cc1cc(N2CC[C@H]3CCO[C@H]3C2)ccc1CCN 2128419168 YXYNATINKRDMHG-HOCLYGCPSA-N 260.381 2.111 10 10 CECE Cc1cc(OC[C@@H]2CCCO2)ccc1N1CCC[C@@H](N)C1 161704952 QDGOPGUQISMXCG-ZBFHGGJFSA-N 290.407 2.480 10 10 CECE CCc1nc(N(Cc2ccc(N)cc2)C2CC2)cc(=O)[nH]1 164543359 UTLUKSPRAFEUQF-UHFFFAOYSA-N 284.363 2.084 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(CN)CCC1 166878296 JXRVJKJXAFIFHL-UHFFFAOYSA-N 289.423 2.230 10 10 CECE C[C@@H](NC1CCS(=O)CC1)c1ccc(F)cc1O 157926520 PLNYETWVOWTQNI-OAEZARSSSA-N 271.357 2.093 10 10 CECE Cc1cc2c(cc1N(C)CC(C)(C)CO)OCO2 258759739 HABVCQBBODCYHE-UHFFFAOYSA-N 251.326 2.178 10 10 CECE Cc1cc(N2C[C@H]3COC[C@@H]32)ccc1CNC1CC1 2129799232 PYCLQKJWSWEPDC-BBRMVZONSA-N 258.365 2.082 10 10 CECE CC[C@H](CNC)CN(C)c1ccc2c(c1)OCO2 258912237 FYNZEHZRLOFOOK-LLVKDONJSA-N 250.342 2.097 10 10 CECE C[C@@]1(O)CC[C@H](NCc2ccc3c(c2)CCCO3)C1 2130297201 ZGDCZFUVELVMOH-GOEBONIOSA-N 261.365 2.405 10 10 CECE N[C@@H]1CCCN(c2ccc(OC[C@@H]3C[C@H]3F)cc2)C1 2131814043 OTCXFEDGZLUEPS-YWPYICTPSA-N 264.344 2.351 10 10 CECE CCN1[C@@H](C)CN(c2ccc(CO)cc2F)C[C@H]1C 2130305679 JNIPCLCOICTKHX-TXEJJXNPSA-N 266.360 2.237 10 10 CECE Nc1ccc(CCN2CCC[C@@H](C3(O)CC3)C2)cc1 2130512321 HHYVBIGTEFKHPP-CQSZACIVSA-N 260.381 2.048 10 10 CECE CN(CC1=CCSC1)c1ccc(CO)c([N+](=O)[O-])c1 2132057535 FMABRXLZJPPYBS-UHFFFAOYSA-N 280.349 2.197 10 10 CECE CCN[C@H](C)c1ccc(N2[C@H]3C[C@@H]2CN(C)C3)cc1 2131080738 KXADXYJCDFYFPF-WQVCFCJDSA-N 259.397 2.250 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC[C@H]2C[C@H]2C1 817549940 PVDZBSJKQMOXLM-XQQFMLRXSA-N 275.348 2.193 10 10 CECE CC(C)(C)n1ccnc1[C@H](O)Cc1ccc(N)cc1 2133276941 LPYCGZUOIPNEHC-CYBMUJFWSA-N 259.353 2.496 10 10 CECE CCCOC(=O)CNCc1cc(Cl)ccc1O 1857872828 DGDUDTMNKUJJBO-UHFFFAOYSA-N 257.717 2.088 10 10 CECE CN[C@@H](C)c1ccc(N(C)C2(CCO)CC2)c(F)c1 2133546029 NJGROJFUQPYGKJ-NSHDSACASA-N 266.360 2.457 10 10 CECE Oc1cccc(CNC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1O 1917506222 WZRVXIZSHHUKNY-QNSTZXKLSA-N 259.349 2.480 10 10 CECE CC(C)[C@@H]1C[C@H]1[C@H](NN)c1ccc2c(c1)CCN2C 2135424787 RRNUWTJHGTYKHL-SQWLQELKSA-N 259.397 2.475 10 10 CECE CCCOc1cc(N2CCN(C3CC3)CC2)ccc1N 111051621 BQJPVMZCLBWPCP-UHFFFAOYSA-N 275.396 2.342 10 10 CECE Cc1cccc(CNC(=O)[C@@H]2C[C@@]23CC3(F)F)c1O 2139761100 FKECXFFKMZIJJA-GXFFZTMASA-N 267.275 2.362 10 10 CECE CCCN(c1ccc(CO)c(OC)c1)[C@H]1CCOC1 2139710263 GXGQVVVWIXAABA-AWEZNQCLSA-N 265.353 2.193 10 10 CECE CN(C)[C@@H]1CN(Cc2ccc(F)cc2O)C(C)(C)C1 2139785418 PZHJZNNADWZWEK-ZDUSSCGKSA-N 266.360 2.446 10 10 CECE C[C@H]1CCO[C@H]1CCNCc1ccc(O)c(O)c1 1918130254 RRJUAHYQOPCYBV-HZMBPMFUSA-N 251.326 2.003 10 10 CECE COc1ccc(O)c(CN[C@H]2CCO[C@H]2C2CC2)c1 224930061 QOGSODXYHOWUFA-ZFWWWQNUSA-N 263.337 2.058 10 10 CECE CN(Cc1noc(C2CCC2)n1)c1ccc(CN)cc1 1967634094 DTIYNABKWNEGGH-UHFFFAOYSA-N 272.352 2.432 10 10 CECE O=C(N[C@@H]1C[C@H]1c1ccccc1)c1ccc(O)c(O)c1 226996633 BUPZNWKVMNMHSG-QWHCGFSZSA-N 269.300 2.384 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N(C)CCOC)c(Cl)cc21 118705645 XSWJWMQTGJEHEU-CYBMUJFWSA-N 297.786 2.025 10 10 CECE CCCN1c2ccc(OC)cc2NC[C@H]2COC[C@H]21 228364795 MMRTXACGOZHYGB-XHDPSFHLSA-N 262.353 2.352 10 10 CECE COC[C@]1(C)CN[C@H](c2ccc(N(C)C)cc2)OC1 1927003010 CAKPGDDLTAQGIZ-GJZGRUSLSA-N 264.369 2.024 10 10 CECE CCCn1nnnc1CN[C@H](CC)c1ccccc1O 1969537898 HFQGSAGPLUVVOL-GFCCVEGCSA-N 275.356 2.030 10 10 CECE CCc1cc(C(=O)NCCCCN=[N+]=[N-])n(CC)n1 231730609 MWNXMDLOKQPUIO-UHFFFAOYSA-N 264.333 2.286 10 10 CECE CCN(CC(N)=O)c1ccc(CNC(C)(C)C)c(C)c1 231823660 XXXGLRHAAFLFOX-UHFFFAOYSA-N 277.412 2.195 10 10 CECE Cc1ccc(O)c(CNC[C@]23CO[C@](CF)(C2)C3)c1 2138002688 VCDGQSHGAWPGGT-GASCZTMLSA-N 265.328 2.309 10 10 CECE CN[C@H](c1ccccc1O)c1cnc(Cl)n1C 1942409014 WZVRTARWCLQTAD-LLVKDONJSA-N 251.717 2.088 10 10 CECE Nc1ccc(F)cc1NC(=O)c1ccc(O)c(O)c1 236336155 ULOHPOQFVPRZCK-UHFFFAOYSA-N 262.240 2.071 10 10 CECE CC[C@]1(C)CN(c2ccc(CO)cc2[N+](=O)[O-])CCO1 1970530086 RFNXATVZUZOIRE-CQSZACIVSA-N 280.324 2.092 10 10 CECE CN(C)CCOc1ccc(N(C)CCOC2CC2)cc1 2143532765 XCUNPJHDKKLOAV-UHFFFAOYSA-N 278.396 2.242 10 10 CECE Oc1ccc(CN[C@H]([C@H]2CCOC2)C(F)(F)F)cc1O 2143637145 BRRYIKNJLHCUIQ-JOYOIKCWSA-N 291.269 2.155 10 10 CECE C[C@H](C[C@@H]1CCCCN1)NCCc1ccc(O)c(O)c1 2148014403 BDVAROJSKQVNQY-OCCSQVGLSA-N 278.396 2.151 10 10 CECE NC1(CCC(=O)NCc2ccccc2O)CCCCC1 2143897544 BNUSWLYOPVZEOO-UHFFFAOYSA-N 276.380 2.450 10 10 CECE N[C@H](CO)c1c(O)c(Cl)cc(Cl)c1Cl 1951401939 HQTCBMZDNIJFTI-RXMQYKEDSA-N 256.516 2.345 10 10 CECE CC(=O)C(=O)c1cccc([N+](=O)[O-])c1Br 1951480658 QUYYILOPANXWAF-UHFFFAOYSA-N 272.054 2.129 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CCCC[C@@H]2O)cc1O 131867832 UZHUYTYOMJBWQS-GDLCADMTSA-N 264.369 2.152 10 10 CECE CO[C@H]1CCCCC[C@H]1NC(=O)Cc1ccc(N)cc1 2144525468 DTMKXRPGTNLBTI-CABCVRRESA-N 276.380 2.275 10 10 CECE Cc1cccc2c1[nH]c(=O)n2Cc1ccccc1O 257903575 ATULFGSJVIRYEC-UHFFFAOYSA-N 254.289 2.392 10 10 CECE CN[C@@H](C)c1ccc(N2CC(CO)C2)cc1C(F)(F)F 2148953251 KBKILWSEJNKQSD-VIFPVBQESA-N 288.313 2.414 10 10 CECE Nc1ccc(CNc2cnn(C[C@@H]3CCCO3)c2)cc1 2148943933 PKCWOBLVCDIJDK-HNNXBMFYSA-N 272.352 2.256 10 10 CECE COc1ccc2nc(CCc3ccc(N)cc3)[nH]c2n1 157868360 HBBNYONIUQZMCS-UHFFFAOYSA-N 268.320 2.334 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(O)c(O)c(C)c1C 260363843 YGRWNCMYOMRVLS-LLVKDONJSA-N 267.325 2.058 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCC[C@H](C2CNC2)C1 2149008050 XSGRNQHLNGPHGZ-RYUDHWBXSA-N 276.380 2.090 10 10 CECE C[C@H](NC(=O)Cc1ccc(N)cc1)c1ccncc1 35692839 RANPBZSDOFYQMX-NSHDSACASA-N 255.321 2.084 10 10 CECE COc1ccc(N(C)[C@]2(CN)C[C@H]3OCCC[C@@H]32)cc1 2146027008 JEDKIPZOUYSZLO-XHSDSOJGSA-N 276.380 2.028 10 10 CECE CCN[C@H](C)c1ccc(N(C)CC(F)(F)CO)cc1O 2150990462 QZKPCFUCFKRSGQ-SNVBAGLBSA-N 288.338 2.127 10 10 CECE CCNCc1ccc(N(C)CCn2ccnc2)c(C)c1 2149426969 BSXWJZVIRJOGEV-UHFFFAOYSA-N 272.396 2.437 10 10 CECE COc1ccc([C@H](C)NC2CCN(C)CC2)c(O)c1 37267005 QUIDXVYEJYHIKL-NSHDSACASA-N 264.369 2.146 10 10 CECE O=C(CN1CC(CC(F)(F)F)C1)c1ccc(O)c(O)c1 2152302054 FHZYROBYFUWROQ-UHFFFAOYSA-N 289.253 2.165 10 10 CECE CNCc1ccc(N2CCn3ccnc3C2)c(Cl)c1 164021861 VGOOVPWDWAZMCV-UHFFFAOYSA-N 276.771 2.276 10 10 CECE C[C@H]1CN2CCC[C@H]2CN1c1ccc2c(c1)COCC2 2152798438 YJADNDFLHGITCV-GUYCJALGSA-N 272.392 2.432 10 10 CECE Oc1cc(Cl)ccc1CN1C[C@H]2CCO[C@H]2C1 2004631480 BQFFCEPZVUZXCI-MFKMUULPSA-N 253.729 2.266 10 10 CECE CCOC(=O)C1=NN(c2c(F)cccc2Cl)C(=O)[C@H]1C 2154699289 WJACCBYDMYVHTF-ZETCQYMHSA-N 298.701 2.381 10 10 CECE CCNCc1ccc(N2CC3(CC3)C[C@H]2CO)cc1C 2155346475 BYNBXQSTGLZDJE-INIZCTEOSA-N 274.408 2.456 10 10 CECE CCNCc1ccc(N2C[C@@H](O)[C@H]2C)c(Cl)c1 2011379419 LKPDFAONGLXUTB-NOZJJQNGSA-N 254.761 2.019 10 10 CECE N[C@H]1[C@H]2CC[C@H]1N(Cc1ccc(Br)cc1O)C2 2012245343 FZRZQYMQUPRJPN-NDMJEZRESA-N 297.196 2.076 10 10 CECE CCc1noc(CN(C)c2ccc([C@H](C)N)cc2F)n1 2160393978 FKKKGIPZCNRJNM-VIFPVBQESA-N 278.331 2.427 10 10 CECE Oc1cc(Br)ccc1CN1CC[C@H]2COC[C@@H]21 2021415256 NVUQXJOGSWIVET-JQWIXIFHSA-N 298.180 2.375 10 10 CECE CC[C@H](C)OC(=O)NCCOc1ccc(N)cc1 2026926085 GRTXNRNXYPZREN-JTQLQIEISA-N 252.314 2.172 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@H]2CCN[C@@H]2C1 2027227340 LFONCAQEGQWHNA-ZWNOBZJWSA-N 266.772 2.229 10 10 CECE Oc1cc(Cl)ccc1CN1CC[C@H]2CNC[C@@H]2C1 2029644890 DDOJWIXLYVKXHO-CMPLNLGQSA-N 266.772 2.087 10 10 CECE Cc1nc(CCNCc2ccc(Cl)cc2O)no1 2029656131 HMMLEAQESPRGPT-UHFFFAOYSA-N 267.716 2.069 10 10 CECE CCc1cccc(CN2C[C@H](OC)[C@H](F)C2)c1O 2029815891 YTRNIZDGWVGBST-OLZOCXBDSA-N 253.317 2.123 10 10 CECE CN[C@H](C)c1ccc(N2[C@H]3CC[C@H]2[C@H](CO)C3)cc1O 2157232538 WODSIHWLGJGZES-YXMPFFBPSA-N 276.380 2.022 10 10 CECE Nc1ccc(N2CCN(CC(F)(F)F)C2=O)cc1 2031705612 AVZKWGDRDFYHCS-UHFFFAOYSA-N 259.231 2.073 10 10 CECE CC1(C)COCC[C@H]1NCc1ccc(O)c(O)c1 2031925920 WUMSAUHGKRUDJF-CYBMUJFWSA-N 251.326 2.003 10 10 CECE CNCc1cc(F)c(N2C[C@H](C)O[C@H](C)C2)c(F)c1 62709104 SGEISBWKDMVHEU-AOOOYVTPSA-N 270.323 2.298 10 10 CECE CN[C@H](C)c1ccc(N(C)CCN2CCCC2)cc1 63052205 UAOZZMYBKQBYDT-CQSZACIVSA-N 261.413 2.499 10 10 CECE O=C(c1cccc(O)c1O)N1C[C@@H]2CCCC[C@H]2C1 187170381 WBSQJOXAHZDTFZ-QWRGUYRKSA-N 261.321 2.360 10 10 CECE C[C@@H]1CN(Cc2ccc(Cl)cc2O)C[C@@H](C)C1N 2037995427 OGAHAMBHJWBHLI-NXEZZACHSA-N 268.788 2.461 10 10 CECE COCC1(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)CCC1 2039721332 CYQXXMOILSMVLQ-SNVBAGLBSA-N 252.318 2.104 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@](F)(CO)C2)cc1 2039794329 HGEVFCMPUGQZMY-SMDDNHRTSA-N 253.317 2.041 10 10 CECE CO[C@H](CNCc1c(C)cccc1O)C1CCOCC1 2160792302 FCAAAUSUBOVJQP-MRXNPFEDSA-N 279.380 2.232 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OC(F)(F)O3)C[C@]1(C)CN 400463445 MWHAZTSHKNIQRT-RNCFNFMXSA-N 284.306 2.429 10 10 CECE CN(CCCC1CC1)C[C@H](O)COc1ccc(N)cc1 400804682 PKBXKKKWHWEGNQ-HNNXBMFYSA-N 278.396 2.131 10 10 CECE CCOC(=O)C(NCCN=[N+]=[N-])(C1CC1)C1CC1 310666530 GILQBVZLZSVOEL-UHFFFAOYSA-N 252.318 2.008 10 10 CECE C[C@@H](N[C@H]1CCCOCC1)c1c(O)cccc1O 310901092 BAFPGQNUNSXEDX-MNOVXSKESA-N 251.326 2.318 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@](C)(OC)C2)cc1O 311559050 KJCZVURAMJMKBQ-NHYWBVRUSA-N 264.369 2.288 10 10 CECE Nc1ccc(CCCNC[C@@]23COC[C@H]2C3(F)F)cc1 2161886418 JCQROYGJONRGLW-ZIAGYGMSSA-N 282.334 2.073 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])c1ccc(O)cc1 90259466 SNVYSPGMPWCYTN-CYBMUJFWSA-N 278.312 2.070 10 10 CECE CCOC(=O)[C@@](C)(NCCN=[N+]=[N-])c1nc(C)c(C)s1 702033821 XQUORCVUKABRLG-LBPRGKRZSA-N 297.384 2.438 10 10 CECE CCN(CC)c1ccc([C@@](C)(O)CCS(C)(=O)=O)cc1 2163095134 QOWYYXLXMSPABF-HNNXBMFYSA-N 299.436 2.175 10 10 CECE CN1CCc2cc([C@@H](O)[C@]3(C)CC(F)(F)CN3)ccc21 2163068567 IXNGINRXPFWVGG-KGLIPLIRSA-N 282.334 2.100 10 10 CECE CC(=O)c1ccc(O)c(CN(C)CC2(C)COC2)c1 703018036 UVYPLONXXBOIAH-UHFFFAOYSA-N 263.337 2.063 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)[C@]1(O)CCSC1 2163231617 VJXNVANABAJLIA-CVEARBPZSA-N 292.448 2.415 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@H]2CCCN(C)C2)cc1O 705162837 UITOUFUOFSZJLA-STQMWFEESA-N 277.412 2.190 10 10 CECE C[C@H]1C[C@@H](O)CCN1c1ccc(CN)c(Cl)c1 705622274 JGMADUAKUWASFW-CABZTGNLSA-N 254.761 2.148 10 10 CECE C[C@@]1(CO)CCCN(c2ccc(CO)c(Cl)c2)C1 688045653 XGMCDWMPPZMYHG-CQSZACIVSA-N 269.772 2.431 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C[C@]12CCC[C@H]1C2 710390445 WTKPSGLLYWJTTD-BLLLJJGKSA-N 273.380 2.329 10 10 CECE C[C@@H]1NCCN([C@H](C)c2ccc(N(C)C)cc2)[C@H]1C 379464524 GSUDBAFLEKTVPV-MELADBBJSA-N 261.413 2.496 10 10 CECE Nc1ccc(NC(=O)CCN2CCC[C@@H](CF)C2)cc1 711406251 GBXPGYNRCGCWDR-LBPRGKRZSA-N 279.359 2.279 10 10 CECE CC(C)N(C[C@H](C)O)c1c(F)cc(CN)cc1F 691398617 BIQKKNRHOHDQPC-VIFPVBQESA-N 258.312 2.019 10 10 CECE CN(Cc1ccn(C)n1)c1ccc(CN)cc1Cl 723525166 YPAWPMIDDCQVTA-UHFFFAOYSA-N 264.760 2.169 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@H](CCF)C2)cc1O 691908842 QBOPIUMTJGGVHP-ZYHUDNBSSA-N 269.316 2.010 10 10 CECE CCN(C[C@@H](C)OC)c1ccc(CN)c(F)c1F 383222171 OBYWSWIYOLAZRF-SECBINFHSA-N 258.312 2.285 10 10 CECE CCN1CC[C@H](N(CC)c2ccc(OC)cc2N)C1 695358637 IHUZIXPMFWWZFK-LBPRGKRZSA-N 263.385 2.198 10 10 CECE CCN(CC)C1[C@@H]2CN(c3ccc(CN)c(F)c3)C[C@@H]12 384577213 RXXJAYCZXVMYLI-ZIAGYGMSSA-N 277.387 2.061 10 10 CECE C[C@H]1CCSCCN1[C@H](C)C(=O)Nc1ccc(N)cc1 385492868 FWJNWWMFDLVUMK-NWDGAFQWSA-N 293.436 2.423 10 10 CECE C[C@H](Cc1ccnn1C)N[C@H](C)c1cc(O)ccc1O 2174323786 BTJXYYUMADCEBV-GHMZBOCLSA-N 275.352 2.113 10 10 CECE O[C@H]1CCC[C@@H]1CNCc1ccc2c(c1)CCCO2 894817648 SWBWQCBGTGQDIU-CABCVRRESA-N 261.365 2.262 10 10 CECE O[C@H]1CCC[C@@H](NCc2ccc3c(c2)CCCO3)C1 921587147 QJWCSDDZPFBZDG-CABCVRRESA-N 261.365 2.405 10 10 CECE O=C(C[C@@H]1CCC[C@H]1O)NCc1cc(Cl)ccc1O 2062035201 VVFTXXYQFKGHHS-JOYOIKCWSA-N 283.755 2.213 10 10 CECE C[C@H](NC(=O)CN1CCC[C@H]1CN=[N+]=[N-])c1ccco1 2179615146 CFBCYJFEUXPDGK-QWRGUYRKSA-N 277.328 2.232 10 10 CECE Cc1nnc2cccc(OCCc3ccc(N)cc3)n12 2176336687 MQHDZDWBLRSPAT-UHFFFAOYSA-N 268.320 2.241 10 10 CECE COc1ccc(OCCc2ccc(N)cc2)nc1OC 2176328376 VYOUZVFUBDWHSR-UHFFFAOYSA-N 274.320 2.303 10 10 CECE COc1cc(Cl)cc(CNC2CN(C3CCC3)C2)c1O 2169253423 CXCICDOLKQMDAJ-UHFFFAOYSA-N 296.798 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2.218 10 10 CECE CCC[C@H]1COC[C@H]1NCc1cc2c(cc1O)OCO2 699474971 QBWMVLDALMBROS-CMPLNLGQSA-N 279.336 2.026 10 10 CECE CC[C@H](COC(=O)CCOc1ccc(N)cc1)OC 396966920 CJBDNIDUSHCAPC-GFCCVEGCSA-N 267.325 2.006 10 10 CECE C[C@H]1C[C@@H](C)[C@@H](CN)CN1[C@H](C)c1cc(O)ccc1O 397356080 FQHDFPMNKCZPDJ-XQHKEYJVSA-N 278.396 2.464 10 10 CECE CC(C)CSCCNC(=O)COc1ccc(N)cc1 397444855 JQLRNKGEOPCSFM-UHFFFAOYSA-N 282.409 2.153 10 10 CECE CC(C)[C@@]1(C)C[C@@H]1NC(=O)COc1ccc(N)cc1 397402631 UUGPMULJBSVCAP-DZGCQCFKSA-N 262.353 2.198 10 10 CECE O=C(N[C@H]1CCCC1(F)F)c1cccc(O)c1O 398406302 ZOBHOIAKFICABT-VIFPVBQESA-N 257.236 2.015 10 10 CECE COC(=O)c1ccc(CN2CCC[C@@H]2CN=[N+]=[N-])nc1 2179617935 VTUCDTWJLOOCMC-GFCCVEGCSA-N 275.312 2.143 10 10 CECE COc1ccc(CN2CCCOC[C@@H]2C)c(O)c1 398903904 FIDUJHULJACQDH-NSHDSACASA-N 251.326 2.012 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c(F)c1 2178162012 YAVVOGCUMBEGOS-QFEPDWEUSA-N 279.355 2.475 10 10 CECE Oc1cccc2c1[C@@H](NCc1cnn3c1CCC3)CC2 2167658166 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Cc1nccnc1CN(C)c1ccc2c(c1)CC[C@@H]2O 2184733408 HJLGRZHSRKSCTH-INIZCTEOSA-N 269.348 2.401 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C[C@H]1C[C@](C)(F)C1 2198457230 AIZKRJDEZWPHAW-FUKZOUPISA-N 279.359 2.277 10 10 CECE CCN1CC(CN(C)c2c(F)cc([C@H](C)N)cc2F)C1 2194695020 QJMGPZRVRWFWFD-JTQLQIEISA-N 283.366 2.372 10 10 CECE C[C@@H](N[C@H]1CC[C@@H](O)CC1)c1c(O)cccc1O 2042539935 JJSPRBQABRXERV-MXWKQRLJSA-N 251.326 2.052 10 10 CECE CC[C@H](NOCCCN(C)C)c1ccccc1O 2044575488 SMGGNXMXZAYTLW-ZDUSSCGKSA-N 252.358 2.316 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@@H](O)C2)c(F)c1 2050105141 RAAVKFMEJZUDRZ-CMPLNLGQSA-N 253.317 2.230 10 10 CECE CCN1CCc2cc([C@@]3(O)CCNCC34CC4)ccc21 2185944630 OOGXKJXIFYDCFQ-KRWDZBQOSA-N 272.392 2.030 10 10 CECE Oc1ccc(CN[C@H]2[C@@H]3[C@H]2CCC3(F)F)cc1O 2051230531 KSOWFVGMQBITPT-JFUSQASVSA-N 255.264 2.231 10 10 CECE C[C@@H]1[C@H](N)CC(C)(C)CN1C(=O)Nc1ccc(N)cc1 2191502744 GQSMQBPPWRUYKI-ZWNOBZJWSA-N 276.384 2.248 10 10 CECE C[C@@H]1CCC[C@H]1S(=O)(=O)N1CCC[C@H](N=[N+]=[N-])C1 2055209469 JJULOTCDGOWILJ-OUAUKWLOSA-N 272.374 2.280 10 10 CECE COc1cc(COCCc2ccc(N)cc2)sn1 2056190315 XKNXOTIYQCKSDC-UHFFFAOYSA-N 264.350 2.493 10 10 CECE FC(F)(F)[C@@H]1CNCCN1c1ccc2c(c1)COCC2 2186679324 QUTWTWPJQBCYIG-ZDUSSCGKSA-N 286.297 2.100 10 10 CECE CN(C[C@](C)(F)C(F)(F)F)C(=O)c1cccc(O)c1O 2191866289 ROTLQEWYDOIPIK-NSHDSACASA-N 295.232 2.460 10 10 CECE O=C(N[C@@H]1C[C@H]2CC[C@H]1C21CC1)c1cccc(O)c1O 2199123211 ZIMLWAPDSSMTLR-YUSALJHKSA-N 273.332 2.406 10 10 CECE Cn1ccc(C2CN(CCCc3ccc(N)cc3)C2)n1 2195405091 JHBLXPTYFWLVHK-UHFFFAOYSA-N 270.380 2.034 10 10 CECE COCCN(CCF)c1ccc2c(c1)CC[C@H]2N 2065073989 PZVROBRBMUDGCK-CQSZACIVSA-N 252.333 2.055 10 10 CECE C[C@@H](CN(C)C(=O)c1cccc(O)c1O)OC(C)(C)C 2192217389 YMGGPOIKVPKMJF-JTQLQIEISA-N 281.352 2.373 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2CCN2C)c(F)c1 2066404035 MYSVQLJPCUNTMO-PWSUYJOCSA-N 252.333 2.019 10 10 CECE CCc1cc(N(C)[C@H](C)c2ccccc2O)nc(=N)[nH]1 2192570150 NYRQNSHSMOEUGG-SNVBAGLBSA-N 272.352 2.355 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1ccc(C(N)=S)nn1 2192568200 VFUTUHIGUJEGHN-VIFPVBQESA-N 288.376 2.014 10 10 CECE O=C(NCc1ccccc1O)[C@H]1C[C@@H]1C1CCOCC1 2199990151 PHCHSTLIVLAJIC-KGLIPLIRSA-N 275.348 2.071 10 10 CECE Cc1cccc(CN(C)[C@@H]2COCC2(F)F)c1O 2076373581 GWNSCQSPHSKTBZ-LLVKDONJSA-N 257.280 2.167 10 10 CECE CC[C@@H](N[C@H](CC)c1ccccc1O)C(=O)N(C)C 2100229977 PZHPQOVXMLJSTJ-CHWSQXEVSA-N 264.369 2.300 10 10 CECE CN(CCc1ccc(N)cc1)C[C@@H]1C[C@]12CCOC2 2100516724 JHWKEJUPUNIZMV-HOCLYGCPSA-N 260.381 2.170 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@H]1C(C)=CCC[C@H]1C 2100928136 CRHAUWYAQAACDF-GRYCIOLGSA-N 266.345 2.420 10 10 CECE CCN(c1ccc(CN)cc1)[C@H]1CCC(F)(F)[C@@H]1O 2103840619 IVNHEWKOFTYPFE-QWHCGFSZSA-N 270.323 2.130 10 10 CECE CNCc1ccc(N2C[C@H](C)[C@@H](F)C2)cc1OC 2084004556 KIBHJZGFKMZMPO-GWCFXTLKSA-N 252.333 2.209 10 10 CECE C[C@@H](C[C@@H]1CCCN1)NCc1ccc2c(c1)CCO2 2104271071 FZAPDJKOHMVBJB-WFASDCNBSA-N 260.381 2.242 10 10 CECE C[C@H]1[C@@H](CC(=O)O)CCN1Cc1c(O)cccc1F 2104484758 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CC[C@H](O)CN(c1ccc([C@@H](C)O)c(O)c1)C1CC1 2107406425 IJMFKPPOJUMVPU-MFKMUULPSA-N 265.353 2.185 10 10 CECE CC[C@H](NC[C@H]1OCCO[C@@H]1C)c1ccccc1O 2087424726 REKJFRPPFVMOLF-OSAQELSMSA-N 265.353 2.237 10 10 CECE Cc1cc(N2CC[C@@H]3COCC[C@@H]32)ccc1CCN 2088751881 SYOJJWZGLHBSHL-ZBFHGGJFSA-N 260.381 2.111 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1ccn2nccc2c1 2108986844 WLBWKWSMZYQUEE-UHFFFAOYSA-N 258.285 2.107 10 10 CECE CC[C@H]1CCOCC[C@H]1NCc1ccc(O)c(O)c1 2109095381 ZJDXJYUQXHUYEQ-QWHCGFSZSA-N 265.353 2.393 10 10 CECE COc1ccnc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)c1 2110910955 XBOMEJMWVUVMCS-SECBINFHSA-N 261.285 2.005 10 10 CECE O=C1Nc2cc(N3CC4(F)CC3C4)c(Cl)cc2[C@H]1O 2111356271 OCAFCFZHWVZLGW-BUVHBNEDSA-N 282.702 2.016 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(CO)cc1F 2111778955 VPRHYXHDMLYIAS-YWPYICTPSA-N 265.328 2.322 10 10 CECE CC1(C)CN(c2ccc(CNC3CC3)cc2)[C@H]1CO 2092554999 JXFHOKPLMHHYSY-HNNXBMFYSA-N 260.381 2.146 10 10 CECE CC1=C[C@@H](C)CN(C(=O)COc2ccc(N)cc2)C1 2095983002 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2.347 10 10 CECE CN(C)c1ccc([C@H](O)C[C@]23CC[C@H]2CNC3)cc1 2142554451 ILEYRIMTHGJKLH-IMJJTQAJSA-N 260.381 2.176 10 10 CECE NCc1ccc(N2CC[C@]3(CCO3)C2)c(Br)c1 1947807686 RLENKTNUIROIJY-ZDUSSCGKSA-N 297.196 2.277 10 10 CECE C[C@H]1C[C@@H](C)CN1[C@H](CN)c1ccc2c(c1)CCN2C 253066471 JEOZCHZVCWBVGN-IIYDPXPESA-N 273.424 2.409 10 10 CECE CCN[C@H](C)c1ccc(N2CCOC[C@H]2CO)c(Cl)c1 253079239 UKIGVCJVCADROU-DGCLKSJQSA-N 298.814 2.208 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC2(CCNC2)CC1 2143831433 PYARSIFAWGXQTJ-LBPRGKRZSA-N 276.380 2.234 10 10 CECE CCN(CCn1c(C)csc1=O)c1ccc(CN)cc1 2143815333 MZFMHBPQFRGEFY-UHFFFAOYSA-N 291.420 2.203 10 10 CECE COC1(OC)CC[C@@H]1CNCc1ccc(N(C)C)cc1 1972387092 HCZPCDIKHLHMLF-CQSZACIVSA-N 278.396 2.241 10 10 CECE CC1CC(CO)(NCc2cccc(Cl)c2O)C1 1972490157 ZBRYWGAGPJGNJF-UHFFFAOYSA-N 255.745 2.296 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]32)cc1O 2143969457 QPBOODFWVKZVKX-YODMDTAWSA-N 277.364 2.185 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]1NCc1ccccc1O 1973223622 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2145602509 ZFXZNHARMGPUAW-NHYWBVRUSA-N 282.334 2.374 10 10 CECE C[C@@H](CNCc1ccc2c(c1)CCN2C)N1CCCC1 160784673 SJVZEAMBHHXKTH-AWEZNQCLSA-N 273.424 2.253 10 10 CECE N[C@@H]1CCCN(c2ccc(OCCOC(F)F)cc2)C1 2150248749 JJHHTFFOCGKAQT-LLVKDONJSA-N 286.322 2.232 10 10 CECE Cc1nscc1CN(C)C(=O)COc1ccc(N)cc1 2150305493 PIJVDWFSAJAUQH-UHFFFAOYSA-N 291.376 2.071 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3OCCO[C@H]3C2)c(Cl)c1 2151769795 FPOPYDXKHLIITJ-KMUNFCNLSA-N 297.782 2.387 10 10 CECE CNCc1ccc(N2CCC(O)(COC)CC2)c(Cl)c1 2151876328 KNPYBEQGUSPRDC-UHFFFAOYSA-N 298.814 2.037 10 10 CECE C[C@@H]1CC[C@H](C(=O)NCC2(CN=[N+]=[N-])CC2)S1 2006017954 FYXXODUPAJKNLU-RKDXNWHRSA-N 254.359 2.477 10 10 CECE C[C@@H](O)c1ccc(N2CCCN(C)C(=O)CC2)c(Cl)c1 2152580124 LXJKQGZMCYKVHJ-LLVKDONJSA-N 296.798 2.452 10 10 CECE Oc1c(F)cc(F)cc1CN1CC[C@H]2NCCC[C@H]2C1 2153084358 HGIOEIXFIABJLK-IINYFYTJSA-N 282.334 2.244 10 10 CECE CC1(NC(=O)COc2ccc(N)cc2)CCCCC1 45024742 HMEVBEUFQAVEHG-UHFFFAOYSA-N 262.353 2.487 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CC[C@@H](N)C2(CCC2)C1 2155074188 GYRSZYVWWNCWAM-IAQYHMDHSA-N 276.380 2.362 10 10 CECE CNCc1ccc(OCc2nncn2C(C)C)c(C)c1 2155015970 ZBHVYQGSFWVQHK-UHFFFAOYSA-N 274.368 2.466 10 10 CECE N[C@H](c1ccccc1O)[C@H](O)c1cscc1F 2010864716 VSIUNKBMOQKPPV-VXGBXAGGSA-N 253.298 2.326 10 10 CECE CC(C)CN1CC[C@H](N[C@H](C)c2cc(O)ccc2O)C1 2160041608 VSUDLROEAOQXTB-OLZOCXBDSA-N 278.396 2.479 10 10 CECE CN(Cc1ccccc1O)CC(C)(C)C(N)=S 2017502408 LHCNHCKTDIWOBQ-UHFFFAOYSA-N 252.383 2.136 10 10 CECE Cc1cc(N2CC(COC(F)(F)F)C2)ccc1CCN 2156333889 FWZPJZXYLNDAKU-UHFFFAOYSA-N 288.313 2.469 10 10 CECE CCN(CC(=O)c1ccc(O)c(O)c1)Cc1ccco1 50153883 ZUKXNQCRKLWNAG-UHFFFAOYSA-N 275.304 2.396 10 10 CECE C[C@H]1C[C@H](CCOC(=O)COc2ccc(N)cc2)CO1 2159293408 FHJSWWITZKTQOU-RYUDHWBXSA-N 279.336 2.006 10 10 CECE CNCc1ccc(N2CCO[C@H]3CCC[C@@H]32)cc1C 50584671 WORUOGHYMGRYOS-HOTGVXAUSA-N 260.381 2.472 10 10 CECE Oc1cccc(CNCc2nc(Cl)cs2)c1O 2020410117 QLLSDPCZFDPQRI-UHFFFAOYSA-N 270.741 2.498 10 10 CECE CCN[C@@H](C)c1ccc(N2CCOCCOCC2)cc1 2159478992 ONPAGEPCVYCPEK-AWEZNQCLSA-N 278.396 2.210 10 10 CECE COc1ccc(N2C[C@@H]3CSC[C@@]3(C)C2)c(N)c1 2028154134 HZKFFQDBMQCVLX-QMTHXVAHSA-N 264.394 2.467 10 10 CECE OCc1ccc(N2CC[C@H]3COCC[C@H]32)c(Cl)c1 2028367725 ZKJBZCXOBUDEBB-WCQYABFASA-N 267.756 2.448 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H]2CO)cc1Cl 2031687402 WQMGIAXFJZRCFY-CYBMUJFWSA-N 268.788 2.409 10 10 CECE CC1=CCC[C@H](C)[C@@H]1[C@H](NCCN=[N+]=[N-])C(=O)O 2039431818 IPOVWVOCNGXLLN-AXFHLTTASA-N 252.318 2.332 10 10 CECE C=C(Cl)C(=O)N(C)Cc1ccc(N(C)C)cc1 401208369 LGEGRHHZTYZOJS-UHFFFAOYSA-N 252.745 2.464 10 10 CECE Nc1ccc(NC(=O)CN2CCC3(CCC3)CC2)cc1 308732245 AMJYCZIWZUGGBB-UHFFFAOYSA-N 273.380 2.473 10 10 CECE CN(C)C[C@H]1CCCCN1c1ccc(CN)cc1F 405050648 VHFOIMXYOLYXHG-CYBMUJFWSA-N 265.376 2.205 10 10 CECE C[C@@H](N[C@H]1C[C@H](n2ccnc2)C1)c1ccc(O)cc1O 2159857377 ADOAUOCSHHFOOT-IJLUTSLNSA-N 273.336 2.349 10 10 CECE CN(C[C@H]1CCc2nccn2C1)c1ccc(CO)cc1 2159893984 AQFAFZZXHJEWOI-CQSZACIVSA-N 271.364 2.074 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@@]2(CCNC2)C1 311364122 PNTGYMSBGNGSPT-IAQYHMDHSA-N 264.344 2.278 10 10 CECE CCN(c1ccc(CN)c(F)c1F)C1CCN(C)CC1 2158707538 YDKABUOCKFBPNP-UHFFFAOYSA-N 283.366 2.344 10 10 CECE CNCc1ccc(N2CCC[C@H]2c2noc(C)n2)cc1 2160442079 MVYFCSIXHUKJDB-AWEZNQCLSA-N 272.352 2.439 10 10 CECE COc1cccc(O)c1CN1CCC[C@H]1[C@H]1CCCN1 2160722575 GSXVNAWZLFFDKO-KGLIPLIRSA-N 276.380 2.117 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CCC[C@H]1N(C)C 2160711867 FJBIFKKMQQEJJO-GXTWGEPZSA-N 278.396 2.221 10 10 CECE Cc1cc(CSc2nccs2)cc(NN)n1 320908607 GIUFZLRBYYRVBF-UHFFFAOYSA-N 252.368 2.424 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@]2(C(=O)O)C[C@@H]2C1 2161286962 OPDHOEJUHIVHBU-FCHSOHFDSA-N 279.311 2.389 10 10 CECE CCN1CCc2cc([C@H](N)c3ncncc3C)ccc21 2175650327 DTVZVICFTMUTFI-HNNXBMFYSA-N 268.364 2.216 10 10 CECE CN[C@H](C)c1ccc(N2CCOC[C@@H]2C(F)F)cc1O 2175653919 MPOBULLVCQNDRI-BXKDBHETSA-N 286.322 2.143 10 10 CECE OC[C@H]1CCC[C@H]1CNCc1ccc(F)c(F)c1O 703363543 HCRQJBNPAQQXBY-GXSJLCMTSA-N 271.307 2.169 10 10 CECE C[C@@H]1CCC[C@@H]1N(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2N 690926853 WPSJSTCAORWOBB-RIEGTJTDSA-N 273.380 2.288 10 10 CECE CCc1cccc(CNCCc2cncn2C)c1O 691473057 GOSBXWUQTBNISP-UHFFFAOYSA-N 259.353 2.020 10 10 CECE CNC(=O)[C@H](CC(C)C)N[C@@H]1CCc2cccc(O)c21 380507412 OTKXBKSXILFNRG-OLZOCXBDSA-N 276.380 2.130 10 10 CECE CCN1CC[C@H]1CNCc1cccc(Br)c1O 712606705 NTHQHPNNLDXQLH-NSHDSACASA-N 299.212 2.339 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CCOC2(C)C)cc1 381311971 QEHCFSDNFRAROM-OAHLLOKOSA-N 264.369 2.028 10 10 CECE CO[C@H]1C[C@](N)(c2ccc3c(c2)CCN3C)C12CCC2 2163071114 LVBDBOMLYYTGGM-RDJZCZTQSA-N 272.392 2.422 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H](C)C(C)(C)O)cc1O 382779762 CPCAHMIYDWFBGK-UWVGGRQHSA-N 252.358 2.008 10 10 CECE CN1CCCc2cc([C@H](O)[C@]34CC[C@H]3CCN4)ccc21 2163103529 VCRXGYIUDILRTE-XIRDDKMYSA-N 272.392 2.245 10 10 CECE CN1CCCc2cc(N3CCC4(CC3)CNC4)ccc21 2163110224 GZCFVSCIOGRKEO-UHFFFAOYSA-N 271.408 2.259 10 10 CECE CC(C)OCCCN(C)CC(=O)c1ccc(O)c(O)c1 382983274 UGFFTCBXHNZZTI-UHFFFAOYSA-N 281.352 2.027 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](O)C1CCCC1 2163136516 UFWMNQCULPNYQI-SJORKVTESA-N 274.408 2.491 10 10 CECE C[C@H]1NC(=O)CC[C@@H]1Nc1c(N)cccc1Cl 392852560 FRTKABSMPBICFO-XCBNKYQSSA-N 253.733 2.001 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H](O)c3cscn3)ccc21 2163229753 LRKSUEUYIVNTBR-GJZGRUSLSA-N 289.404 2.259 10 10 CECE COC[C@H]1CCCN1c1ccc(CN)c(F)c1F 696541800 RKCQEARUIBQHSB-SNVBAGLBSA-N 256.296 2.039 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccnc(Cl)n2)C1 723318899 SIMNNGZNECEFGH-SSDOTTSWSA-N 266.692 2.045 10 10 CECE Fc1cc(CNC2CC2)ccc1N1C[C@@H]2CCO[C@H]2C1 2172043049 ALZBGDWLUZXHAW-LRDDRELGSA-N 276.355 2.303 10 10 CECE CNCc1ccc(N(C)[C@@H](C)C[S@@](C)=O)c(Cl)c1 398926672 DJMQGGIKXXYWLA-XTZNXHDOSA-N 288.844 2.263 10 10 CECE C[C@H]1CCc2nc(C(=O)Nc3ccc(O)c(O)c3)cn2C1 2063461945 ZRQSJJANWMIPRQ-VIFPVBQESA-N 287.319 2.129 10 10 CECE CCCNCc1ccc(N2CC(N(C)C3CC3)C2)cc1 2172998925 DXOVZCMRBPDDSI-UHFFFAOYSA-N 273.424 2.469 10 10 CECE Oc1cccc(CN[C@H]2CCCN(C3CCC3)C2)c1O 2173054486 PRXCBRBYVJTZIA-ZDUSSCGKSA-N 276.380 2.204 10 10 CECE COc1ccc(CNC[C@H]2CC3(CCC3)CO2)c(O)c1 2166407218 FMSFFZPDARQFPV-CQSZACIVSA-N 277.364 2.450 10 10 CECE CCOC1([C@@H](NN)c2ccc3c(c2)CCN3CC)CC1 2166560563 ZOYRUYJNSQUADM-HNNXBMFYSA-N 275.396 2.143 10 10 CECE Oc1ccc(CNc2ccc3nsnc3c2)c(O)c1O 2177212788 QEGUOTBGFACAJL-UHFFFAOYSA-N 289.316 2.420 10 10 CECE COc1ccc(O)c(Cn2cc(Cl)c(O)n2)c1 2070598774 CPEPVYKUMNSSCN-UHFFFAOYSA-N 254.673 2.005 10 10 CECE CO[C@H]1CC(CNCc2cc(C)ccc2O)C[C@@H]1OC 2174847666 WFFPLABBRKHNLS-HOTGVXAUSA-N 279.380 2.230 10 10 CECE CO[C@H]1CC[C@H](CN(C)CCOc2ccc(N)cc2)C1 2174863380 UXCKKBSZJUNBQR-BBRMVZONSA-N 278.396 2.395 10 10 CECE C[C@@H](O)c1ccc(N(C)C2C[C@H]3C=C[C@@H](C2)O3)cc1O 2175071964 UKUJEWUYMKPFEX-NDNKKMJESA-N 275.348 2.368 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H]2CN3C(C)C)ccc1CCN 2187597833 YJKCHGVSYFXAKU-IRXDYDNUSA-N 273.424 2.168 10 10 CECE C[C@H]1[C@@H](NCc2ccc3c(c2)CCO3)C2CCN1CC2 2192784130 HVOIQESODZIRNF-YVEFUNNKSA-N 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CECE CCc1cccc(CNC[C@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)c1O 2353916982 ANKJIQKCHVKHTO-LFYQSXPISA-N 273.376 2.468 10 10 CECE N[C@H]1C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc2c(c1)CCCO2 2354674749 QQXQWWUAVUCIMK-VGWMRTNUSA-N 272.392 2.227 10 10 CECE N[C@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1ccc2c(c1)CCCO2 2354674750 QQXQWWUAVUCIMK-YHUYYLMFSA-N 272.392 2.227 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2C[C@@H]3C[C@H]2[C@H]2C[C@H]32)cc1 2355282522 MNXGGNFDAFEQJQ-YPUPRDRTSA-N 270.376 2.362 10 10 CECE CN(C)c1ccc(CNc2cc(=O)n3ccccc3n2)cc1 10810068 CZNCBMFUDMKURW-UHFFFAOYSA-N 294.358 2.373 10 10 CECE C[C@@H](N[C@H](CO)Cc1ccccc1)c1cc(O)ccc1O 63218204 PNYNWXPAIZFHNC-OCCSQVGLSA-N 287.359 2.352 10 10 CECE C[C@@H](O)CN(C)c1ccc([C@@H](C)N)cc1Br 61698178 XQXADTCGIVWLID-RKDXNWHRSA-N 287.201 2.286 10 10 CECE COc1ccc([C@H](NC[C@H](C)O)c2ccccc2)c(O)c1 35601797 FVOOJGHQNXNLBL-YVEFUNNKSA-N 287.359 2.461 10 10 CECE O=[N+]([O-])c1ccc(O)c(CNc2nnc(C3CC3)o2)c1 181510210 XHPGCGLPQRCMIT-UHFFFAOYSA-N 276.252 2.173 10 10 CECE CC(C)[C@@](C)(N[C@@H](C)c1cc(F)ccc1O)C(N)=O 311699853 QBOVPUQJFWVTEI-LKFCYVNXSA-N 268.332 2.082 10 10 CECE CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 71198917 JTDNDMHJZLQWFQ-JTQLQIEISA-N 256.296 2.476 10 10 CECE NCCCN(C(=O)c1cccc(O)c1O)C1CCCCC1 125936559 IFAXMQQPSPUEHY-UHFFFAOYSA-N 292.379 2.222 10 10 CECE C[C@@H]1CSCCN1CCOc1ccc(N)cc1 70219176 KNZCTYBLMRQFSE-LLVKDONJSA-N 252.383 2.085 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(C)CCCCN1 133209742 WEVPTFPBOFATNG-KRWDZBQOSA-N 289.423 2.243 10 10 CECE CN(c1ccc(CN)cc1Br)C(C)(C)CO 133279727 WKAGJOKNXZFOIM-UHFFFAOYSA-N 287.201 2.115 10 10 CECE CS(=O)(=O)c1ccc(OCCCN=[N+]=[N-])cc1 42416327 CTSLZEQUMNZIRK-UHFFFAOYSA-N 255.299 2.169 10 10 CECE CC1(C)CN(C(=O)c2ccc(O)c(O)c2)CCS1 226998759 XFBMMKMEAKBNPB-UHFFFAOYSA-N 267.350 2.065 10 10 CECE CC(C)CC[C@@](C)(O)CNC(=O)c1cccc(O)c1O 193100349 DILDSTSKCWXPQV-OAHLLOKOSA-N 281.352 2.015 10 10 CECE C[C@H](NC[C@H]1CCCOC1)c1c(O)cccc1O 235520365 MPEHOTUNQQNDOS-WDEREUQCSA-N 251.326 2.175 10 10 CECE COCCNCc1ccc(N2C[C@@H]3CC[C@H](C2)O3)cc1C 90906698 RVDPHVBZOMWPAD-CALCHBBNSA-N 290.407 2.099 10 10 CECE CCN(CC)[C@H](CN)c1ccc2c(c1)CCCN2C 50287004 ANBDSMAKOZVIQA-MRXNPFEDSA-N 261.413 2.411 10 10 CECE CNCc1ccc(N2CCC[C@H](OC)C2)c(F)c1 230286699 VBFBOVHFXOLXSO-LBPRGKRZSA-N 252.333 2.160 10 10 CECE COc1ccc(C(=O)[C@H](N)C(C)C)c2ccn(C)c12 606596093 IUOANELMSWYESH-CYBMUJFWSA-N 260.337 2.353 10 10 CECE CCOC(=O)[C@@H](N)c1cc(C)cc(Br)c1O 259770603 ALIWEDKKZRQARD-VIFPVBQESA-N 288.141 2.026 10 10 CECE CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@]2(CCOC2)O1 370210475 QEFFUGOZUBLGDK-WBVHZDCISA-N 291.391 2.471 10 10 CECE COC(=O)C1(CN[C@@H](C)c2cc(OC)ccc2O)CC1 289929869 YXTBWFNLVFFURH-JTQLQIEISA-N 279.336 2.005 10 10 CECE COc1cc(CNCc2ccc(O)c(O)c2)cc(C)n1 2167037082 HURZISJAGJKQSJ-UHFFFAOYSA-N 274.320 2.100 10 10 CECE N[C@@H]1CC[C@@H]2CN(c3ccc4c(c3)OCCCO4)C[C@@H]21 2162628595 BMDUHRZRJCPDCQ-KWCYVHTRSA-N 274.364 2.021 10 10 CECE COC[C@]12CN(c3ccc([C@@H](C)N)c(O)c3)C[C@]1(C)C2 2165473408 YNLBUVJGLYGTHB-RLCCDNCMSA-N 276.380 2.275 10 10 CECE CCN1CCc2cc([C@H](NC)[C@](C)(O)C(F)F)ccc21 2163140485 JNECOQVIETXPPU-ZFWWWQNUSA-N 284.350 2.346 10 10 CECE O=C(O)[C@H](O)c1ccc2c(O)csc2c1S 396375192 MNJHVAQLUWCBOQ-SSDOTTSWSA-N 256.304 2.014 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@H]1NCC[C@@H]1C 2164032343 XPYQNEVOAFKCNL-JCURWCKSSA-N 273.424 2.328 10 10 CECE CC[C@H](O)[C@@H](N)c1c(O)c(Br)cc(F)c1F 713826867 IHOZGGDCZMXQOT-IMTBSYHQSA-N 296.111 2.204 10 10 CECE COCCN1CCC[C@@H](Nc2c(N)cccc2Cl)C1 399370510 KKUMKSHCZXDBEW-LLVKDONJSA-N 283.803 2.445 10 10 CECE CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4ccc(N)cc4)[C@H]1[C@H]3C2 394319837 CKLWJKFAWWGCKX-PTNZTPPNSA-N 258.365 2.124 10 10 CECE COc1ccc(N(C)Cc2cc(OC)ns2)c(N)c1 722384518 XVBMTPGMSBZHRB-UHFFFAOYSA-N 279.365 2.379 10 10 CECE NCc1ccc(N2CC[C@H]3CC[C@H](O)[C@H]2C3)c(F)c1F 722203209 GXHCTRQEEHBBDY-WQAKAFBOSA-N 282.334 2.163 10 10 CECE C[C@@]1(CO)CCCCN1C(=O)Nc1ccc(N)cc1 723018934 ZSUFPELITONXBR-AWEZNQCLSA-N 263.341 2.038 10 10 CECE Cc1cc(C)c([C@@H](C)NC2CC(CC(N)=O)C2)c(O)c1 903261335 WVQJHAAWHNZSNC-PNESKVBLSA-N 276.380 2.314 10 10 CECE C[C@H](CC(=O)NCc1ccc(N)cc1)n1cccc1 837302760 FSHJDJCGMZUDBP-GFCCVEGCSA-N 257.337 2.338 10 10 CECE CCN(C)c1ccc([C@@H](C)NC2CC(CC(N)=O)C2)cc1 903259320 DNILZTVVPJWQGO-DNOWBOINSA-N 289.423 2.447 10 10 CECE CC1(C)CN(Cc2c(O)cccc2Cl)[C@@H]2COC[C@H]2O1 846117829 HFNGPMLCSJQKHW-TZMCWYRMSA-N 297.782 2.424 10 10 CECE Oc1cc2c(cc1CN1CC[C@@H]3OCC[C@@H]3C1)CCC2 842623656 XLJOEYPAIMMSIK-PBHICJAKSA-N 273.376 2.492 10 10 CECE CC[C@@H](NC[C@H]1CN(C2CC2)C(=O)O1)c1ccccc1O 844313015 PQQFNDNHZGFSAY-GXTWGEPZSA-N 290.363 2.416 10 10 CECE CO[C@H](CN(C)c1ccc([C@@H](C)N)c(O)c1)C1CC1 692268826 FIYDHORSCCFUDT-MEBBXXQBSA-N 264.369 2.273 10 10 CECE Oc1ccc(-c2noc(CNCc3ccccc3)n2)cc1O 692429859 LWWAVCWFBLLUGO-UHFFFAOYSA-N 297.314 2.438 10 10 CECE Nc1cccc(Br)c1N[C@@H]1CCOC1 697513412 SEEMMGJKIQWRHX-SSDOTTSWSA-N 257.131 2.232 10 10 CECE C[C@@H]1C[C@H]2CN(Cc3ccc(F)cc3O)CCN2C1 1876166557 BEOPJYPIJQQPLK-RISCZKNCSA-N 264.344 2.057 10 10 CECE Oc1ccc2ccccc2c1CN[C@@H]1COC[C@@H]1F 1876140233 OKZFQMYYMNZYMA-UONOGXRCSA-N 261.296 2.372 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3C(C(F)F)[C@@H]3C2)cc1O 1877071862 LUIXMVIBMNYRME-WHGOUJPWSA-N 269.291 2.393 10 10 CECE C[C@H](NC(=O)N[C@@H](C)[C@H](C)CO)c1ccc(N(C)C)cc1 776148824 VVMLNCKHPGMQSO-AGIUHOORSA-N 293.411 2.130 10 10 CECE C[C@@H]1CO[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)C1 888578340 MTEZSIYZCCMOPR-LRDDRELGSA-N 288.391 2.110 10 10 CECE C[C@]1(C(=O)N2CCC(CN=[N+]=[N-])CC2)CCCCO1 1908024808 LBMWDFBZOWLWMB-CYBMUJFWSA-N 266.345 2.495 10 10 CECE COc1ccc(O)c(CNCC23CC(C2)[C@@H](C)O3)c1 1878455170 WLGZAYOLNVJTEL-CKQAKLJMSA-N 263.337 2.058 10 10 CECE C[C@H]1CC[C@](C)(NS(=O)(=O)Cc2ccc(N)cc2)C1 1878809274 XFJQUNULTVWBMP-FZMZJTMJSA-N 282.409 2.267 10 10 CECE CN(C)c1ccc(CNC2(CO)CC2)c(C(F)(F)F)c1 793059568 SUERZNGOPKXHCS-UHFFFAOYSA-N 288.313 2.386 10 10 CECE C[C@H](O)c1cc(F)c(N2CCC[C@H]2[C@H](C)O)c(F)c1 1880484595 GVLGIPHAFBRKRQ-RVBZMBCESA-N 271.307 2.368 10 10 CECE C[C@H](O)c1cc(F)c(N2CCC(C)(O)CC2)c(F)c1 1880478341 DVMWPZKIYBEABZ-VIFPVBQESA-N 271.307 2.369 10 10 CECE CN(CCc1ccc(N)cc1)C[C@]12CCOC[C@@H]1C2 1880538417 WKSMLQRPLDBNPP-GOEBONIOSA-N 260.381 2.170 10 10 CECE CCCN(CC(=O)N(C)C)[C@@H](C)c1ccccc1O 133664732 UMPKSNLCXFFHPX-LBPRGKRZSA-N 264.369 2.253 10 10 CECE Nc1ccc(OCC(=O)O[C@H]2CCCC2(F)F)cc1 1888320913 LIVHXEHWIKVZJZ-NSHDSACASA-N 271.263 2.379 10 10 CECE Oc1cccc(F)c1CNCCCOC[C@@H]1CCCO1 1964022990 ZZJAPXTUZOXZPN-LBPRGKRZSA-N 283.343 2.207 10 10 CECE CC[C@H]1COCCN1c1ccc(CN)c(Cl)c1 61845877 SWKXWSQMTPIZEK-NSHDSACASA-N 254.761 2.414 10 10 CECE Cc1cc(CN[C@@H](C)c2cc(F)ccc2O)nn1C 1964458282 UOSXTXJONUZKLZ-JTQLQIEISA-N 263.316 2.424 10 10 CECE CC(C)N(CC(=O)NCCCN=[N+]=[N-])C(=O)OC(C)(C)C 1963697821 FNWHFEMXWMCYTQ-UHFFFAOYSA-N 299.375 2.449 10 10 CECE COc1cc2c(cc1Cl)N(CC(=O)O)C[C@H](C)C2 84173539 XRCIGYAKWMELBR-MRVPVSSYSA-N 269.728 2.432 10 10 CECE CC(=O)c1ccc(C(=O)NCc2cccc(O)c2O)cc1 1176565991 QVZHLOIITGOCNJ-UHFFFAOYSA-N 285.299 2.230 10 10 CECE C[C@@H]1[C@H](OCCc2ccc(N)cc2)C2CCN1CC2 1893430317 FPVWYDYRZJRVKX-WBMJQRKESA-N 260.381 2.311 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1ccnn1[C@@H]1CC1(F)F 1964942467 CPPXVXPIRDWZEV-SECBINFHSA-N 284.270 2.284 10 10 CECE CCC[C@H]1CN(c2ccc(CN(C)C)cc2)CCN1 689490388 FRNFVMWQEQDFDM-HNNXBMFYSA-N 261.413 2.327 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1COc2ccccc21 692843198 WPMINBHIBQFLTC-CMPLNLGQSA-N 272.308 2.464 10 10 CECE CCCc1nc(SCC(=O)Nc2ccc(N)cc2)n[nH]1 713458260 YIKGXQCIYQSJMK-UHFFFAOYSA-N 291.380 2.070 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H]2CNC[C@@H](C2)C1 719049049 HTWSIGMCYKLNCK-IJLUTSLNSA-N 264.344 2.134 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2n[nH]c3ccccc23)C1 694029501 RZCGCEATMFNAFV-VIFPVBQESA-N 270.296 2.478 10 10 CECE CC[C@H](O)c1ccc(N(C)C[C@H]2CCCS2(=O)=O)cc1 694130062 CTLGZNSTEQICMG-CABCVRRESA-N 297.420 2.143 10 10 CECE CC[C@H](O)c1ccc(N2CC(N3CCCC3)C2)cc1 697795393 YRIYZIYTDQMRSR-INIZCTEOSA-N 260.381 2.414 10 10 CECE CCC1CN(CCCC(=O)Nc2ccc(N)cc2)C1 697969908 WYXLOBVWMVSYIS-UHFFFAOYSA-N 261.369 2.329 10 10 CECE CC(C)[C@H]1CCCN1CC(=O)Nc1ccc(N)cc1 88835326 ZNTWIRCYUHQRKM-CQSZACIVSA-N 261.369 2.328 10 10 CECE C=CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1262555643 BKUPQVQQDBGQFA-UHFFFAOYSA-N 299.418 2.021 10 10 CECE CCO[C@@H]1CC[C@@H](C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2118209010 AOOLERWYEFMSPY-IJLUTSLNSA-N 266.345 2.493 10 10 CECE COc1ccc2c(c1)S[C@H](CC(=O)O)[C@H](C)N2C 215613187 JFZLBXWXXNEVCH-GZMMTYOYSA-N 267.350 2.469 10 10 CECE Cc1cc(N2CC=C[C@@H]2CO)ccc1CNC(C)C 2119806958 JVCHHBKCHIWEEI-MRXNPFEDSA-N 260.381 2.230 10 10 CECE CN(CC1CCCC1)S(=O)(=O)Cc1ccc(N)cc1 104352402 SPGLDHXASGVVIP-UHFFFAOYSA-N 282.409 2.221 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H](C3)[C@H]2CO)cc1Cl 2122159270 CIMQBUCGVQBZOP-ITDIGPHOSA-N 280.799 2.409 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@@H]1OCC[C@@H]1F 2122526636 SQXYTOYKYQALIW-ZFWWWQNUSA-N 264.344 2.025 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1Cc1nnc2ccccn12 2123008939 NWNKYOGIEWKWTA-JTQLQIEISA-N 257.301 2.004 10 10 CECE COc1ccc(CNC(=O)c2cccc3c2OCC3)c(O)c1 1633927288 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CCC[C@](N)(C(=O)O)c1ccc(Br)cc1O 713786234 XAAZCQQPTJKGAG-LLVKDONJSA-N 288.141 2.193 10 10 CECE CC[C@H](C)[C@H](c1c(O)cccc1OC)N1CCNCC1 575290087 VMQXVEXRRRMOEJ-BLLLJJGKSA-N 278.396 2.393 10 10 CECE CO[C@@]1(CO)CCCN(Cc2cc(Cl)c(C)cc2O)C1 826952974 YFSDSDKQQZYGAH-HNNXBMFYSA-N 299.798 2.327 10 10 CECE COc1ccc(CNC[C@@]2(C)CCCOC2)c(O)c1 2133531159 VLJOGSBEHLTSQV-OAHLLOKOSA-N 265.353 2.307 10 10 CECE N[C@H]1CCCCCC[C@H]1C(=O)NCc1ccccc1O 828015777 MPLCFSFCLHDDLU-KGLIPLIRSA-N 276.380 2.306 10 10 CECE CCOc1cccc(CN2CC[C@@H](CO)[C@@H]2CC)c1O 824637505 XOCVIVVDBKNGJZ-KBPBESRZSA-N 279.380 2.384 10 10 CECE CCOc1cccc(NC(=O)c2cc(O)c(O)c(O)c2)c1 586735696 ZFXDVXUIRDLQOA-UHFFFAOYSA-N 289.287 2.454 10 10 CECE CC[C@@H]1COCCN1Cc1cc2c(cc1O)CCC2 738085152 QADUQESTTOBJQG-OAHLLOKOSA-N 261.365 2.492 10 10 CECE CCc1n[nH]cc1C(=O)NCc1ccc(N(C)C)cc1C 734467744 AQXHCPAXWZGSFB-UHFFFAOYSA-N 286.379 2.277 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@]12CCCC[C@H]1C2 910957627 TZONLGLACOWIMD-XHDPSFHLSA-N 261.321 2.294 10 10 CECE 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C[C@H](N)c1ccc2c(c1)CCN2CCO[C@@H]1CC1(F)F 689041070 PCDQAUYSFIZBPT-IINYFYTJSA-N 282.334 2.493 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCC[C@H]3C3CC3)cc21 706449981 OWOVFGYYXLAVMZ-DZGCQCFKSA-N 272.348 2.075 10 10 CECE CCC1(O)CCN(c2ccc(CO)cc2F)CC1 707232217 LQAMFOQAEXLTEL-UHFFFAOYSA-N 253.317 2.059 10 10 CECE Nc1ccc(CN2CCO[C@H](C(F)(F)F)C2)cc1 698732734 CKGPVHKAPZVAGT-NSHDSACASA-N 260.259 2.032 10 10 CECE CCCN(c1ccc(N)cc1)S(=O)(=O)N(CC)CC 63115513 DRMFIHNOJDQHGT-UHFFFAOYSA-N 285.413 2.072 10 10 CECE CC(C)[C@@H]1C[C@@H](NCc2ccc(O)cc2O)CO1 691449956 MQZZALMIIQPEGK-RISCZKNCSA-N 251.326 2.001 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])[C@H]1CC2CCC1CC2 691534422 NHERMANNAWQYSO-QQFIATSDSA-N 266.345 2.254 10 10 CECE COCC1(CN[C@@H](C)c2ccc(OC)cc2O)CC1 691798506 KKWAHPBPLIXKSI-NSHDSACASA-N 265.353 2.478 10 10 CECE Cc1cc(CO)ccc1N(C)[C@H]1CN(C)C(C)(C)C1 694140315 FJDFBMNFPFGNFU-CQSZACIVSA-N 262.397 2.406 10 10 CECE Nc1ccc(N2C(=O)NC3(CC4(CCC4)C3)C2=O)cc1 694233718 YLTZZMIJMICGPF-UHFFFAOYSA-N 271.320 2.028 10 10 CECE Cc1ccc(O)c(CN(CCC(=O)O)CC2CC2)c1 717175411 RTTSSTUIUIRGFX-UHFFFAOYSA-N 263.337 2.387 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)[C@@H]1C[C@H](C)CO1 718408192 STBNEVQMGFAWQL-WFASDCNBSA-N 276.380 2.431 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H](C(C)(C)O)C2)cc1O 719662131 RMTXGTBFGQYNOO-NEPJUHHUSA-N 278.396 2.399 10 10 CECE C[C@H]1C[C@H](N(C)c2ccc(CN)cc2F)CCO1 721397369 AJDBUKCRRCIXGW-CMPLNLGQSA-N 252.333 2.288 10 10 CECE COc1ccc(CNC[C@@H]2CCCC[C@@H]2CO)c(O)c1 89503009 QVROYEAYVSWDIN-GXTWGEPZSA-N 279.380 2.289 10 10 CECE CCC[C@H]1COC[C@]1(CN)N(C)c1ccc(OC)cc1 699430502 IOYLWEPWFVFMRC-BBRMVZONSA-N 278.396 2.275 10 10 CECE CCC[C@@]1(C(=O)O)CCN(Cc2ccc(O)c(O)c2)C1 86782471 ZEEJHXJUUPJUKM-OAHLLOKOSA-N 279.336 2.175 10 10 CECE C[C@@H]1C[C@H](CN(C)CCOc2ccc(N)cc2)[C@@H](C)O1 686383238 QJSIJOOUUVEALN-MGPQQGTHSA-N 278.396 2.393 10 10 CECE CCN1CCC[C@H]1CN(C)c1ccc(CNC)cc1F 92633243 QXENJJBQGQISMA-AWEZNQCLSA-N 279.403 2.466 10 10 CECE CN(C)c1ccc(/C=C/CNCc2csnn2)cc1 1331955637 ZNGUVLAVOQWOGZ-ONEGZZNKSA-N 274.393 2.407 10 10 CECE Cc1cc(CN(C)C(=O)Nc2ccc(N)cc2)no1 2115103437 NILWCQSHLGNPDG-UHFFFAOYSA-N 260.297 2.229 10 10 CECE Cc1sc(Cl)nc1C(=O)NCc1cc(O)ccc1O 1455357520 SCROVWOPPJZRDD-UHFFFAOYSA-N 298.751 2.446 10 10 CECE COc1cc(Cl)cc(CN[C@H]2C=C[C@@H](OC)C2)c1O 2119393500 KNJFITOXAXADCW-NWDGAFQWSA-N 283.755 2.487 10 10 CECE C[C@@H]1C[C@@H](CO)CN(c2cc(Cl)c(CN)cc2F)C1 2120879789 QKKAGHSEDKRSLY-NXEZZACHSA-N 286.778 2.393 10 10 CECE COc1ccc(CNC(=O)Cc2ccc(C=O)cc2)c(O)c1 1617754052 XCHVBDUOYCTXHN-UHFFFAOYSA-N 299.326 2.072 10 10 CECE CN1CCCc2cc3c(cc21)C[C@@H](CC(=O)O)CO3 211902483 YUKWRPKXGIMHEG-JTQLQIEISA-N 261.321 2.095 10 10 CECE CNCc1ccc(N(C)C[C@H]2OCC[C@H]2F)c(F)c1 2122546675 BBVGFNXBMIHAOH-BXUZGUMPSA-N 270.323 2.108 10 10 CECE O=C(NCc1ccc(O)c(O)c1)c1ccc(Cl)[nH]1 1566359960 TVOPGDALQJNPDJ-UHFFFAOYSA-N 266.684 2.009 10 10 CECE C[C@@H](NC(=O)CN1CCC(N=[N+]=[N-])CC1)c1ccco1 1912169739 OHKQFPQUACLAMP-SNVBAGLBSA-N 277.328 2.232 10 10 CECE CCC[C@H](C(=O)OCC)N1CC[C@H](CN=[N+]=[N-])C1 1912168111 RTIRYEKXKXERPH-GHMZBOCLSA-N 254.334 2.350 10 10 CECE Cc1cccc(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)c1O 1912194212 JOJMTHCJNFDZBO-JTQLQIEISA-N 260.297 2.473 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)c2cccnc2Br)C1 1912159049 CEWUPHQPALVZDX-SSDOTTSWSA-N 296.128 2.369 10 10 CECE [N-]=[N+]=NCCCCn1ncc(N2CCCCC2)cc1=O 1912168765 GAUZQOAJYLCWAQ-UHFFFAOYSA-N 276.344 2.324 10 10 CECE CN1CCc2cc(CN3C[C@H](CN)C(C)(C)C3)ccc21 1913114092 CJJYSGPVJAMTDR-HNNXBMFYSA-N 273.424 2.096 10 10 CECE CN1CC[C@H]2[C@@H]1CCCN2Cc1cc(F)ccc1O 2127340996 GVFJNQZMCQQNBM-KBPBESRZSA-N 264.344 2.200 10 10 CECE CN[C@H]1CCCc2cc(N(C)CCN(C)C)ccc21 2128279067 KVPOTMNWMBRFHF-INIZCTEOSA-N 261.413 2.281 10 10 CECE O[C@@H]1CCN(c2ccc3c(c2)CC[C@H]3O)C2(CC2)C1 2128315661 VCIUFKRRRICWDD-UKRRQHHQSA-N 259.349 2.160 10 10 CECE OC[C@@H]1CC2(CC2)CN1c1ccc2c(c1)CC[C@@H]2O 2128320479 DFDGCQFTNDAIOL-ZFWWWQNUSA-N 259.349 2.017 10 10 CECE OC[C@H]1CC2(CC2)CN1c1ccc2c(c1)CC[C@H]2O 2128324376 DFDGCQFTNDAIOL-UKRRQHHQSA-N 259.349 2.017 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCSC)cc1O 167635710 AOSOFNCUUGLKAT-JTQLQIEISA-N 254.399 2.472 10 10 CECE CCN(C)c1ccc([C@@H](C)NCc2ncnn2C)cc1 152946979 WMKMMNBXNSXFKS-GFCCVEGCSA-N 273.384 2.122 10 10 CECE Cc1ccc(CC(=O)NCCc2ccc(O)c(O)c2)s1 156680276 YMZYRZCBLPZEBA-UHFFFAOYSA-N 291.372 2.369 10 10 CECE COc1cccc(O)c1CNCCc1ncoc1C 2128987992 AFZRPJXAWLYPEL-UHFFFAOYSA-N 262.309 2.030 10 10 CECE NC[C@@H](c1ccc(O)cc1O)N1CCc2ccccc2C1 33442204 FBZRLRIVABBMAE-INIZCTEOSA-N 284.359 2.156 10 10 CECE Cc1cocc1CN(C)C(=O)c1cccc(O)c1O 2129915042 GVEZPCFCTTUAAS-UHFFFAOYSA-N 261.277 2.271 10 10 CECE Cc1sccc1CNC(=O)c1cc(O)c(O)c(O)c1 2132417370 CUZULNGOUDXJDE-UHFFFAOYSA-N 279.317 2.103 10 10 CECE CC(C)[C@H]1C[C@@H]1CN(C)C(=O)c1ccc(O)c(O)c1 2135382859 LVDNAJHWSASESG-VXGBXAGGSA-N 263.337 2.462 10 10 CECE CC(C)[C@H]1C[C@H]1COC(=O)COc1ccc(N)cc1 2135585133 QWPDYXIBPABGSS-SMDDNHRTSA-N 263.337 2.483 10 10 CECE CC(=O)C(=O)[C@@H](O)c1csc(-c2ccc(F)cc2)n1 1919052339 LYHHINVDFNSNJD-LBPRGKRZSA-N 279.292 2.141 10 10 CECE N[C@@H](c1ccccc1O)[C@H](O)c1ccc(Cl)o1 1919788578 LBSGHANZCBYFGP-NWDGAFQWSA-N 253.685 2.372 10 10 CECE Oc1ccc(CNc2ccc3c(c2)OCO3)c(O)c1O 226751729 YAOFKZATCIMALP-UHFFFAOYSA-N 275.260 2.144 10 10 CECE CC(C)[C@@H](C(=O)O)[C@H](N)c1ccc2c(c1)CCN2C 1927695365 MAESNZOKPNOEAH-ZIAGYGMSSA-N 262.353 2.036 10 10 CECE CCNCc1cc(F)c(N2CC[C@H](C)[C@@H](O)C2)c(F)c1 230279984 OZXYXUCMHHNGAM-HZMBPMFUSA-N 284.350 2.281 10 10 CECE COc1cc(N2CC([C@@H]3CC3(F)F)C2)ccc1CN 2139699065 QMCCAETVRMUMGC-LBPRGKRZSA-N 268.307 2.245 10 10 CECE COc1cc(N(C)C[C@H]2C[C@H]2C(F)F)ccc1CN 2139692193 XCOWIETWPFZCAT-ZYHUDNBSSA-N 270.323 2.491 10 10 CECE CC(C)(C)OC(=O)NCC[C@](C)(N)c1ccccc1O 1933869070 IUHCBNCSILLQCK-HNNXBMFYSA-N 280.368 2.481 10 10 CECE Cc1ccc(CN2CC[C@H]3CCC[C@]32CN)c(O)c1 2139774141 PEGRYKBEESFBLC-ZBFHGGJFSA-N 260.381 2.404 10 10 CECE CCCO[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 126329140 MONJLBNWHVXLHN-NSHDSACASA-N 279.336 2.129 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)Cc1nccn1C 235503071 XDXBJUYZABMKOY-JTQLQIEISA-N 261.325 2.024 10 10 CECE C[C@@H]1CCOCCN1c1ccc(CN)c(Cl)c1 1944040910 VRFXUKCNPMTNEQ-SNVBAGLBSA-N 254.761 2.414 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](C)[C@H]2C(N)=O)cc1Cl 2146447533 NXGQGLMBRVHVTE-RBZYPMLTSA-N 295.814 2.321 10 10 CECE CCNCc1ccc(N2C[C@H](C3CC3)[C@@H](O)C2)c(C)c1 2146824064 BUBCATSHEKGIKO-WBVHZDCISA-N 274.408 2.312 10 10 CECE O=C1CCN[C@@H](c2cc(Br)ccc2O)C1 1951738671 YXIKDUBHTRAMAV-SNVBAGLBSA-N 270.126 2.148 10 10 CECE CC(C)n1ncnc1CN[C@H]1CCc2cccc(O)c21 1971544146 JENTWLURNHKLIY-LBPRGKRZSA-N 272.352 2.342 10 10 CECE Cc1cccc(O)c1CN1C[C@H](C(=O)O)C2(CCC2)C1 1972956975 QLBXDTPDIYYYFH-CYBMUJFWSA-N 275.348 2.387 10 10 CECE COc1cccc(CN[C@H]2CCCC[C@H]2CO)c1O 152310438 YSBLFOXBPYGBRA-STQMWFEESA-N 265.353 2.042 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@H]3C[C@@H]32)cc1Br 2004412246 NCEHHKXJFHQGDO-JCOFBHIZSA-N 297.196 2.446 10 10 CECE COC(=O)CCCN(Cc1ccc(N)cc1)C(C)C 35365425 PGCXNZAUEHUSHV-UHFFFAOYSA-N 264.369 2.432 10 10 CECE COC(=O)[C@@H](N[C@@H](C)c1cc(OC)ccc1O)C(C)C 35346459 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2152895824 VECDZXHMWBCNQD-SNVBAGLBSA-N 274.368 2.090 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](O)C2(C)C)c(Cl)c1 2023139675 RHSYWABIAABBJE-UFBFGSQYSA-N 255.745 2.353 10 10 CECE [N-]=[N+]=NC1CN(C(=O)[C@]23CCC[C@@H]2CSC3)C1 2023530624 GNQWQJYLZJACDX-KCJUWKMLSA-N 252.343 2.041 10 10 CECE C[C@H]1COCC[C@@H]1N(C)Cc1cccc(F)c1O 2031919109 KURYJKOVKIWLTF-GWCFXTLKSA-N 253.317 2.388 10 10 CECE NCc1ccc(N2CC[C@H](O)C3(CC3)C2)cc1Cl 2032262616 RGVHYQIQWFTNSV-ZDUSSCGKSA-N 266.772 2.150 10 10 CECE CC1(C)C[C@@H](CO)N(c2ccc(CN)c(Cl)c2)C1 2033712496 SOBYSLFQNLFFAL-LBPRGKRZSA-N 268.788 2.396 10 10 CECE CCc1nc(Sc2ncc(CNC(C)C)s2)n[nH]1 2037795698 ZHYGIIYBUXJVPA-UHFFFAOYSA-N 283.426 2.473 10 10 CECE C[C@@H](O)C[C@H]1CCCN1c1c(F)cc(CN)cc1F 311489591 MUMXYTWAYVALLG-MWLCHTKSSA-N 270.323 2.163 10 10 CECE CCOC(CN[C@H]1CCc2cccc(O)c21)OCC 312088344 OOIJYRGXAFCHJJ-LBPRGKRZSA-N 265.353 2.368 10 10 CECE N[C@H]1C(=O)Nc2cc(N3C[C@H]4CCC[C@@H](C4)C3)ccc21 312198134 DFNYTLVWHVDETM-ZIBATOQPSA-N 271.364 2.265 10 10 CECE 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O=C(C=Cc1ccc(O)c(O)c1)NC1Cc2ccccc2C1 2308935704 AQZIUEVASUUGBK-UHFFFAOYSA-N 295.338 2.395 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@H]1COC2(CCC2)C1 2315990994 SMDSKQQMGJEMOE-SNVBAGLBSA-N 252.318 2.104 10 10 CECE CSc1cc(N2CC[C@H](O)C[C@H]2C)ccc1CN 2328543881 XKIONMKVUCDQEV-MFKMUULPSA-N 266.410 2.217 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H]3C[C@H]2[C@H]2C[C@@H]23)c1 2329258326 ZQZOJIYENDGXRK-ATGSNQNLSA-N 257.333 2.435 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H]3CC[C@@]2(CO)C3)c1O 2329382804 QRNLAPNQKYLFOX-NOLJZWGESA-N 261.365 2.341 10 10 CECE Cc1ccc(O)c(CN[C@@H]2C[C@@H]3CC[C@@]2(CO)C3)c1 2329382206 JOJVYGURSYJUPA-MAZHCROVSA-N 261.365 2.341 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H]2NC[C@@H]3CCC[C@H]23)cc1 2329487156 XRUXGYZLCOEWRQ-QCEMKRCNSA-N 260.381 2.174 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1C[C@@H]2C[C@H]1[C@H]1C[C@@H]21 2330319334 JFAQZPMHBIAUBZ-LFUTUZGBSA-N 258.321 2.423 10 10 CECE Oc1cccc2c1[C@@H](NC[C@@H]1C[C@@H]3C[C@@H]3CO1)CC2 2331054195 YVCRZKIEDDCLMK-CRWXNKLISA-N 259.349 2.394 10 10 CECE 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CCN1CCc2cc([C@@H](O)[C@H]3NCCC3(C)C)ccc21 2163067100 SGROUDLSWQPSQH-HZPDHXFCSA-N 274.408 2.491 10 10 CECE CCN1CCc2cc([C@@](C)(O)c3cn(C)cn3)ccc21 2163068606 JKGPHJAKWWIAHY-MRXNPFEDSA-N 271.364 2.058 10 10 CECE CN[C@@H](COCCOC)c1ccc(N2CCCC2)cc1 2163096073 GRDATLQWTIVTBD-INIZCTEOSA-N 278.396 2.210 10 10 CECE COc1nn(C)cc1CN(C)[C@@H](C)c1ccccc1O 2168064055 NANZTHUKSNMJMM-NSHDSACASA-N 275.352 2.327 10 10 CECE CN(C)c1ccc([C@@H](N)[C@]2(O)[C@H]3C=CC[C@H]2CC3)cc1 2163130354 HBRFGPMFAUJZJW-DIECFANBSA-N 272.392 2.470 10 10 CECE CN(C)c1ccc([C@@H](N)[C@]2(O)CCOC(C)(C)C2)cc1 2163131045 NJEWSPFUCLZPLL-ZBFHGGJFSA-N 278.396 2.073 10 10 CECE C[C@H]1C[C@](N)(c2ccc3c(c2)CCN3C)C[C@@H](C)N1C 2166868548 CCNTUCVBTUJHNX-LAQFHYBYSA-N 273.424 2.336 10 10 CECE CC[C@H]1CCOCC[C@H]1NC(=O)c1cccc(O)c1O 2165380608 DOYOGSKYDJZTQU-CMPLNLGQSA-N 279.336 2.033 10 10 CECE CNCc1ccc(N(C)CC2=CCCOC2)c(C)c1 723163758 BEHITJIUMKKFCV-UHFFFAOYSA-N 260.381 2.497 10 10 CECE Cc1ccncc1CN1CCc2cc(CN)ccc21 2133390040 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CN(CC(=O)Nc1ccc(N)cc1)C[C@H]1CC=CCC1 402525727 HJUNFOVQDUWBEX-ZDUSSCGKSA-N 273.380 2.495 10 10 CECE CCCOc1cc(N2CCN(CCF)CC2)ccc1N 402666540 SPCCWIYFHXTJQP-UHFFFAOYSA-N 281.375 2.149 10 10 CECE COc1cc(N[C@@H]2CCc3cccc(O)c32)nn1C 311880545 NAPOWNYXYHPUGD-SNVBAGLBSA-N 259.309 2.234 10 10 CECE COc1ccc(CN[C@H]2CCOC2(C)C)c(O)c1 328376039 KKILXPONWSQJAL-ZDUSSCGKSA-N 251.326 2.058 10 10 CECE C[C@H](C(=O)NCCN=[N+]=[N-])n1cnc2ccccc21 701274720 BUHAFHDNVDSKNP-SECBINFHSA-N 258.285 2.024 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N(C3CCC3)C3CC3)cc21 2161293440 XHLNGUAFWXNPDK-OAHLLOKOSA-N 272.348 2.218 10 10 CECE CN(C[C@@]12COC[C@@H]1C2(F)F)c1ccc(CO)cc1F 2161871896 QSPUVMATVYMOHR-QWHCGFSZSA-N 287.281 2.036 10 10 CECE Nc1ccc(OCC(=O)N[C@@H]2CCC3(CCC3)C2)cc1 2161859206 DEHLBVROKMVHNO-CYBMUJFWSA-N 274.364 2.487 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2CCN(C)[C@H](C)C2)cc1O 2170391841 CSMKULSMDHCUDW-DYEKYZERSA-N 278.396 2.364 10 10 CECE CCNCc1ccc(N2CCc3c(ncn3C)C2)cc1 2170378603 HXSHBNXORYAUQN-UHFFFAOYSA-N 270.380 2.092 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])CCO[C@@H](C(C)C)C1 90257208 SHBFXZNCUGSFLF-YPMHNXCESA-N 284.360 2.023 10 10 CECE Cc1cccc2c1N(C(=O)C1=CC[C@@H](N)C1)CCC2 702447511 LTAQZGCDQAZNJT-CQSZACIVSA-N 256.349 2.322 10 10 CECE CN(CC1(C)COC1)c1ccc(CN)c(Br)c1 702953717 ZRRMEHHUZROUSB-UHFFFAOYSA-N 299.212 2.381 10 10 CECE C[C@@H](N[C@H]1CCc2nccn2C1)c1cc(F)ccc1O 368327797 MPCGCMGMONRWOZ-PWSUYJOCSA-N 275.327 2.393 10 10 CECE CCOc1cccc(CN2CC[C@H]3COC[C@@H]3C2)c1O 690799648 RNVXJPSXECBTCK-KBPBESRZSA-N 277.364 2.259 10 10 CECE COc1ccc(N(C)[C@@]2(CN)CO[C@H](C3CC3)C2)cc1 691264601 QPUPJBTZDAQVHH-HOTGVXAUSA-N 276.380 2.028 10 10 CECE CCC1(C)CN(CCC(=O)Nc2ccc(N)cc2)C1 381873566 UMBFTKKHTNPWRY-UHFFFAOYSA-N 261.369 2.329 10 10 CECE CC(C)CNCc1ccc(N(C)CCC(N)=O)c(Cl)c1 382052877 DJKUEDHOOMNFMU-UHFFFAOYSA-N 297.830 2.397 10 10 CECE CCC1(N)CCN(c2ccc(OC)cc2[N+](=O)[O-])CC1 714752063 MNZJPDLDEPAFBP-UHFFFAOYSA-N 279.340 2.311 10 10 CECE CCNCc1ccc(N(C)CC23CCN(CC2)C3)cc1 715828934 GSZDTWRIJMZFSP-UHFFFAOYSA-N 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399060176 LIBGGQMUWHLEPB-SNVBAGLBSA-N 254.761 2.271 10 10 CECE CCc1cccc(CN2CCn3ccnc3C2)c1O 821982315 JIGPPHKCYGAFEZ-UHFFFAOYSA-N 257.337 2.167 10 10 CECE C[C@H](N[C@@H]1CC[C@]12C[C@@H]2C(=O)O)c1cc(F)ccc1O 2172493618 AOEHGPDDJSZRKG-DGFVYPATSA-N 279.311 2.435 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H]3C[C@H](C2)C3O)cc1 2172930376 ZXLDIFMALGNYKF-FKEKPDDDSA-N 274.408 2.249 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3OC(=O)N(C)[C@@H]3C2)c(Cl)c1 2176929555 AOUAIPODSZWGSL-BZHVJNSISA-N 296.754 2.033 10 10 CECE COc1ccc(N2C[C@H]3CC[C@@](CN)(C3)C2)c(OC)c1 2176937537 QINDVTHHVDNJKM-LRDDRELGSA-N 276.380 2.269 10 10 CECE CN(CCCC(F)F)c1cc2c(cc1F)[C@H](O)C(=O)N2 2166598727 YYPAXTSJQQJBNQ-LBPRGKRZSA-N 288.269 2.293 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])c1ccc(C)nc1 2174178107 YFWSNEDSKRNHHR-CYBMUJFWSA-N 277.328 2.068 10 10 CECE COc1cc(Cl)cc(CN2CCC[C@H](N)CC2)c1O 1205116736 HKRVYGRLIJHGIK-LBPRGKRZSA-N 284.787 2.367 10 10 CECE CC(C)NC(=O)[C@@H]1CCCN1c1ccc(CO)c(Cl)c1 2169609760 VNDQLQNQJLZWJQ-AWEZNQCLSA-N 296.798 2.326 10 10 CECE Cc1ccc(O)c(Cn2[nH]c(=N)cc2C(F)(F)F)c1 2079155993 MQQKYBMLAIKKKE-UHFFFAOYSA-N 271.242 2.377 10 10 CECE Cc1ccn2[nH]c(=N[C@H](C)c3ccccc3O)nc2c1 2192621916 HZDDXNWMMTTXAJ-LLVKDONJSA-N 268.320 2.338 10 10 CECE CCCN(Cc1ccccc1O)CC1COCCOC1 2187904983 CCLMPAYSAIKYQR-UHFFFAOYSA-N 279.380 2.267 10 10 CECE C[C@H](NC(=O)CC12CCC(CC1)N2)c1ccccc1O 2192623165 FFDQNJGFGAXSBJ-FZWSLVFFSA-N 274.364 2.244 10 10 CECE C[C@H]1CC[C@H](CN(C)C(=O)CCc2ccc(N)cc2)O1 2196185134 LVCBBOHTHGZJBY-SWLSCSKDSA-N 276.380 2.227 10 10 CECE Nc1ccc(OCC(=O)NCC[C@@]23CCC[C@H]2C3)cc1 2182060190 JYIOGTSDCAPDLD-BLLLJJGKSA-N 274.364 2.344 10 10 CECE C[C@H](O)c1ccc(N2CC(O)(c3cccs3)C2)cc1O 2193351961 CFGJDANVQMJBEI-JTQLQIEISA-N 291.372 2.215 10 10 CECE Nc1ccc(OC[C@@H](O)CO[C@H]2CCCC23CC3)cc1 2183248500 GWORAQRKIGYNBG-HIFRSBDPSA-N 277.364 2.358 10 10 CECE Oc1ccc(CN[C@@H]2C[C@H]3[C@H]4CC[C@@H](C4)[C@@H]32)c(O)c1O 2193771402 NAOABKLXJTWIEB-CDESUGMGSA-N 275.348 2.328 10 10 CECE CC1(C)CN(c2ccc3c(c2)CCC[C@H]3N)C[C@H]1CO 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2.288 10 10 CECE CN1CCCc2cc([C@@H](N)C3=CCOCC3)ccc21 2098463676 QBWJLJMYCONQDZ-INIZCTEOSA-N 258.365 2.416 10 10 CECE CN1CCC2(CC1)CCN2c1ccc(CN)cc1Cl 2114134991 UVFSJGLESTZMFZ-UHFFFAOYSA-N 279.815 2.473 10 10 CECE Nc1cccc(C(=O)O)c1N[C@H]1[C@@H]2[C@H]1CCC2(F)F 2114367287 BEGDDHYQOAILHI-OUAIYISWSA-N 268.263 2.423 10 10 CECE C[C@H]1CC(C)(C)CN1S(=O)(=O)Cc1ccc(N)cc1 2114462707 ZYONFTMMBSTRJQ-NSHDSACASA-N 282.409 2.219 10 10 CECE CNCc1ccc(N(C)CCOCC2CC2)cc1OC 2204556483 DWLIWLQKVVUXFV-UHFFFAOYSA-N 278.396 2.277 10 10 CECE COc1ccc(N2C[C@@H]3[C@H](CO)[C@@H]3C2)cc1Cl 2214342159 CAECJABQGLYUFH-JGPRNRPPSA-N 253.729 2.023 10 10 CECE Cc1ccc(CN[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)O)c(O)c1 2204632575 HUPOOCZYNXJROD-AZHAFVHUSA-N 275.348 2.290 10 10 CECE CSc1ncc(CN=c2nc3cc(C)ccn3[nH]2)s1 2269193922 PROQNYDRTWLKNT-UHFFFAOYSA-N 291.405 2.250 10 10 CECE CNCc1ccc(N(C)[C@H]2CC[C@H]2COC)cc1OC 2207393316 VYNKNWQYDMFASA-ZFWWWQNUSA-N 278.396 2.276 10 10 CECE COc1ccc(N2CC[C@H](C3(O)CC3)C2)cc1F 2219609824 PLSYONZDOAUQOP-JTQLQIEISA-N 251.301 2.186 10 10 CECE COc1ccc(N2CC[C@H]2C(F)F)c(C(=O)O)c1 2220401746 WTWXXQPOBOOACR-JTQLQIEISA-N 257.236 2.237 10 10 CECE COc1ccc(N2CC[C@H]3C[C@@]3(F)C2)c(CO)c1 2222679620 COGPHTIMJDFGIR-SMDDNHRTSA-N 251.301 2.126 10 10 CECE COc1ccc(N(C)C[C@@H]2COCCN2)cc1C(C)C 2233152136 ILWOTKIXOOPSGY-CYBMUJFWSA-N 278.396 2.243 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)[C@@H]2OC[C@H]3CCCC[C@H]32)CC1 2233182650 IBDYMSVRKARMHS-RAIGVLPGSA-N 278.356 2.493 10 10 CECE N[C@H](c1ccccc1O)[C@H]1OCC[C@@H]1C(F)(F)F 2223765306 YMYYRMOCLJEWGC-GDPRMGEGSA-N 261.243 2.359 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)[C@H](C)C[S@](C)=O 2223980503 UEKQWRLXCPXNJO-FMTVUPSXSA-N 269.410 2.252 10 10 CECE COc1cc(N2CCC[C@@H](CCCO)C2)ccc1CO 2234182614 TWEMLNRODGLNJR-ZDUSSCGKSA-N 279.380 2.176 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)C[C@H](CC(=O)O)C1CC1 2234171354 LGHSVTFXHINWFU-GMTAPVOTSA-N 280.328 2.225 10 10 CECE COc1cc(N2CCCC[C@@H]2[C@@H](C)CO)ccc1CN 2234435754 GPEZOYHSKQTSOL-SWLSCSKDSA-N 278.396 2.141 10 10 CECE CCn1nc(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])cc1C 2225791027 ACOMCPNZJXXIHR-ZJUUUORDSA-N 262.317 2.173 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)[C@H]1C[C@@H]2CC[C@H](C1)O2 2225793301 VETWUURXESSXEL-ZIQFBCGOSA-N 264.329 2.292 10 10 CECE CC[C@H](N)Cc1cc(OC)ccc1N1C[C@H](F)[C@H](F)C1 2235974878 ZSJNZEJDBCQYQL-FPMFFAJLSA-N 284.350 2.471 10 10 CECE COc1ccc(N2CCO[C@@H](C3CC3)CC2)c(CN)c1 2235967134 CADGARSNJPVVNP-MRXNPFEDSA-N 276.380 2.159 10 10 CECE COc1ccc(N(C)CCCn2ccnc2)c(C=O)c1 2235993816 BHQZTQIVAAIOFT-UHFFFAOYSA-N 273.336 2.231 10 10 CECE COc1ccc(N2CCC(F)(F)[C@@H](CO)C2)c(F)c1 2226794204 PZHXVNOIQBDUMP-SECBINFHSA-N 275.270 2.288 10 10 CECE COc1ccc(N2CC[C@H](C(F)(F)CO)C2)cc1C 2226858788 PKJZHLQBHGNIQQ-NSHDSACASA-N 271.307 2.458 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)[C@@H]1CC1(F)F 2227038268 VIWYDDPFAPQFMF-XQQFMLRXSA-N 270.323 2.029 10 10 CECE CCN(C[C@@H]1CCOC1)c1ccc(OC)cc1CN 2227686154 PDDUVMUOSUUIRY-LBPRGKRZSA-N 264.369 2.017 10 10 CECE CC(=O)c1ccc(O)c(CN(C)C[C@]2(F)CCOC2)c1 2238270879 WMBKWRLBYFFGBS-OAHLLOKOSA-N 281.327 2.155 10 10 CECE CC(C)(CC(F)F)Cn1ccc2c(c1=O)CNCC2 2228421360 BRUSVPBUSCIROA-UHFFFAOYSA-N 270.323 2.175 10 10 CECE COc1ccnc(C)c1NC(=O)c1cccc(O)c1O 2238582059 ANSUYVKYEFKMPD-UHFFFAOYSA-N 274.276 2.062 10 10 CECE COC1(CSC[C@H](O)COc2ccc(N)cc2)CCC1 2238709976 NMSUXOJBCHZOKO-CYBMUJFWSA-N 297.420 2.311 10 10 CECE CN(CCC(=O)Nc1ccc(N)cc1)CC1(Cl)CC1 2229652331 HYZCUCRFWJHXGQ-UHFFFAOYSA-N 281.787 2.301 10 10 CECE COCC1CC(SCC(=O)c2ccc(O)c(O)c2)C1 2229852426 NRRQMKWGYCDHDA-UHFFFAOYSA-N 282.361 2.439 10 10 CECE CC[C@H](C)[C@@H](N[C@H](C)c1cc(F)ccc1O)C(N)=O 2278765458 XFPCLGSUHCNCBN-IGJMFERPSA-N 268.332 2.082 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)[C@@H]1OCC[C@@H]1C(F)(F)F 2240492388 MXHZXEVPIDWHBK-XHNCKOQMSA-N 292.261 2.255 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC(=O)NC[C@@H]1C(C)C 2240844812 USKWLLNUTYHNMA-IUODEOHRSA-N 276.380 2.009 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)CC(=O)NCC(C)C 2240828587 DDMSGAIROWANDD-ZDUSSCGKSA-N 278.396 2.257 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC(c2cnn(C)c2)C1 2240835886 FHTBNNYBFQLQKV-GFCCVEGCSA-N 270.380 2.352 10 10 CECE CSc1ncc(CN[C@H]2CCC[C@@]23CCNC3)s1 2257100709 CWFWKQXIVTYGAG-AAEUAGOBSA-N 283.466 2.487 10 10 CECE COc1ccc(N(CC(C)C)C[C@@H](C)O)c(N)c1 2259828384 WQTGNPJWKXOJGE-LLVKDONJSA-N 252.358 2.121 10 10 CECE CCN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@H]3O)cc1 2270731213 HZWVCTKYNVEVRQ-ZIEJDFEHSA-N 260.381 2.174 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1c(F)cc([C@@H](C)O)cc1F 2273212206 CDNLDRCYWJKMSG-BZHVJNSISA-N 271.307 2.368 10 10 CECE CN(Cc1ccccc1O)C(=O)c1cnnc(Cl)c1 2273950158 GMVBMGAUSJYPFO-UHFFFAOYSA-N 277.711 2.108 10 10 CECE CCOC1CC(NC(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2265429733 VTFXEZLJRFHIBO-KPPDAEKUSA-N 267.333 2.038 10 10 CECE COc1ccc(N2CC3(CCCNC3)C2)c2c1CCC2 2284597950 ZVBGMHZZPSSCQT-UHFFFAOYSA-N 272.392 2.374 10 10 CECE N[C@@H]1C[C@H]2CC[C@H]1C[C@@H]2NCc1ccc2c(c1)CCO2 2284884205 VJYVDJRPLJCQGF-XNISGKROSA-N 272.392 2.227 10 10 CECE COc1ccc(N2CCC23CCNCC3)c(OC)c1C 2295420526 DURUYSVKJWKLNX-UHFFFAOYSA-N 276.380 2.345 10 10 CECE Cc1c(CN2C[C@@H]3C[C@@]3(CN)C2)n(C)c2ccccc12 2288250308 QOHAZSIDCVJOHJ-SUMWQHHRSA-N 269.392 2.267 10 10 CECE C[C@H]1CCO[C@H]1CN[C@H](C)c1c(O)cccc1O 2296640006 FRMSPFOGVKBKON-CWSCBRNRSA-N 251.326 2.173 10 10 CECE CSc1cc(N2CC3(CSC3)C2)ccc1CN 2308070657 XXFCUOGUEOALQM-UHFFFAOYSA-N 266.435 2.420 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H]2C[C@@H]2CF)cc1O 2310931428 LPKJJPGJIFIWPE-MXWKQRLJSA-N 252.333 2.454 10 10 CECE Nc1ccc(CNC(=O)C[C@@H]2CCC2(F)F)cc1 2313812607 BPAVCBKZQIOEHZ-JTQLQIEISA-N 254.280 2.320 10 10 CECE CC(=O)N1CCN(N=Nc2ccc([N+](=O)[O-])c(C)c2)CC1 2330246633 SBCKSXVETLVWQY-UHFFFAOYSA-N 291.311 2.066 10 10 CECE COc1ccc(N(C)C[C@H]2C[C@@H](F)C2)c(CN)c1 2327461686 XXEVBRSXEROYJA-KLPPZKSPSA-N 252.333 2.338 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@@H]2C[C@@H]3OCC[C@@H]3O2)CC1 2329493085 DUBKNMWHXYIAIY-CYDGBPFRSA-N 266.345 2.098 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H]1[C@@H]2CCOC[C@@H]21 2331260880 CUKZDVRJFCYNTP-QXSJWSMHSA-N 260.381 2.296 10 10 CECE C[C@@H](c1cc(Cl)ccc1O)N1CCO[C@@H]2COC[C@@H]21 2332174392 KZYWAQIRBVFGMY-DUFXMDAXSA-N 283.755 2.206 10 10 CECE CN(CCOCC1CCC1)Cc1cc(N)ccc1O 2338468255 QKFYTOXGEBSRTA-UHFFFAOYSA-N 264.369 2.223 10 10 CECE C[C@@H]1CCC[C@@H](CS(=O)(=O)Nc2ccc(O)cc2)O1 2338677792 QMTSSTARMBOBEO-MFKMUULPSA-N 285.365 2.092 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC(C[S@](C)=O)C2)c1C 2340846271 LAACJCSYBNSSGZ-BLVKFPJESA-N 281.421 2.171 10 10 CECE COc1ccc(N2C[C@H](O)C[C@H]2C(C)C)c(C=O)c1 2344692146 JTFFIYGYIOVHDU-DOMZBBRYSA-N 263.337 2.103 10 10 CECE CO[C@H]1COCCN(c2ccc([C@H](C)O)c(Cl)c2)C1 2351646623 CPYQJDQWEYECGA-CMPLNLGQSA-N 285.771 2.245 10 10 CECE C[C@@H](N[C@@H]1C[C@@H]2CC[C@@]1(CO)C2)c1c(O)cccc1O 2354527302 RRVHCECASUHNDD-KTMIJUKYSA-N 277.364 2.300 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@@H]2C[C@H]3CNC[C@H]32)cc1 2355450215 NADMQUPIMDDYOP-RKTXRCNFSA-N 274.408 2.422 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@H]1C[C@@H]2C[C@@H]2CO1 2355836557 OOQBPTPJVDSIIS-DANNLKNASA-N 272.392 2.494 10 10 CECE CO[C@]1(C)C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(O)cc1O 2356193228 UZAWYRYETIWHNE-LMRQPLJMSA-N 277.364 2.391 10 10 CECE Cc1cccc(NC=C2C(=O)OC(C)(C)OC2=O)c1 10121464 SGMDNHLEFDLDHB-UHFFFAOYSA-N 261.277 2.127 10 10 CECE Nc1ccc(OC[C@H](O)COCc2ccccc2F)cc1 69281810 MKKSMOSZYRCPKQ-CQSZACIVSA-N 291.322 2.364 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1ccc(=O)oc1 38089578 XDLQPDGPZYXEGZ-JTQLQIEISA-N 273.288 2.179 10 10 CECE C[C@@H](NCC(C)(C)N(C)C)c1ccc(O)cc1O 20125794 XZKKWKNDHKBRJN-SNVBAGLBSA-N 252.358 2.089 10 10 CECE CC(C)(C)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 62734022 AUESKFQWBNRTTH-AWEZNQCLSA-N 289.423 2.276 10 10 CECE C[C@H](Cc1ccccc1)NC(=O)COc1ccc(N)cc1 62182790 BQCQHYNIXFFQFJ-CYBMUJFWSA-N 284.359 2.395 10 10 CECE C[C@@H](C(=O)N1CCCCCC1)N(C)c1ccc(CN)cc1 34653804 GMGAXOBZBHCLDY-AWEZNQCLSA-N 289.423 2.373 10 10 CECE Cc1cc(O)c(CN2CCN(C3CC3)CC2)cc1C 129094610 MDUDNQSPBVCTIY-UHFFFAOYSA-N 260.381 2.289 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)c1ccc([N+](=O)[O-])[nH]1 38089662 REOODLDIWHAWGH-VIFPVBQESA-N 289.291 2.462 10 10 CECE COC(=O)C(C)(C)N[C@@H](C)c1ccc(N(C)C)cc1 37304402 IMXDBCRQRAWXPA-NSHDSACASA-N 264.369 2.355 10 10 CECE COC[C@H]1CCN(c2ccc(/C=C/C(=O)O)cc2F)C1 81072950 NSYIIISBDNSRAD-PYEVWLCESA-N 279.311 2.396 10 10 CECE CS[C@H]1CCC[C@@H]1NCc1ccc(O)c(O)c1 226758294 RYEGYRFSDNDZPW-GWCFXTLKSA-N 253.367 2.472 10 10 CECE COCCN(CCOC)/N=N/c1cc(OC)cc(OC)c1 1860488009 ZEDHVHWIQMOTMW-FOCLMDBBSA-N 297.355 2.297 10 10 CECE COC(=O)[C@](CN)(CCc1ccc(N)cc1)CC1CC1 234567715 KZJNTVQCTJKPSY-MRXNPFEDSA-N 276.380 2.120 10 10 CECE COc1cc(Br)cc([C@@H](N)C(F)F)c1O 238453825 ATGIKAUKMYDIAO-SSDOTTSWSA-N 282.084 2.428 10 10 CECE NCc1ccc(N2C[C@@H]3CC[C@H](C2)O3)cc1Cl 90905348 OBLHQGOTLXYUAZ-TXEJJXNPSA-N 252.745 2.166 10 10 CECE COc1ccc(C)cc1NN=NCCN1CCOCC1 1860495746 PBQDISPJPDEVKT-UHFFFAOYSA-N 278.356 2.115 10 10 CECE CCCN(CCC(=O)NC1CC1)c1ccc(CN)cc1 54049359 ZOOUAEIVJVNVRG-UHFFFAOYSA-N 275.396 2.030 10 10 CECE C[C@@H](CO)c1cc(Br)c(F)c(O)c1O 258345047 DSLGPSVCWFWUTJ-BYPYZUCNSA-N 265.078 2.095 10 10 CECE Cc1cc(N2CCO[C@@H](CCF)C2)ccc1C[C@@H](C)N 700576066 REOICKXJZSUWGQ-CJNGLKHVSA-N 280.387 2.450 10 10 CECE COC(=O)[C@@H](C1CC1)[C@](C)(O)c1ccc(N(C)C)cc1 2167002473 WOUUSCNLCGWNLY-GDBMZVCRSA-N 277.364 2.159 10 10 CECE CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(Cc2ccc(N)cc2)[C@H]31 394319841 CKLWJKFAWWGCKX-RHMLRGBNSA-N 258.365 2.124 10 10 CECE NCCO[C@H]1CCN(c2ccc(OC3CCC3)cc2)C1 2168990752 HCSQHTWECVUUSO-INIZCTEOSA-N 276.380 2.172 10 10 CECE CO[C@H](CNCc1cc2c(cc1O)OCO2)C1CCC1 703057280 BHULXXMFFWBDGK-OAHLLOKOSA-N 279.336 2.026 10 10 CECE Nc1ccc(CCN2CCC[C@]3(CO)CCC[C@@H]23)cc1 2165251512 SGUGNBMGUDSXQI-SJORKVTESA-N 274.408 2.438 10 10 CECE CCC[C@H](NC(=N)N)c1cc(Br)ccc1O 396484457 LLWVXVHGJNBJEZ-VIFPVBQESA-N 286.173 2.479 10 10 CECE CCNCc1ccc(N2CC[C@H](N3CC=CC3)C2)cc1 2170456889 FWKNJPWLMSJEQK-KRWDZBQOSA-N 271.408 2.247 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H](C)CF)c1 814423029 RLUKCVJQXARBFO-DTWKUNHWSA-N 270.304 2.119 10 10 CECE C[C@@H](NC[C@H]1CC[C@H](C(N)=O)CC1)c1cc(F)ccc1O 817585264 DQYJWWZSGHCNMB-IJLUTSLNSA-N 294.370 2.474 10 10 CECE CNC(=O)[C@H]1CCCCN1c1ccc([C@@H](C)NC)cc1 723158799 QGGRFOUAPLJZSC-IUODEOHRSA-N 275.396 2.072 10 10 CECE Nc1ccc2c(ccn2C[C@@H]2C[C@H]3COC[C@H]3O2)c1 724593942 IZLDMFUXCPUROT-CORIIIEPSA-N 258.321 2.027 10 10 CECE COc1cccc(CNC(=O)[C@H](OC)C2CCCC2)c1O 830540153 FWJQKKSTJWBMGN-OAHLLOKOSA-N 293.363 2.222 10 10 CECE CC1(C)CCC[C@](O)(C(=O)NCc2ccccc2O)C1 830526342 KARZMLPYNXSMJE-MRXNPFEDSA-N 277.364 2.340 10 10 CECE CN(C)c1ccc(/C=C/CN2CC[C@H](C(=O)O)C2)cc1 901492429 ZHNQFTAUQJWLEM-XGACYXMMSA-N 274.364 2.172 10 10 CECE COC1(C)CN(C/C=C/c2ccc(N(C)C)cc2)C1 839100571 AUUBDKSZDYJNOZ-AATRIKPKSA-N 260.381 2.487 10 10 CECE CSC[C@H](C)NC(=O)NCc1c(O)cccc1F 919480344 JQYMHOXBEYDVKN-QMMMGPOBSA-N 272.345 2.082 10 10 CECE C[C@H](N)[C@@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)C1 843057360 JFMDCUYRDWUUIP-YMEQAZQUSA-N 273.424 2.435 10 10 CECE CCc1cc(O)ccc1NS(=O)(=O)C[C@H](OC)C1CC1 842587234 ANKOZTYNMRTSBG-AWEZNQCLSA-N 299.392 2.121 10 10 CECE CCON(C)C(=O)CNCc1ccc2ccccc2c1O 846062421 HLFVCDGXZWDMPL-UHFFFAOYSA-N 288.347 2.045 10 10 CECE C[C@H](CC(=O)NCc1c(O)cccc1F)[C@@H]1CCCO1 928709309 CWBAHCRUAVVZOB-YGRLFVJLSA-N 281.327 2.353 10 10 CECE COc1ccc(N2CCCC[C@H]2[C@@H](C)CO)c(N)c1 696680814 MXBKZVRYKVEKGH-FZMZJTMJSA-N 264.369 2.265 10 10 CECE CCCCN(Cc1ccccc1O)[C@H]1CON(CC)C1=O 852019120 UUIXEKSAYUVZEW-AWEZNQCLSA-N 292.379 2.157 10 10 CECE CCN(c1ccc(/C=C/C(=O)O)cc1)[C@@H]1CCN(C)C1 693438432 BPTPGCCHURUOJD-RZIFZGNASA-N 274.364 2.315 10 10 CECE CCOCc1cc(CN[C@@H]2CC[C@H](C)NC2)ccc1OC 863485021 RMAWKRICZOOXKB-XJKSGUPXSA-N 292.423 2.462 10 10 CECE COc1cccc([C@@H](C)NCC[C@@H](O)C(F)F)c1O 866442012 BRVMZFBYTNFOSC-PSASIEDQSA-N 275.295 2.068 10 10 CECE CC(C)Oc1ccc(N2CCO[C@@H](CCN)C2)cc1 71597033 KCHBKKNDXQTGLJ-HNNXBMFYSA-N 264.369 2.028 10 10 CECE CC[C@@H](NCC1(N)CCOCC1)c1ccc(C)cc1O 863540168 BORPHSFRTYQGTE-CQSZACIVSA-N 278.396 2.249 10 10 CECE CN1CN(Cc2cc(-c3ccccc3)ccc2O)CC1=O 765633318 AGSFSIJRPUYVBP-UHFFFAOYSA-N 282.343 2.291 10 10 CECE O=C(NCc1ccccc1O)c1cc(=O)c2ccccc2[nH]1 769365744 RZCVJDUKJUYCOS-UHFFFAOYSA-N 294.310 2.164 10 10 CECE C[C@H](c1ccccc1O)N(C)c1ncccc1CN 1877533243 QGOKTHFSYSHUTJ-LLVKDONJSA-N 257.337 2.443 10 10 CECE CN(Cc1ccccc1O)C1CC2(CCCNC2)C1 1877543818 APLNTVIROAVJSP-UHFFFAOYSA-N 260.381 2.356 10 10 CECE C[C@H](c1ccccc1O)N(C)CC(=O)N1CCCC1 132706047 NSSAHUHIJQVXMR-GFCCVEGCSA-N 262.353 2.007 10 10 CECE COc1ccc(CNC(=O)C2(C(F)(F)F)CC2)c(O)c1 794380379 YPDFEDPVOOPSRM-UHFFFAOYSA-N 289.253 2.360 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H](O)C(C)(C)C2)c(F)c1 1880488435 VGYGULNHHGEQLY-PELKAZGASA-N 271.307 2.225 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@@H](O)C(C)(C)C2)c(F)c1 1880488436 VGYGULNHHGEQLY-PRHODGIISA-N 271.307 2.225 10 10 CECE Oc1cccc(F)c1CN[C@H]1CCN2CCC[C@H]2C1 896636490 DIWKUYKHRASDIA-RYUDHWBXSA-N 264.344 2.248 10 10 CECE C[C@H]1CC[C@H](CN(C)c2c(F)cc(CO)cc2F)O1 1885285041 UBZKIECNFMAONH-GXSJLCMTSA-N 271.307 2.461 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)OCCCO3)C[C@@H](C)N1 1152673101 KCNSAVBPWQFSSQ-VXGBXAGGSA-N 262.353 2.035 10 10 CECE CCOc1ccc(NC(=O)c2cccc(O)c2O)nc1C 1167767487 CARQFPCSRMJGGH-UHFFFAOYSA-N 288.303 2.452 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cccc2nc[nH]c12 1963732684 QSTDZNYFVHLJPD-UHFFFAOYSA-N 258.285 2.383 10 10 CECE Oc1ccc([C@H]2NCCc3ccc(F)cc32)c(O)c1O 83596345 NMGMMAFSAICMAP-CYBMUJFWSA-N 275.279 2.178 10 10 CECE Cc1cccc([C@@H]2NCCc3ccc(O)c(O)c32)c1O 83621025 KHXDNTIRTFOGAC-AWEZNQCLSA-N 271.316 2.347 10 10 CECE CCC[C@@]1(C(=O)O)CCN(Cc2ccc(N)cc2)C1 1891475069 WDSQEVPDFKEGFD-OAHLLOKOSA-N 262.353 2.346 10 10 CECE c1ccc2c(c1)CCCN2c1ncnc2c1CNCC2 169129995 CVEAFTJGSQKWFI-UHFFFAOYSA-N 266.348 2.207 10 10 CECE Cc1ccc(S(=O)(=O)NCCCN=[N+]=[N-])cc1C 42013218 UXKXFNULGWMKQT-UHFFFAOYSA-N 268.342 2.282 10 10 CECE NCc1ccc(N2CCN3CCCC[C@H]3C2)cc1Cl 249906187 LUZIVICBXMYIND-AWEZNQCLSA-N 279.815 2.473 10 10 CECE C[C@H](CCO)CCNCc1ccc(F)c(F)c1O 703394234 JIJSVHAVOIANRT-VIFPVBQESA-N 259.296 2.169 10 10 CECE CO[C@@H]1CC[C@@H](C)N(c2ccc(CN)c(F)c2F)C1 687204480 JUAVHHUIEVNTNV-MWLCHTKSSA-N 270.323 2.427 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Br)[C@@H](C)CN1 706867082 OJBBKHJHUCDHSG-UWVGGRQHSA-N 299.212 2.337 10 10 CECE C[C@]12CCCC[C@H]1CN2c1ccc2c(c1)NC(=O)[C@H]2N 707136618 VPLYVAJLMQCASQ-FSBGKCOPSA-N 271.364 2.407 10 10 CECE C[C@H](N)c1ccc(N(C)C(C)(C)CCO)c(F)c1 688342465 BOJFMFMGACAMIK-JTQLQIEISA-N 254.349 2.443 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](C)[C@@H](CO)C2)cc1Cl 708756934 XBTUVUUSUAAQRR-GARJFASQSA-N 269.772 2.458 10 10 CECE C[C@H](N)c1ccc(N(C)CCN2CCCC2)c(F)c1 63052185 GIMSTQBCWJYMBR-LBPRGKRZSA-N 265.376 2.377 10 10 CECE CCNCc1ccc(N(C)C[C@@H](O)C2CC2)c(C)c1 690259760 PORPURMPRRPRBM-MRXNPFEDSA-N 262.397 2.312 10 10 CECE C[C@@H]1CCc2cc(N3CC[C@H](CC(N)=O)C3)ccc2N1 690731070 HHSQPNLBOCXPTB-VXGBXAGGSA-N 273.380 2.135 10 10 CECE Nc1ccc(CC(=O)NCCC2SCCS2)cc1 693789846 JGDNPFIJVNUGME-UHFFFAOYSA-N 282.434 2.124 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@](C)(C3CC3)C2)cc1O 694867837 QSOKMKLSNUIZBG-ZBEGNZNMSA-N 276.380 2.417 10 10 CECE C[C@@H]1CC(F)(F)CCN1c1ccc2c(c1)NC(=O)[C@H]2N 697621042 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2.163 10 10 CECE Nc1ccc(OCc2nc(C[C@@H]3CC3(F)F)no2)cc1 701927997 IVBHMKUJHBNQIB-MRVPVSSYSA-N 281.262 2.429 10 10 CECE CC[C@@]1(c2ccc(OC)cc2O)COC(C)(C)CN1 83482266 AOFSIHUVYMUFCI-HNNXBMFYSA-N 265.353 2.405 10 10 CECE NC1(c2nnc(-c3ccc(-n4cccc4)cc3)o2)CC1 83483991 BXTRBBASWBWNON-UHFFFAOYSA-N 266.304 2.475 10 10 CECE C[C@H]1C[C@@H](C)[C@@H](C(=O)O)CN1Cc1ccc(N)cc1 1891640375 ZSEFOJYPICIZSH-SUNKGSAMSA-N 262.353 2.200 10 10 CECE C[C@@H](NC1CCC(C)(O)CC1)c1c(O)cccc1O 703549642 ORWYCIPOEORWCV-RWWNRMGGSA-N 265.353 2.442 10 10 CECE Cc1ccc(O)c([C@H](C)NCC[C@@H]2CC(=O)N(C)C2)c1 723546092 MUIZNEKOEHCHOE-QWHCGFSZSA-N 276.380 2.220 10 10 CECE CO[C@H](COC(=O)c1ccc(C)c(O)c1O)C1CCC1 1327070001 BQVOEWFKESUWFK-GFCCVEGCSA-N 280.320 2.378 10 10 CECE Cc1ccc(O)c(CNC[C@]2(CO)CC23CCC3)c1 1964614915 NILMNSGVOCMVJF-INIZCTEOSA-N 261.365 2.343 10 10 CECE CC(C)c1cc(Sc2nccs2)nc(NN)n1 822042703 OZTDBQDPZBBIMP-UHFFFAOYSA-N 267.383 2.493 10 10 CECE NCc1ccc2c(c1)CCCN2CCCn1ccnc1 62801628 RETWVVXAEIIQKZ-UHFFFAOYSA-N 270.380 2.185 10 10 CECE [N-]=[N+]=NCCCN[C@@H](C(=O)O)[C@H]1CCC(F)(F)C1 712976546 XSNYPMHORITMSF-JGVFFNPUSA-N 262.260 2.165 10 10 CECE Cc1ccc([C@@H](C)N(C)C2CC(S(C)(=O)=O)C2)c(O)c1 716082088 LGEYLJASIPQPFU-PNESKVBLSA-N 297.420 2.269 10 10 CECE Fc1cc(OCC(F)(F)F)ccc1N1CCNCC1 87439250 RWMOBJPMQMXIDA-UHFFFAOYSA-N 278.249 2.176 10 10 CECE NCc1cc(F)c(N2CCO[C@@H](C(F)(F)F)C2)c(F)c1 698751838 MJCKSWSCXPZMDP-SNVBAGLBSA-N 296.239 2.191 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2CCCOC2)cc1O 93671713 OZEUEFCBFKPYOX-RYUDHWBXSA-N 264.369 2.275 10 10 CECE Cc1cccc(CN2C[C@H](O)CC3(CCOCC3)C2)c1O 1331566105 SBRLTNGUOKUQBG-OAHLLOKOSA-N 291.391 2.064 10 10 CECE O=C(C[C@H]1CC=CCC1)NCc1cccc(O)c1O 1348045987 GEHXDCZPYDCHSH-NSHDSACASA-N 261.321 2.460 10 10 CECE O=C(COC(F)(F)F)Nc1c(Cl)ccc2nonc12 1525080690 ILHLKCWZJBXVGE-UHFFFAOYSA-N 295.604 2.351 10 10 CECE CN(C)c1cccc(C(=O)NCc2cc(O)ccc2O)c1 1471660775 LRMZPTGQJXLLET-UHFFFAOYSA-N 286.331 2.094 10 10 CECE O=C1c2c(O)cccc2OC[C@H]1c1ccc(O)c(O)c1 1614949057 AGAOPVKSSUIFMT-VIFPVBQESA-N 272.256 2.162 10 10 CECE COC(=O)[C@@](C)(C[C@H](C)C(F)(F)F)NCCN=[N+]=[N-] 2121374570 AXJSYZJEKBVEOD-IONNQARKSA-N 282.266 2.407 10 10 CECE CC[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)OC 1556890974 AWVHMOMLDQCJOW-LLVKDONJSA-N 278.312 2.004 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N[C@H]1C[C@@H]1Cc1ccccc1 1565793849 UGQVNLBXNKALCC-GJZGRUSLSA-N 297.354 2.388 10 10 CECE O=[N+]([O-])c1ncccc1NCc1c(O)cccc1F 1643209861 IRROTRCZZYFDSK-UHFFFAOYSA-N 263.228 2.447 10 10 CECE CC[C@@H]1CN(c2ccc(C=CC(=O)O)cc2)CCN1C 1912096960 MYDLMRPSALJVGO-CQSZACIVSA-N 274.364 2.315 10 10 CECE CC(=O)c1ccccc1NC(=O)CN(C)CCN=[N+]=[N-] 1912176755 DPFLCAFQFAVABS-UHFFFAOYSA-N 275.312 2.070 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(CCCCC(N)=O)C1 1912147730 LLPOTUOWKMXFGX-LLVKDONJSA-N 253.350 2.054 10 10 CECE CC[C@@H]1CCCCN1C(=O)CN1CC[C@@H](N=[N+]=[N-])C1 1912149283 DKZISTRIILPYRW-VXGBXAGGSA-N 265.361 2.162 10 10 CECE COC[C@@H](C)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 1912186033 ZAZOMEIAZRJWJC-GHMZBOCLSA-N 254.334 2.208 10 10 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10 CECE CN(C)c1ccc(CN[C@@H]2CCC[C@@H]3CNC[C@H]32)cc1 1967985157 DEJXCIVUXHKSGW-DJIMGWMZSA-N 273.424 2.230 10 10 CECE CCOC1CC(NCc2ccc3c(c2)CCN3C)C1 230951569 IKNARKRVTMINNZ-UHFFFAOYSA-N 260.381 2.336 10 10 CECE CCN[C@@H](C)c1ccc(N(CCO)CC(F)F)cc1O 231322521 DZWWSFGWRQBJMB-JTQLQIEISA-N 288.338 2.127 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)c1ccn(C)n1 231890479 IMQXASXNOPXIRQ-UHFFFAOYSA-N 272.352 2.055 10 10 CECE CNC(=O)[C@@H]1CCCN(c2ccc([C@@H](C)N)cc2Cl)C1 232290087 BBTCATQYVNYDNC-ZYHUDNBSSA-N 295.814 2.322 10 10 CECE CCN(CCCOCCOC)c1ccc(N)cc1 233468085 YUYJYXYEEMZYPS-UHFFFAOYSA-N 252.358 2.148 10 10 CECE CCNCc1ccc(N2CC[C@]2(C)CCO)cc1C 2140577452 ZBKQLCRYNOZOIK-MRXNPFEDSA-N 262.397 2.456 10 10 CECE CN(C)[C@@H]1CCN(c2ccc(CN)c3ccccc23)C1 234245763 IWCDFSYOGKLQDK-CQSZACIVSA-N 269.392 2.439 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](O)C3(CC3)C2)c(F)c1 2149753703 HFQXJNMWHLLRFT-IAQYHMDHSA-N 278.371 2.457 10 10 CECE C[C@H](NC[C@@H]1C[C@H]2O[C@H]1[C@@H]1C[C@H]21)c1cc(O)ccc1O 2144066483 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10 10 CECE CN(CC1[C@@H]2CC[C@@H]12)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 2160072888 KIYUVPZYSIMRLR-WGZSSWNPSA-N 291.782 2.384 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCN2CCC[C@H]2C1 300439518 FZUYKOBJBNVEEO-STQMWFEESA-N 276.380 2.329 10 10 CECE CN1CCC[C@H](CN2CCC[C@@H](N=[N+]=[N-])CC2)C1 2038010592 VDXSKVSHJHNYKE-QWHCGFSZSA-N 251.378 2.493 10 10 CECE CC[C@@H](NCc1c(O)cccc1Cl)C(=O)N(C)C 2038814649 HDXHKSRIOAZMOP-LLVKDONJSA-N 270.760 2.002 10 10 CECE O=Cc1csc(S(=O)(=O)Nc2ccc(O)cc2)c1 2039734315 KNDFAWRIPZWBAF-UHFFFAOYSA-N 283.330 2.067 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])[C@H]1CC[C@H](C)C1 2040174434 AWMBMMIRGWTJBW-GARJFASQSA-N 254.334 2.254 10 10 CECE CC(C)[C@H](O)CCNCc1ccc(N(C)C)cc1 304363030 UPBGUTZTPSIJBC-OAHLLOKOSA-N 250.386 2.249 10 10 CECE CNCc1ccc(OC)c(CN(C)[C@H]2CO[C@H](C)C2)c1 401464797 TVFLTJHXQMISDO-IUODEOHRSA-N 278.396 2.024 10 10 CECE C[C@@H]1CC[C@@H](N(C)c2cc3c(cc2N)OCCO3)CO1 402083773 NWIFEUXOFPHVKR-GHMZBOCLSA-N 278.352 2.044 10 10 CECE C[C@H](Nc1ccc2nncn2c1)c1cc(O)ccc1O 2159798744 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CC(C)[C@H](N)CCN(C)Cc1cc(F)cc(F)c1O 708495397 WVOXZQWDPQFMNT-CYBMUJFWSA-N 272.339 2.476 10 10 CECE CNCc1ccc(N2C[C@H](C)[C@@H](O)[C@H](C)C2)c(C)c1 688137732 NRRFSLHAPFKMDF-VIKVFOODSA-N 262.397 2.168 10 10 CECE C[C@@H](CO)CN(C)c1c(F)cc(CNC2CC2)cc1F 688325454 GJNHGLFMEUEAEL-SNVBAGLBSA-N 284.350 2.281 10 10 CECE CCC[C@@]1(O)CCCN(c2ccc(CN)cc2F)C1 710211137 IIDLVPGJSFPEEJ-OAHLLOKOSA-N 266.360 2.416 10 10 CECE CN1CCc2cc([C@H](NN)[C@H]3C[C@@H]3C(F)(F)F)ccc21 2163149183 GQDFSOAZCUWLCD-GVXVVHGQSA-N 285.313 2.382 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)C[C@@H]2CCCC[C@H]21 712412748 CPRMCXNZKPKLDF-HOSYDEDBSA-N 252.318 2.310 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@@H](C)[C@H]2C)cc1O 380500087 HNJGZPXDUBQJNI-AXFHLTTASA-N 250.342 2.026 10 10 CECE Oc1c(F)cc(F)cc1CN1CCN[C@H](CC(F)F)C1 2177311780 JVGGSLCAFBIZPM-SNVBAGLBSA-N 292.276 2.099 10 10 CECE CN(C[C@]12CCC[C@H]1C2)S(=O)(=O)Cc1ccc(N)cc1 693822331 GTLKBRHTWQMMND-DZGCQCFKSA-N 294.420 2.221 10 10 CECE CO[C@H]1CCN(c2cc3c(cc2N)OCCO3)[C@@H](C)C1 383145774 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CC[C@H](NCc1ccc(OC)cc1O)C(C)(C)O 394008576 FGBYHGHGILEGPT-ZDUSSCGKSA-N 253.342 2.040 10 10 CECE COCCCCN(C)CCCOc1ccc(N)cc1 397348762 OCDCYLUBDHVUHC-UHFFFAOYSA-N 266.385 2.396 10 10 CECE Cc1cc(N)ccc1N1C(=O)c2cscc2C1=O 821935407 LZGCJJDEQUYFKW-UHFFFAOYSA-N 258.302 2.439 10 10 CECE COc1cccc(CC(=O)NCC2(CN=[N+]=[N-])CC2)c1 2174350183 BZBMYMPJXICUQI-UHFFFAOYSA-N 274.324 2.444 10 10 CECE COC(=O)c1cccc(N)c1N[C@H](C)[C@H]1CCC[C@@H]1O 2167852686 JXQWASFRTPWUAF-BREBYQMCSA-N 278.352 2.017 10 10 CECE COC(=O)c1cc(C)nn1[C@H](C)c1c(O)cccc1OC 2069926201 XHEXTETXNBKDJR-SNVBAGLBSA-N 290.319 2.302 10 10 CECE CN(CCCCN1CCCC1=O)Cc1ccc(N)cc1 2169792208 FWUCDVAFJZHACF-UHFFFAOYSA-N 275.396 2.103 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCCCN2CCCC2=O)C1 2169719381 PXDXEYHIEAULLZ-CYBMUJFWSA-N 279.388 2.411 10 10 CECE CCN[C@H](C)c1ccc(N(C)CCn2cncn2)cc1 2170125009 GOWXCCWIZXUWQV-CYBMUJFWSA-N 273.384 2.085 10 10 CECE CCN(C)C[C@H]1CCN(c2ccc([C@H](C)O)c(O)c2)C1 2170254460 RLVBLGNHAPMQND-QWHCGFSZSA-N 278.396 2.224 10 10 CECE 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10 10 CECE OCc1ccc(N2CC[C@H]3[C@H](C[C@H]3O)C2)c(Cl)c1 2217845709 VSCPBPFRSONBCB-UHIISALHSA-N 267.756 2.039 10 10 CECE CSc1ncc(CNC[C@@H]2C[C@@H]3C[C@H]3CO2)s1 2208850278 LMNMOVNDVKFOTD-GUBZILKMSA-N 270.423 2.380 10 10 CECE CC[C@H](COC)CC(=O)N[C@H]1CCC[C@H]1N=[N+]=[N-] 2218737914 LOKQNPQHIBCVEC-GARJFASQSA-N 254.334 2.397 10 10 CECE COc1ccc(N2CC[C@H](C)[C@H](F)C2)c(CN)c1 2220413583 FGZAKGZDSNCMFO-GXFFZTMASA-N 252.333 2.338 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)C[C@H]1[C@@H]2COC[C@@H]21 2232097147 YVQPJXZZWLWBTQ-NGFQHRJXSA-N 261.365 2.377 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@@H]2CCC[C@@H]2C(=O)O)CC1 2234172778 UWZHPMNEKCCTSL-MNOVXSKESA-N 280.328 2.036 10 10 CECE CCOc1ccc(N2CC(O)(C(F)F)C2)cc1OCC 2234880981 NMXYZQPFKAIKIR-UHFFFAOYSA-N 287.306 2.300 10 10 CECE Oc1ccc(CNC[C@@H]2OC[C@@H]3CCC[C@@H]32)c(O)c1 2224960742 DJHJWVLKFOAOAY-WHOFXGATSA-N 263.337 2.003 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)COc1ccccc1 2225797264 DVKJLMUFESPJGL-NEPJUHHUSA-N 260.297 2.413 10 10 CECE COc1ccc(N2CC[C@@H](OC)[C@H]2C2CC2)c(CN)c1 2235966935 ZOQYPGHHACJRFU-HZPDHXFCSA-N 276.380 2.158 10 10 CECE CC[C@H]1CN(c2ccc(OC)cc2CCN)C[C@H](C)O1 2235969249 BNYRTNCDJIBKGR-JSGCOSHPSA-N 278.396 2.200 10 10 CECE CCO[C@@H]1C[C@@H]2CN(c3ccc(OC)cc3C=O)C[C@H]21 2235989699 ZVEPBNDSWPRQSU-DJSGYFEHSA-N 275.348 2.369 10 10 CECE O[C@@H]1CCC12CCN(c1ccc3c(c1)CCO3)CC2 2226752138 HXMHMJUWASPYJN-OAHLLOKOSA-N 259.349 2.363 10 10 CECE COc1ccc(N2CC[C@H](O)C[C@@H](C)C2)cc1OC 2226814435 OCRQRICRQYMFTI-YPMHNXCESA-N 265.353 2.301 10 10 CECE CCN[C@](C)(CO)C[C@H](C)Oc1ccc(N(C)C)cc1 2237697736 JGLDOLNPJUCNMV-BBRMVZONSA-N 280.412 2.271 10 10 CECE COc1ccc(N2CCN(C)CC2(C)C)c(C=O)c1 2227695866 QCEMYWSQIMGMIP-UHFFFAOYSA-N 262.353 2.038 10 10 CECE COc1ccc(N2C[C@@H]3[C@@H](C2)C3(F)F)c(C(=O)O)c1 2227669623 FKWNZWLIKZVBHT-NXEZZACHSA-N 269.247 2.095 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@@H]1CC[C@@H]1OC 2227821155 SQBPXXAQRTZRPZ-KGLIPLIRSA-N 262.353 2.042 10 10 CECE Cc1nn(C)c([C@@H](N)c2ccc3c(c2)CCN3C)c1Cl 2240891395 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CCc1cccc(CNCCN2CC[C@@H]3C[C@@H]32)c1O 2274565829 PKJPEJKEAAGBFL-HIFRSBDPSA-N 260.381 2.138 10 10 CECE FC(F)Oc1ccc(N2CC[C@H](C3CNC3)C2)cc1 2278480639 IFLNRZUCXFFTMV-JTQLQIEISA-N 268.307 2.334 10 10 CECE Nc1ccc(CN=c2cccc(OC(F)F)[nH]2)cc1 2269036927 GRCHTBLAISEORD-UHFFFAOYSA-N 265.263 2.299 10 10 CECE Cc1cc(N2Cc3cnn(C)c3C2)ccc1[C@H](C)N 2269667809 QVUAQZJYUBCKEG-NSHDSACASA-N 256.353 2.268 10 10 CECE CN[C@H](C)c1ccc(N2CC=CC[C@@H]2CO)cc1C 2269670028 SFIYTHARTPCSAG-UKRRQHHQSA-N 260.381 2.403 10 10 CECE C[C@H](c1cc(O)ccc1O)N1CCC[C@](F)(C(=O)O)C1 2280529917 WYVOARAQPNKYMK-YMTOWFKASA-N 283.299 2.048 10 10 CECE OCC1(CNCc2ccc(F)c(F)c2O)CC(F)(F)C1 2281674033 SKAMFJNSXYFIGD-UHFFFAOYSA-N 293.260 2.168 10 10 CECE CCP1(=O)CCC(Nc2c(N)cccc2C(N)=O)CC1 2283571142 UKNRDBCVBIMOHT-UHFFFAOYSA-N 295.323 2.325 10 10 CECE CNC(=O)[C@@]1(C)CCN(c2ccc([C@@H](C)O)c(C)c2)C1 2285171480 IBDMTOKRODLVCW-WBMJQRKESA-N 276.380 2.011 10 10 CECE CC1=CCN(Cc2ccc(N3CCNCC3)cc2)CC1 2286074521 ZSWMPCPTIANWLE-UHFFFAOYSA-N 271.408 2.248 10 10 CECE CCCCN1C(=O)NC(=O)C(=CC=Cc2ccco2)C1=O 2296556031 SETMMDLKNXBECG-UHFFFAOYSA-N 288.303 2.098 10 10 CECE O=C(Nc1cccc(F)c1)c1cc(O)c(O)c(O)c1 586730867 CEUMIPITZBGCRG-UHFFFAOYSA-N 263.224 2.195 10 10 CECE O=C1NC(=S)SC1=Cc1ccc(N2CCCC2)nc1 2298752296 VUWQRQZDIGYKRL-UHFFFAOYSA-N 291.401 2.171 10 10 CECE Nc1ccc(OC[C@@H](O)CSCC(F)(F)F)cc1 2313547187 RUADDMFALMANRU-SECBINFHSA-N 281.299 2.304 10 10 CECE C[C@]12C[C@H](C1)[C@H](CN1CC[C@H](CN=[N+]=[N-])C1)CO2 2316061583 YWLNHYWSMOSIHG-LPWJVIDDSA-N 250.346 2.434 10 10 CECE CSc1cc(N2C[C@H]3COCC[C@@H]32)ccc1CN 2328538385 JVFGPPYZOADTOK-AAEUAGOBSA-N 264.394 2.092 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H]3CN)c(OC)c1 2330483075 PUKDBFUEQSQRKW-LOWVWBTDSA-N 262.353 2.020 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@@H]2CC[C@H]3C[C@@H]2CO3)CC1 2330532346 SPRAPPDBZHVQEL-OUAUKWLOSA-N 264.329 2.008 10 10 CECE CC[C@@H](NC)c1ccc(N2C[C@@H](F)[C@H](CO)C2)cc1 2330777417 IGBNYGMPQBNZDA-NWANDNLSSA-N 266.360 2.124 10 10 CECE C[C@@H](N[C@H]1CO[C@]2(C)C[C@H]1C2)c1ccc(O)cc1O 2337738871 MHWCADAOIPCHSD-NRWDQBFYSA-N 263.337 2.316 10 10 CECE OCc1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]32)cc1C1CC1 2339143996 RLXTZIRHIINUKU-BPUTZDHNSA-N 259.349 2.016 10 10 CECE CN[C@@H](C)c1ccc(N2CC([C@H](C)O)C2)c(C)c1C 2340846850 BAHAJFOZNKPHQQ-STQMWFEESA-N 262.397 2.401 10 10 CECE CN(Cc1ccccc1O)[C@@](C)(CC1CC1)C(=O)O 2351138443 ACYPZBSDZBNYJU-HNNXBMFYSA-N 263.337 2.467 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@@H]2C[C@H]1CC2(F)F 2354318973 YSUOBKGDDHSMNN-ZNIXKSQXSA-N 283.318 2.449 10 10 CECE N[C@H]1C(=O)Nc2cc(N3C[C@@H]4CC=CC[C@@H]43)c(Cl)cc21 2355614667 DYYAXSLOBWOZGJ-ORUWWINDSA-N 289.766 2.447 10 10 CECE OCc1ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)cc1C(F)(F)F 2355624924 YOLMRKOPDULGOU-CKLFPEKLSA-N 287.281 2.157 10 10 CECE CC(C)CNC[C@H](O)CCSc1nccs1 309307234 ZODKKHWRUMSTQL-SNVBAGLBSA-N 260.428 2.232 10 10 CECE CCN(CC(=O)N(C)C)c1ccc(CNCC(C)C)cc1 62737296 NNMKROGPKHSGON-UHFFFAOYSA-N 291.439 2.347 10 10 CECE CN1C(=O)/C(=C\c2ccc(Cl)s2)C(O)=NC1=S 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Cc1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N([C@H]3C[C@H]3C)C2)c1 368331502 KALPXDXSFBDPDC-COMQUAJESA-N 288.391 2.361 10 10 CECE COc1cccc(CNCCc2cccnc2OC)c1O 289690210 DDZURQQAEVJHTL-UHFFFAOYSA-N 288.347 2.137 10 10 CECE CC[C@H](NC(=O)/C=C/c1ccc(N(C)C)cc1)[C@H](C)O 387331726 SESNEPABNCDJKO-FMUZQAFBSA-N 276.380 2.041 10 10 CECE CN(C)c1ccc([C@@H](N)Cc2cc(Cl)n(C)n2)cc1 706157528 BYWJLVSDSGWVHX-ZDUSSCGKSA-N 278.787 2.382 10 10 CECE COc1ccc(CNC(C)C)cc1CO[C@H]1CCOC1 110526977 MABURHZSYNJHJT-HNNXBMFYSA-N 279.380 2.499 10 10 CECE COc1ccc(N2C[C@@]3(C)CNC[C@]3(C)C2)c(OC)c1 2162672994 NVVPRIIZCVKXPN-HZPDHXFCSA-N 276.380 2.140 10 10 CECE CN(C)c1ccc([C@@]2(N)CCCN3CCSC[C@H]32)cc1 2163060424 BPTJTXZBYDTZQD-HOTGVXAUSA-N 291.464 2.118 10 10 CECE CN(C)c1ccc([C@@H](N)[C@H]2CCc3nccn3C2)cc1 2163067347 WBFUXDCFWLKKRP-XJKSGUPXSA-N 270.380 2.212 10 10 CECE CN1CCc2cc([C@H](O)[C@@]3(CN)CC34CCC4)ccc21 2163075308 BRXAGOQZARQGND-RDJZCZTQSA-N 272.392 2.231 10 10 CECE CCN(CC)c1ccc([C@@H](Cn2ccnn2)NC)cc1 2163099289 HOEBGNLXZMLIAT-OAHLLOKOSA-N 273.384 2.085 10 10 CECE CN1CCc2cc([C@H](N)C34CCCN3CCC4)ccc21 2163127023 MVENLXZSONSSLZ-INIZCTEOSA-N 271.408 2.307 10 10 CECE CCN(CC)c1ccc([C@@H](N)c2c(C)nnn2C)cc1 2163142755 DHBAZXCFSCMLGK-CQSZACIVSA-N 273.384 2.018 10 10 CECE COCO[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N=[N+]=[N-] 705903749 BMTNBTCVZKIDOW-NXEZZACHSA-N 286.332 2.295 10 10 CECE CC[C@@H](NCc1cccc(C)c1O)[C@@H](O)C(F)F 295128605 XROMJWSRHATHKA-ZYHUDNBSSA-N 259.296 2.195 10 10 CECE C[C@@H](C(=O)N(C)Cc1ccc(N)cc1)[C@@H]1CCCCO1 711901436 QRFFAZFOKHIOGK-DOMZBBRYSA-N 276.380 2.432 10 10 CECE O=[N+]([O-])c1ccc(N(CC(F)F)CC(F)F)cc1CO 719446785 UYRSUGAHQRJKSG-UHFFFAOYSA-N 296.220 2.424 10 10 CECE CCN(CC)c1ccc(CN(C[C@H](O)CO)C(C)C)cc1 817417484 HOTPLOKSHQZWQY-KRWDZBQOSA-N 294.439 2.096 10 10 CECE C[C@@H](N)c1ccc(N(C)CC(=O)NC2CC2)cc1Cl 723177344 RTAVKPCLGJJZIQ-SECBINFHSA-N 281.787 2.075 10 10 CECE CNCc1ccc(N(C)Cc2nn(C)cc2C)cc1C 723523768 LPHUJQUEYJBKQU-UHFFFAOYSA-N 272.396 2.393 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CC(=O)NC)cc1Cl 723183175 QVFQFSMIXGBPGT-JTQLQIEISA-N 283.803 2.193 10 10 CECE Cc1cc(OC[C@@H]2C[C@@H]2C)ccc1N1CCNCC1 722639418 XMVNHGIPSPLRCY-JSGCOSHPSA-N 260.381 2.439 10 10 CECE CO[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)C(C)(C)C 588405826 UQEXMKMOXKPIBM-QPBFKRLHSA-N 293.363 2.288 10 10 CECE C[C@H](NCCCn1ccnn1)c1ccc(Cl)cc1O 841754710 UZDPUPTUINSBGI-JTQLQIEISA-N 280.759 2.378 10 10 CECE CCOc1ccc(O)c(CN(C2CC2)[C@@H]2CCNC2)c1 843056333 YHOQCXPVLNFCJD-CQSZACIVSA-N 276.380 2.117 10 10 CECE CN(C[C@]1(C)CCOC1)C(=O)Nc1ccc(N)cc1 687507584 GLSVPYIJETWJAS-AWEZNQCLSA-N 263.341 2.159 10 10 CECE C[C@H](NC[C@@H]1CNC[C@H]1C)c1cc(F)cc(F)c1O 925787234 XTPVAXXUDAELLY-UTLUCORTSA-N 270.323 2.177 10 10 CECE O=C(NCCOCC1CCC1)NCc1c(O)cccc1F 921988028 YWLZAKSKWLOGAT-UHFFFAOYSA-N 296.342 2.147 10 10 CECE O=C(CSCC(F)(F)F)NCc1c(O)cccc1F 928706589 YALFKFRCTJILQN-UHFFFAOYSA-N 297.273 2.443 10 10 CECE Cc1cc(COC(=O)c2ccc(C)c(O)c2O)c(C)nn1 922401028 DZYWTMMMWMTQMP-UHFFFAOYSA-N 288.303 2.170 10 10 CECE Cc1ccc([C@H](C)N[C@H]2CCN(CC(C)(C)O)C2)c(O)c1 866412905 NSIGRNMUIKHKCH-KBPBESRZSA-N 292.423 2.196 10 10 CECE C[C@@H](N[C@H]1CCN(CC(C)(C)O)C1)c1ccc(F)cc1O 866412112 DEGCRUVFOWSTLE-YPMHNXCESA-N 296.386 2.027 10 10 CECE C[C@H]1C[C@@H]1CCNC(=O)CCOc1ccc(N)cc1 1875970249 JNNXXQZZGVWGAV-RYUDHWBXSA-N 262.353 2.200 10 10 CECE Cc1ccc(N)cc1C(=O)NCc1ccc(N)cc1 1876513305 FCZJQQCHJOKCKM-UHFFFAOYSA-N 255.321 2.089 10 10 CECE CCN(C(=O)NC[C@H](C)COC)c1ccc(N)cc1 1877625062 RIRBKWYBWMSTHF-NSHDSACASA-N 265.357 2.087 10 10 CECE FC(F)COc1ccc(N2C[C@H]3CC[C@H]2CN3)cc1 1879907395 GMMQEOIHTGXGGT-PWSUYJOCSA-N 268.307 2.271 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@]12CCOC[C@@H]1C2 1880241668 XATKKOFIEHDYMI-NUEKZKHPSA-N 260.381 2.440 10 10 CECE Oc1cccc(F)c1CN[C@H]1COC2(CCC2)C1 896640479 QPJVMUVXRIHYQY-SNVBAGLBSA-N 251.301 2.333 10 10 CECE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C(=O)NCCN=[N+]=[N-])C1 1885562727 JWBOWMHOWMORLE-NXEZZACHSA-N 297.359 2.106 10 10 CECE CN(CC(=O)N1CCC(N=[N+]=[N-])CC1)C(=O)OC(C)(C)C 1885563470 VDXKYVWTTIOERK-UHFFFAOYSA-N 297.359 2.155 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@H](CC(=O)NCCN=[N+]=[N-])C1 1885557882 VWFOKFLTKCLMFD-MGCOHNPYSA-N 297.359 2.106 10 10 CECE Oc1ccc(CNCC/C=C/Br)c(O)c1 1961337535 XDQMRWSIKGMPDK-ORCRQEGFSA-N 272.142 2.486 10 10 CECE O=C(NCc1c(O)cccc1O)C1(C(F)(F)F)CCC1 1304053386 JSKLGUPLIHOAIX-UHFFFAOYSA-N 289.253 2.447 10 10 CECE CCOC(=O)CCN1C[C@@H](C)Nc2cc(OC)ccc21 76928017 GIWCTBLNVLNHRF-LLVKDONJSA-N 278.352 2.269 10 10 CECE CC[C@H](CO)CNCc1cc(Cl)cc(OC)c1O 1963167974 PCKYZRFHQFVKFS-VIFPVBQESA-N 273.760 2.162 10 10 CECE COc1cc(Cl)cc(CN[C@H]2C[C@@H](OC)C2)c1O 1963420646 HHRYJQAMEKKCCI-PHIMTYICSA-N 271.744 2.321 10 10 CECE CNCc1nc2cccc(C(=O)O)c2n1-c1ccc(N)cc1 76044694 MRIIAHHWDKYZSM-UHFFFAOYSA-N 296.330 2.025 10 10 CECE COc1ccc(CNC[C@H](C)N2CCCCC2)c(O)c1 40906800 YUYQHAZHRFGVJK-ZDUSSCGKSA-N 278.396 2.365 10 10 CECE CCNCc1ccc(N2C[C@H](O)CC[C@H]2C)c(F)c1 399311706 CKGAJPJDOYOOLW-DGCLKSJQSA-N 266.360 2.285 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCN2C)c1nncs1 1892859187 MHFTZUAVECNKPR-SNVBAGLBSA-N 274.393 2.381 10 10 CECE C[C@H](NC(=O)c1ccc2nnn(C)c2c1)c1ccccc1O 1171730990 VSPHOFAZIHYFIZ-JTQLQIEISA-N 296.330 2.165 10 10 CECE C[C@@H]1C[C@H](CNCc2ccc(F)cc2O)CCO1 1964600258 HQJBYSNTNVASQZ-GHMZBOCLSA-N 253.317 2.436 10 10 CECE CSC[C@H]1CCN(CCc2ccc(N)cc2)C1 706668326 YCPDUUBSBCIQEA-ZDUSSCGKSA-N 250.411 2.496 10 10 CECE Nc1ccc(OCCC(=O)N2CCC3(CC2)CC3)cc1 707024574 WBLKNFMDDIOVLZ-UHFFFAOYSA-N 274.364 2.440 10 10 CECE C[C@H](C(=O)NCc1ccccc1O)[C@@H]1CCCCO1 711917056 YZKAHTUTRKCYIR-FZMZJTMJSA-N 263.337 2.214 10 10 CECE CCN1CC[C@H](NC)[C@]1(C)c1ccc(N(C)C)cc1 712119180 NFNMKRWCILPRKJ-HOTGVXAUSA-N 261.413 2.281 10 10 CECE CNCc1cc(F)c(N2CCC[C@@H](C)[C@H]2CO)c(F)c1 688628585 TYXWBWXGYBAYHO-QMTHXVAHSA-N 284.350 2.281 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](CO)CC[C@H]2C)c(F)c1 688707325 ZELVOHDYEMASNQ-UTUOFQBUSA-N 266.360 2.443 10 10 CECE O=C(O)C1=CC[C@H](NCc2c(O)ccc(Cl)c2F)C1 1327604963 UWYMAYFFILLONL-QMMMGPOBSA-N 285.702 2.448 10 10 CECE CCc1cccc(CNCC[C@@H](O)C(F)(F)F)c1O 717405121 DZCMRHVYVUIGEC-LLVKDONJSA-N 277.286 2.358 10 10 CECE Cc1cnc(CN(c2ccc(CN)cc2)C2CC2)cn1 693763952 LVVKMKHUTORMDQ-UHFFFAOYSA-N 268.364 2.413 10 10 CECE C[C@H](N[C@H]1CO[C@H](C2CC2)C1)c1cc(O)ccc1O 691461594 JNTXFLGQUCVBLO-ISOBSLSZSA-N 263.337 2.316 10 10 CECE CC1(C)C[C@H](NC(=O)Nc2ccc(N)cc2)C[C@H](O)C1 693842390 BFNNBYUOZNTING-OLZOCXBDSA-N 277.368 2.330 10 10 CECE NCc1ccc(N2[C@H]3CC[C@H]2COC3)c(Cl)c1 695053156 FFQHMMFMOJPGCV-QWRGUYRKSA-N 252.745 2.166 10 10 CECE Cc1ccc([C@@H](C)N(C)CCCS(C)(=O)=O)c(O)c1 694183608 OTLRCISGGVSFCV-GFCCVEGCSA-N 285.409 2.128 10 10 CECE Cc1c(CN[C@H]2CC23CC(O)C3)n(C)c2ccccc12 724982059 JNIQYBUQPFEXSD-PDOTXMHQSA-N 270.376 2.490 10 10 CECE COC[C@H](C)Oc1ccc(N2CCC(N)CC2)c(F)c1 87439436 KDVKGKWZCFMGBJ-NSHDSACASA-N 282.359 2.167 10 10 CECE Fc1cc(CNC2CC2)cc(F)c1N1CC2(COC2)C1 697121242 QTMTZVXETUBQNL-UHFFFAOYSA-N 280.318 2.053 10 10 CECE CC(C)[C@H]1COC[C@@H]1NC(=O)Nc1ccc(N)cc1 699771774 BYAKGOHQSGDRTE-OLZOCXBDSA-N 263.341 2.061 10 10 CECE COc1ccc(N(C)CCC[C@H](C)O)cc1OC 789312593 SBEFURXRHBETAB-NSHDSACASA-N 253.342 2.301 10 10 CECE CN(C)c1ccc(Cn2c3ccccc3c(=O)n2C)cc1 1196972867 NEZWEYUCNVZYSE-UHFFFAOYSA-N 281.359 2.454 10 10 CECE CCn1ncc(N)c1NCc1cnc(SC)s1 2248708590 RJVCUEVVFYJJLR-UHFFFAOYSA-N 269.399 2.276 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H](N)C(C)(C)F)ccc21 2117551486 PBFJTZJUMGTYDX-ZIAGYGMSSA-N 266.360 2.178 10 10 CECE Cc1coc(C(=O)NCc2cccc(O)c2O)c1C 1455315729 KZQMVESBAHFFST-UHFFFAOYSA-N 261.277 2.238 10 10 CECE CC12CC(C(=O)NCC3(CN=[N+]=[N-])CC3)(CCO1)C2 2117729453 WPFXYWCDRKYFKF-UHFFFAOYSA-N 264.329 2.152 10 10 CECE CN(C(=O)COc1ccc(N)cc1)[C@H]1CC=CCC1 2118461600 SGCXNJUBTDKFEA-ZDUSSCGKSA-N 260.337 2.215 10 10 CECE Cc1nnc(NCc2ccc3cccnc3c2O)nc1C 1458448106 LDWDTPXXESABAT-UHFFFAOYSA-N 281.319 2.354 10 10 CECE O=C(COc1ccccc1F)N1Cc2cccc(O)c2C1 1471355642 OVYJCYGYPMBUCJ-UHFFFAOYSA-N 287.290 2.453 10 10 CECE C[C@@H](c1ccc(Cl)cc1O)N1CCO[C@H](CN(C)C)C1 2203363239 QZBNGRYBSILYTD-WCQYABFASA-N 298.814 2.369 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@H]1Cc2ccc(F)cc21 1471662108 OMHDIQQQAZGMJV-AWEZNQCLSA-N 287.290 2.193 10 10 CECE COC[C@]1(F)CCN(c2ccc([C@H](C)N)cc2F)C1 2123227871 PEQHNQYDQNGHPO-HZMBPMFUSA-N 270.323 2.410 10 10 CECE CCCC[C@H](O)CCC(=O)NCc1ccccc1O 1545682180 VNYUZHRBWXARGQ-ZDUSSCGKSA-N 265.353 2.340 10 10 CECE Cn1cccc1C(=O)NCc1cc(Cl)ccc1O 1628667195 ROBJSFXHCNLXKO-UHFFFAOYSA-N 264.712 2.314 10 10 CECE O=C(/C=C/c1cccs1)NCc1ccc(O)cc1O 1639444633 SWJYVBTYAHOJRR-AATRIKPKSA-N 275.329 2.489 10 10 CECE O=C(Cc1ccc(O)c(O)c1)NCCC1CC(F)(F)C1 1638626482 NFRVHYXLVYBYJE-UHFFFAOYSA-N 285.290 2.192 10 10 CECE Cc1ncsc1/C=C\C(=O)NCc1cccc(O)c1O 1643813197 YSUPCKWLTYLUSI-WAYWQWQTSA-N 290.344 2.192 10 10 CECE CO[C@@H](CN1CCC(N=[N+]=[N-])CC1)C1CCOCC1 1912163575 LETFSYZRZKSZJY-ZDUSSCGKSA-N 268.361 2.203 10 10 CECE Cc1cc(N2C[C@H](O)[C@@H]2C)ccc1CNCC(C)C 2126121488 BZUUNMRQDLWSKC-BBRMVZONSA-N 262.397 2.310 10 10 CECE O=C(NCc1c(O)cccc1O)c1ncsc1C1CC1 1597574741 RLTVDTKRSRDRBX-UHFFFAOYSA-N 290.344 2.362 10 10 CECE CN[C@H]1CCCc2cc(N3CCC[C@H](O)C3)ccc21 2128279981 WFFSNNNBEHQXMA-HOCLYGCPSA-N 260.381 2.245 10 10 CECE CN[C@H]1CCCc2cc(N3CC[C@](C)(O)C3)ccc21 2128279788 TYNZAZMVVKOJQL-HOTGVXAUSA-N 260.381 2.245 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](C)[C@@H](O)C3)ccc21 2128315300 QHQZRWRWPHHIMD-XZJROXQQSA-N 260.381 2.100 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2N)[C@H]1CCCC[C@@H]1O 2128310625 JZWTXCBXPZDMOS-PMPSAXMXSA-N 260.381 2.372 10 10 CECE CN(C(=O)CN1CC[C@H]2CCCC[C@@H]21)c1ccc(N)cc1 162402626 MUXCRAVIKJDQAE-CJNGLKHVSA-N 287.407 2.496 10 10 CECE CN(C)c1ccc([C@H](NC(=O)C2CC2)c2nccn2C)cc1 169813040 WKRUZLLHLJICAC-HNNXBMFYSA-N 298.390 2.102 10 10 CECE CCC[C@@H](C)CNC(=O)[C@H]1CNc2ccccc2N1 2129804954 GJOMOSSQKXDAQK-BXUZGUMPSA-N 261.369 2.445 10 10 CECE CCN1CCN(/N=N/c2ccc(OC)c(OC)c2)CC1 1860485333 DFEBAURDSPRWNZ-FOCLMDBBSA-N 278.356 2.340 10 10 CECE N[C@@H]1CCCC[C@@H]1c1nc(-c2ccc(O)c(O)c2)no1 236309153 KIWTWJCDMBQLAL-VHSXEESVSA-N 275.308 2.133 10 10 CECE COc1ccc(N(C)[C@H]2CNC(C)(C)C2)cc1OC 258907483 VGBIZULUJMHUKP-GFCCVEGCSA-N 264.369 2.281 10 10 CECE NC[C@@H](c1ccccc1O)N1CCN(c2ccccc2)CC1 32053593 TZHXXBBCNIPKHK-KRWDZBQOSA-N 297.402 2.214 10 10 CECE CC[C@@H](C(=O)Nc1ccc(N)cc1)n1ccc(C)cc1=O 33512770 TYLWJLSVZPHMDN-AWEZNQCLSA-N 285.347 2.329 10 10 CECE CO[C@H]1CC[C@H](N2CCCc3cc(CN)ccc32)C1 2130623803 RDODNAIURYQPOF-GJZGRUSLSA-N 260.381 2.465 10 10 CECE Cc1ccnc2[nH]c(-c3cc(O)c(O)c(O)c3)nc12 2132405536 ZXBPJGXFBRCYKJ-UHFFFAOYSA-N 257.249 2.050 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C[C@@H]1CC2(CCOCC2)O1 2133056996 LTKXSJBBYUHYIC-NEPJUHHUSA-N 266.345 2.099 10 10 CECE Nc1ccc(OC[C@@H](O)CN2CCCCC23CC3)cc1 1915553497 AKECOMZPMOCEHV-AWEZNQCLSA-N 276.380 2.027 10 10 CECE CCC[C@@H]1C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 2135269651 XYXRJSZJLCDKAP-NEPJUHHUSA-N 263.337 2.193 10 10 CECE O=C(O)C=Cc1ccc(N2CCOCC23CC3)cc1 1915575160 YGISYJGPLWZKIT-UHFFFAOYSA-N 259.305 2.154 10 10 CECE CN(CC1(O)CCC1)c1ccc(CO)cc1Cl 1914598957 QXBHLJVMQHPBLA-UHFFFAOYSA-N 255.745 2.184 10 10 CECE CC(C)[C@H]1CCCN1c1ccc2c(c1)NC(=O)[C@H]2N 251387712 JBMWHSOVBBMQAB-KGLIPLIRSA-N 259.353 2.263 10 10 CECE C[C@H]1CN(Cc2ccc(F)cc2O)C[C@@H]1CC(=O)O 2139771153 VBFKSZWDDICNLU-ONGXEEELSA-N 267.300 2.074 10 10 CECE CN[C@H]1CCCC[C@@H]1N(C)Cc1ccc(F)cc1O 2139774633 XLNFRDJKPIZWRU-KBPBESRZSA-N 266.360 2.494 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1[C@H]2CCOC[C@@H]21 1968788521 FIJGPDBOCXJZHC-GVUJHPQVSA-N 275.348 2.194 10 10 CECE C[C@H]1CCN(Cc2c(O)cccc2Cl)[C@@H]1C(=O)O 227165496 IEGIFHHVDCKSAX-UFBFGSQYSA-N 269.728 2.341 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CCCN3C[C@@H]2C)cc1 227461551 ZFEDTHLSXLPCOE-XEZPLFJOSA-N 259.397 2.379 10 10 CECE C[C@H](c1ccc(O)cc1O)N1[C@H]2CC[C@H]1CC(N)C2 251577190 VOKHOHNEUBXCPJ-USWWRNFRSA-N 262.353 2.113 10 10 CECE COc1ccc(O)c(CNCC23COC(C)(C2)C3)c1 1967898489 SNSBEFDHOMKWLT-UHFFFAOYSA-N 263.337 2.060 10 10 CECE CN[C@@H](C)c1ccc(N(CCO)C2CCC2)c(F)c1 228398447 XPUMRVFZADMONF-NSHDSACASA-N 266.360 2.457 10 10 CECE CC1(C)CC[C@@H](NCc2ccc3c(c2)CCO3)CN1 1967989815 GQYAWQOWFAZAJV-CQSZACIVSA-N 260.381 2.242 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H](N)C3(CCC3)C2)c1O 1967992576 VDWLCMUYKUFJHX-CYBMUJFWSA-N 296.798 2.367 10 10 CECE CN(CC[C@H]1CN2CCC1CC2)c1ccc(CN)cc1 2151318068 AJBCVCAISFTLMK-INIZCTEOSA-N 273.424 2.313 10 10 CECE COC1(OC)CC(CN[C@@H](C)c2ccc(O)cc2O)C1 2146903404 LTKSIKMNPLMFSY-JTQLQIEISA-N 281.352 2.148 10 10 CECE CNCc1cccc(NC(=O)c2cccc(O)c2O)c1 126654827 RGVQBSTYNXPLSQ-UHFFFAOYSA-N 272.304 2.070 10 10 CECE COc1ccc(O)c([C@H](C)N(C)C[C@@H]2CCCNC2)c1 234973922 DCEXXKJZPCHNHH-QWHCGFSZSA-N 278.396 2.393 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@@H]2C[C@H](O)[C@H]2C1 2151396015 HJXOSXONIVKOFI-ZOBUZTSGSA-N 274.408 2.310 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2Cc1cn(C)cn1 2151439328 QGRRXIJCVIZROV-LBPRGKRZSA-N 270.380 2.263 10 10 CECE CO[C@@H]1CCN([C@H](C)c2cc(C)ccc2O)[C@H](CN)C1 252780238 SPBVWPCNOCIRJE-HZSPNIEDSA-N 278.396 2.200 10 10 CECE C[C@@H]1CN(C)CC[C@H]1NCc1ccc2c(c1)CCN2C 252699523 UPRDYCZBORFNRC-CZUORRHYSA-N 273.424 2.109 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@H]2C(=O)N(C)C)c(Cl)c1 2143710057 VZFRRUPMHMDUDP-YGRLFVJLSA-N 295.814 2.417 10 10 CECE CCOCCOCCN1CCc2cc([C@H](C)N)ccc21 2143848475 SPGSXFHTCXNQCZ-ZDUSSCGKSA-N 278.396 2.122 10 10 CECE CSc1ccc([C@@H]2C[C@@H](CN)CN2C)c(O)c1 258666785 OQXPHRDRQJIHKP-CABZTGNLSA-N 252.383 2.066 10 10 CECE Cc1noc2ncnc(NCc3ccc(N)cc3)c12 159528528 PSCUZXLDOYKSSO-UHFFFAOYSA-N 255.281 2.121 10 10 CECE C[C@@H]1CC[C@H](CNC(=O)CCOc2ccc(N)cc2)S1 2151676861 YKDWRQLAARFWGK-BXUZGUMPSA-N 294.420 2.438 10 10 CECE C[C@H](Cn1ccnc1)N[C@H](C)c1ccc(O)cc1O 37158001 TYEOYAVWMMQHEO-GHMZBOCLSA-N 261.325 2.034 10 10 CECE CN(C)c1ccc2c(c1)OCCN2C[C@@H]1CCCN1C 2146281883 JXENOTDPSQNMSI-AWEZNQCLSA-N 275.396 2.046 10 10 CECE NN[C@H](c1ccccc1O)c1cccc2cccnc12 2146239596 GTBVWVSGQDWENX-MRXNPFEDSA-N 265.316 2.493 10 10 CECE COC[C@]1(OC)CCCN(Cc2cccc(F)c2O)C1 2151849202 OWNQDJSQJCXQDN-HNNXBMFYSA-N 283.343 2.159 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CCSC)c(Cl)cc21 167638243 JKBIEEGIFRTZJW-LBPRGKRZSA-N 299.827 2.352 10 10 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C[C@@H](O)c1cc(F)c(N2CC[C@H](O)[C@@H]3CC[C@@H]32)c(F)c1 2194518228 NUXFUPFRKLHYPS-PGOKHVGTSA-N 283.318 2.368 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCC[C@H]3N)CC[C@@H]1CO 2184688916 JBECODNFZXTHFC-SUYBPPKGSA-N 274.408 2.477 10 10 CECE Nc1ccc(CCOc2cc([N+](=O)[O-])cc(F)n2)cc1 2184651949 OSWWZNYEUWMYCI-UHFFFAOYSA-N 277.255 2.333 10 10 CECE O[C@H]1CCCc2cc(N3C[C@H](O)CC4(CC4)C3)ccc21 2184683373 ZQPNNALAMFDQMT-ZBFHGGJFSA-N 273.376 2.408 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@H]4C[C@@]4(CO)C3)ccc21 2184711300 PWVQOYYHGYRMTO-XYPHTWIQSA-N 272.392 2.102 10 10 CECE CNCc1ccc(N2CC[C@@H]2CN(C)C)c(Cl)c1 2042681313 BGBAPHFDWNIRBA-GFCCVEGCSA-N 267.804 2.200 10 10 CECE Nc1ccc(COc2cc3nc(O)oc3cc2N)cc1 2198907867 HOETWMLZYDLMQQ-UHFFFAOYSA-N 271.276 2.277 10 10 CECE CCc1nnsc1[C@H](N)c1ccc(N(C)C)cc1 2044718202 INURLDWTFNCCNU-GFCCVEGCSA-N 262.382 2.215 10 10 CECE Cc1cc(CN[C@@H](C)c2c(O)cccc2O)nnc1C 2185741429 QVQVKXMGPGBALS-NSHDSACASA-N 273.336 2.355 10 10 CECE C[C@H]1O[C@@]2([C@@H](NN)c3ccc(N(C)C)cc3)CC[C@H]1C2 2199194555 XRYGGLZDNRCTFD-XTBFLFJDSA-N 275.396 2.215 10 10 CECE CCCOc1cc(N2C[C@@H](C)[C@@H](CCN)C2)ccc1N 2191570649 QKBJZCMYSHAINE-OLZOCXBDSA-N 277.412 2.479 10 10 CECE Cn1ncc2cc([C@@H](N)c3ccccc3O)sc21 2054799296 CCHIEJVICNAQFP-LBPRGKRZSA-N 259.334 2.389 10 10 CECE CN(C)c1ccc(C(=O)Nc2ccc(N)cc2)cc1N 2191749250 GMFSDJYFBNKDJR-UHFFFAOYSA-N 270.336 2.169 10 10 CECE CN(C[C@@H]1CCN1C)c1ccc(CN)c2ccccc12 2186456954 ZQVCAOVONMHREG-AWEZNQCLSA-N 269.392 2.439 10 10 CECE Nc1ccc(CCC(=O)NCC2(F)CCC2)cc1 2057672486 LLNSVBDOFYHAOX-UHFFFAOYSA-N 250.317 2.210 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC1=CSC2=NCCN12 2059058943 OGWOPQNPOAEXQC-SECBINFHSA-N 264.358 2.021 10 10 CECE Cc1cc(N(C)C[C@@H]2OCCOC2(C)C)ccc1CN 2186952110 SXOIOZVVGQSLKH-HNNXBMFYSA-N 278.396 2.084 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CN(C)C(C)(C)C1 2192245190 KNUIXNWOAJXSJG-GFCCVEGCSA-N 278.396 2.221 10 10 CECE CN1CCCC12CN(c1ccc(CO)c(Cl)c1)C2 2066469458 DUMWETNQLAZRLF-UHFFFAOYSA-N 266.772 2.117 10 10 CECE Cc1ccc([C@@H](C)N[C@@H]2COCC2(F)F)c(O)c1 2067442251 SCRNZNSLVJCLEF-BXKDBHETSA-N 257.280 2.385 10 10 CECE C[C@H](N[C@H]1COCC1(F)F)c1cc(F)ccc1O 2067441734 NIRBLDUPJZJGQC-CPCISQLKSA-N 261.243 2.216 10 10 CECE C[C@H](N[C@@H]1CCCO[C@@]12CCOC2)c1ccccc1O 2192624086 TVXMMPSLXMOFIM-APHBMKBZSA-N 277.364 2.381 10 10 CECE C[C@@H](NC(=O)[C@H]1CCCCCCN1)c1ccccc1O 2192623751 SNWATCIINNHOFC-TZMCWYRMSA-N 276.380 2.492 10 10 CECE N[C@@H]1CCCc2cc(N(CC(F)F)C3COC3)ccc21 2196629395 SWLISBIVXDLKSY-CQSZACIVSA-N 282.334 2.493 10 10 CECE CCN1CCc2cc([C@H](N)c3nnccc3C)ccc21 2192717274 YKAQHDRPMDFWLX-HNNXBMFYSA-N 268.364 2.216 10 10 CECE CCCCC[C@@](CC)(NCCCN=[N+]=[N-])C(N)=O 2073352548 IDEKJSNXVFFTQX-GFCCVEGCSA-N 255.366 2.491 10 10 CECE CCN1CCc2cc([C@@]3(O)CN[C@H]3C(C)(C)C)ccc21 2196878675 LTLRKQBKPIMPSX-RDJZCZTQSA-N 274.408 2.275 10 10 CECE COc1ccc(CNC23CC(C)(C2)O[C@H]3C)c(O)c1 2100444966 IZVLYJJERLNKDF-ISAOAKOHSA-N 263.337 2.200 10 10 CECE CN[C@H](C)c1ccc(N2CC(OC(C)C)C2)cc1O 2102491574 UISJHGQURNWFPT-LLVKDONJSA-N 264.369 2.286 10 10 CECE CCCC(=O)NCCCN[C@@H](C)c1ccccc1O 2102500146 NSVVHSZIHZUGHA-LBPRGKRZSA-N 264.369 2.349 10 10 CECE Cc1nc([C@H]2CCN2c2ccc(CN)cc2Cl)no1 2104174100 RMCLWVXOMXBRSF-GFCCVEGCSA-N 278.743 2.442 10 10 CECE CCNCc1ccc(N2Cc3conc3C2)c(F)c1 2104151081 SNFDETRQWNTPPC-UHFFFAOYSA-N 261.300 2.443 10 10 CECE Cc1cccc(CNC(=O)[C@H]2[C@@H](C)C2(F)F)c1O 2084061561 WHMZLWMNENZLLG-PSASIEDQSA-N 255.264 2.218 10 10 CECE CCN(Cc1ccc(F)cc1O)[C@H]1CCN(C)C1 2084090578 WGPBCKFLCRBFED-ZDUSSCGKSA-N 252.333 2.057 10 10 CECE COc1ccc(N2C[C@H](C)CC[C@H]2CN)c(OC)c1 2106370428 IUZAYNYGTXRWLJ-NEPJUHHUSA-N 264.369 2.267 10 10 CECE COc1ccc(N2C[C@H]3CNC[C@H]3C2(C)C)c(F)c1 2106343173 ARQOWLXXFYQAOF-ZYHUDNBSSA-N 264.344 2.269 10 10 CECE C[C@@H]1NCCN(c2ccc3c(c2)OC(F)(F)O3)[C@H]1C 2106364318 ILJVCOBUJFTXMM-IUCAKERBSA-N 270.279 2.195 10 10 CECE CN1CCc2cc(N3CCNCC(C)(C)C3)ccc21 2106799402 WCFOFOSQUWWLLT-UHFFFAOYSA-N 259.397 2.115 10 10 CECE CN1CCCc2cc([C@H](NN)c3ccsn3)ccc21 2106826150 QQHQFRROHVRBGG-AWEZNQCLSA-N 274.393 2.078 10 10 CECE CN1CCc2cc([C@@H](O)c3ccc(CN)s3)ccc21 2106806695 ZORMCSXTDZIIDX-OAHLLOKOSA-N 274.389 2.281 10 10 CECE CCC[C@H](C)[C@@H](O)[C@@H](N)c1ccc2c(c1)CCN2C 2106848837 NLLPSOFJOOPMRO-KNXALSJPSA-N 262.397 2.476 10 10 CECE CN(CCC1CCNCC1)Cc1c(O)cccc1F 2106954387 ANTMGRMVGPFJPX-UHFFFAOYSA-N 266.360 2.353 10 10 CECE CCCN[C@H](c1ccc2c(c1)CCCN2C)[C@H](C)O 2106947134 AECVGFMIJOBZTC-LRDDRELGSA-N 262.397 2.491 10 10 CECE COc1ccc(CN[C@H]2CCCC[C@@H]2OC)c(O)c1 2088261013 JAENOZNPRWWBCQ-ZFWWWQNUSA-N 265.353 2.448 10 10 CECE C[C@H](N[C@H](C)c1ncccn1)c1c(O)cccc1O 2089066261 BRHGTKMGKGQHSL-VHSXEESVSA-N 259.309 2.300 10 10 CECE CNC[C@@H](C)N(C)Cc1ccc2c(c1)CCCN2C 2111831716 FCOQZHCHXFLQKY-CYBMUJFWSA-N 261.413 2.109 10 10 CECE C[C@@](O)(Cc1ccccc1)[C@@H](N)c1ccccc1O 2091866330 FKXMNVXEBSJHCX-JKSUJKDBSA-N 257.333 2.386 10 10 CECE Cc1ccc(C(=O)N(C)Cc2ccc(N)cc2)n1C 2092473508 VIBFEPVKCDDTAS-UHFFFAOYSA-N 257.337 2.188 10 10 CECE O=S(=O)(C[C@H]1CC[C@H](F)C1)Nc1ccc(O)cc1F 2093987660 BBGXHJJCYPSAIY-IUCAKERBSA-N 291.319 2.411 10 10 CECE CC[C@]1(O)CCN(c2ccc([C@@H](C)NC)cc2F)C1 2094380218 OTNGTKWGUAISQY-ABAIWWIYSA-N 266.360 2.457 10 10 CECE CCCC1CN(c2cc3c(cc2F)[C@H](O)C(=O)N3)C1 2095923413 BOKUGKKOPGKJPM-ZDUSSCGKSA-N 264.300 2.048 10 10 CECE CCN[C@H](c1ccccc1O)C1(O)CC(C(F)F)C1 2096910929 QPYLXCZPQMOSRR-VTGPFMDVSA-N 271.307 2.449 10 10 CECE NCc1ccc(N2CCOCCC23CCC3)cc1F 2097873565 RCBHWOFUPBSOEX-UHFFFAOYSA-N 264.344 2.434 10 10 CECE CO[C@H]1CCCN(c2c(F)cc(CO)cc2F)[C@@H]1C 2099126987 XYVKLHDWZLWHIA-RNCFNFMXSA-N 271.307 2.461 10 10 CECE Cn1ccc2c1CN(c1ccc(CO)cc1F)CC2 2114540120 LDECQNPRAIPKPI-UHFFFAOYSA-N 260.312 2.219 10 10 CECE O=C(O)C[C@H]1[C@H]2CC[C@@H](C2)N1Cc1c(O)cccc1F 2201081323 FXJILQYUZWDTHC-KWBADKCTSA-N 279.311 2.359 10 10 CECE CNCc1ccc(N2CC[C@H](OC)[C@@H](C)C2)cc1OC 2204556071 XWFTZUIQJGBHLW-WFASDCNBSA-N 278.396 2.276 10 10 CECE CNCc1ccc(N(C)C[C@H]2CCC[C@H]2O)cc1OC 2204544385 AQETUYOTLGSHHI-UKRRQHHQSA-N 278.396 2.012 10 10 CECE Cc1ccc(CN2C[C@@]3(C)CN(C)C[C@]3(C)C2)c(O)c1 2204647695 XVQQBLZIAUPIBB-IAGOWNOFSA-N 274.408 2.474 10 10 CECE C[C@H](O)c1ccc(N2CCc3ccnc(O)c3C2)cc1 2206103114 DLZKPZLCCKXTFH-NSHDSACASA-N 270.332 2.403 10 10 CECE CCN[C@@H](C)c1ccc(N2CC([S@](C)=O)C2)cc1C 2269663850 YWYWGNKZKRFISK-BUXKBTBVSA-N 280.437 2.233 10 10 CECE Cc1cc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)ccc1[C@@H](C)N 2269667459 XBEXHZFFRLRGHG-MEYUZBJRSA-N 260.381 2.079 10 10 CECE Cc1cc(N2C[C@H]3C[C@@H](O)C[C@H]3C2)ccc1[C@@H](C)N 2269668428 DYJDLFLEWQPRTF-GUIRCDHDSA-N 260.381 2.222 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)cc1C 2270696704 HEUOKUHTUNWXBB-BCUIYNNISA-N 260.381 2.092 10 10 CECE COc1ccc(N2CC(F)(F)C[C@H]2CO)c(F)c1 2219619816 QJFFEHGVKGIPSM-QMMMGPOBSA-N 261.243 2.041 10 10 CECE COCCN(C[C@@H](C)O)c1ccc([C@@H](C)O)cc1Cl 2272334231 DAYCZMFHKCBLTM-GHMZBOCLSA-N 287.787 2.227 10 10 CECE Cc1ccc(O)c(CN[C@@H]2CCCN(C3CC3)C2)c1 2273138571 DYIATBOOXCKSIN-CQSZACIVSA-N 260.381 2.417 10 10 CECE CO[C@@]12CC[C@@H]1CN(c1ccc(CO)cc1Cl)C2 2222809967 HHBNXDLGQPAECU-BXUZGUMPSA-N 267.756 2.448 10 10 CECE C[C@]1(O)C[C@H]2[C@H]1CCN2c1ccc2c(c1)CCC[C@H]2N 2233771264 XPYKXAXPSIXZMQ-NCOADZHNSA-N 272.392 2.372 10 10 CECE CC(=O)c1cc(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])n(C)c1 2234177308 RLSZCEQCZHGJQC-WDEREUQCSA-N 275.312 2.189 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)C1 2224940952 MTOOBUWPURGUOI-WHOHXGKFSA-N 264.329 2.103 10 10 CECE Nc1ccc(CC(=O)N2CCC[C@@H](OC(F)F)C2)cc1 2235671757 HREJFYWUQHKCCO-GFCCVEGCSA-N 284.306 2.042 10 10 CECE CNCc1cc(OC)ccc1N1CCC[C@H]1CCCO 2235977501 RTKGJVMMTZMIPL-AWEZNQCLSA-N 278.396 2.156 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CC[C@H]3C[C@@H]3C)ccc21 2236507899 ILHJVUMZQFSIQG-PGUXBMHVSA-N 273.380 2.382 10 10 CECE OCC1[C@@H]2CN(c3ccc(OC4CCC4)cc3)C[C@@H]12 2226526517 KCBHYUSYZPLKCW-HUUCEWRRSA-N 259.349 2.292 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)CCCN3C)C[C@H]1O 2226662108 OHZAEMBFAXOWKH-BLLLJJGKSA-N 260.381 2.276 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)CCC23CC3)cc1 2227516924 VDOPXEAJDRQRFA-DOMZBBRYSA-N 260.381 2.461 10 10 CECE N[C@@H]1CCc2cc(N3C[C@@H](O)CCC34CC4)ccc21 2227526997 ZCVHMKRMJQDJMK-DZGCQCFKSA-N 258.365 2.126 10 10 CECE COc1ccc(N(C)C[C@@H]2OCC[C@@H]2C)c(CO)c1 2227710084 BGPUUFQKCQYDLS-NHYWBVRUSA-N 265.353 2.049 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CCCc2scnc21 2238100561 QTLKZZXLEYPYKT-HIFRSBDPSA-N 290.388 2.333 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@]2(F)CCOC2)cc1O 2238285174 PYQNSNNCJFYETI-IAQYHMDHSA-N 282.359 2.237 10 10 CECE CC[C@H](C)NCc1ccc(N2CC([S@](C)=O)C2)c(F)c1 2240041963 BSRSFHDXLXXDFG-YBTHPKLGSA-N 298.427 2.281 10 10 CECE C[C@H]1[C@@H](O)CN1c1c(F)cc(CNC2CCC2)cc1F 2240036702 ZTLMZXWBOQSQFM-XPTSAGLGSA-N 282.334 2.176 10 10 CECE Nc1ccc(CCNC[C@@H]2OCC[C@H]2C(F)(F)F)cc1 2240504528 KQUDJDRDBSZGER-OLZOCXBDSA-N 288.313 2.368 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCO[C@H]2COCC[C@@H]21 2240762679 RPSSIHXCBSABPP-RCBQFDQVSA-N 276.380 2.009 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC(c2cnn(C)c2)C1 2240830180 MCTGTCUTPKSCSM-LBPRGKRZSA-N 271.364 2.386 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)CCC(N)=O)cc1C 2285143519 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C[C@@H](NCc1ccc(O)c(O)c1)C1CCOCC1 226760425 IMRDSMAOXXXRJY-SNVBAGLBSA-N 251.326 2.003 10 10 CECE CC[S@](=O)Cc1cc(CNC(C)C)ccc1OC 84006869 HTVGOVDGPUMNEJ-GOSISDBHSA-N 269.410 2.462 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC[C@@H](C)[C@@H]1C(=O)O 227172242 FOQCPUKHDRQDSB-VYUIOLGVSA-N 267.300 2.387 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1csc(C)n1 229259720 QGLSGJAFAXEEMJ-JTQLQIEISA-N 283.357 2.346 10 10 CECE NCc1ccc(N2CCN(C3CC3)CC2)cc1C(F)(F)F 48989667 FEKFECJDCFBYLM-UHFFFAOYSA-N 299.340 2.449 10 10 CECE Oc1ccc(Cl)cc1CNCCc1ncc[nH]1 139225753 HBZKZYNOBRTMRH-UHFFFAOYSA-N 251.717 2.101 10 10 CECE C[C@]1(O)C[C@@H]2[C@@H]1CCN2c1ccc2c(c1)CCCO2 2226673203 MMTUQOYMAUZOMV-LZWOXQAQSA-N 259.349 2.361 10 10 CECE Cc1cnc(Cl)c(NC(=O)c2cc(O)nc(O)c2)c1 235946513 NXBBMJSJMKJTBK-UHFFFAOYSA-N 279.683 2.102 10 10 CECE CCN(c1ccc(CN)cc1)[C@@H]1CC(F)(F)C[C@@H]1O 2133274190 DOMXKFOFFCDPQN-OLZOCXBDSA-N 270.323 2.130 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1c(OC)cnn1C 97449169 VRFBJGZCGBDZFT-OAHLLOKOSA-N 288.395 2.194 10 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271.364 2.465 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3CNCCSC3)ccc21 2163075281 BKTIZBKCOXAKNL-HOCLYGCPSA-N 292.448 2.055 10 10 CECE Cn1ccc([C@@H](N)c2ccc(N3CCCCC3)cc2)n1 2163104601 FGQXNVOIXBIEKM-INIZCTEOSA-N 270.380 2.459 10 10 CECE CN1CCc2cc([C@H](COC3CCCC3)NN)ccc21 2163147679 OEJZFYKHGDUZDS-HNNXBMFYSA-N 275.396 2.143 10 10 CECE CCN(CC)c1ccc([C@@H](N)[C@@]2(O)CCCOC2)cc1 2163155733 ZWHWREBHWDDWHP-HZPDHXFCSA-N 278.396 2.074 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCNCCC23CC3)c1 2163767650 ZCNWMALBGWTFJV-GFCCVEGCSA-N 276.380 2.290 10 10 CECE Nc1ccc(OCC(=O)O[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 2163944730 JQALBEDTMNVGCN-ZSBIGDGJSA-N 283.274 2.235 10 10 CECE C[C@@H]1Oc2c(N)cccc2N(OCc2ccc(N)cc2)C1=O 821297495 ONUURDRCWZXBMI-JTQLQIEISA-N 299.330 2.097 10 10 CECE CCc1nc(CNC/C=C/c2ccc(N(C)C)cc2)n[nH]1 835054313 JNYFGDLDVALJBK-AATRIKPKSA-N 285.395 2.236 10 10 CECE COc1cccc(CNC(=O)[C@@H]2C[C@@H]3C[C@@H]3C2)c1O 830541002 QWQFVONFRSGTAW-GDNZZTSVSA-N 261.321 2.063 10 10 CECE C[C@H](NC1CC(CC(N)=O)C1)c1ccc(Cl)cc1O 903255565 YOSXQAPTFUUSEV-SILCLGDVSA-N 282.771 2.350 10 10 CECE CC1(C)CC[C@@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)O1 588531167 TYJAWRJGTGWAIN-RNZFLTOJSA-N 291.347 2.185 10 10 CECE C[C@@H](NC/C=C/c1ccc(N(C)C)cc1)c1nncn1C 835037768 MRDRCMGANOSPPF-URWSZGRFSA-N 285.395 2.245 10 10 CECE COc1ccc(N2CC[C@H](N[C@H]3CCC[C@H](N)C3)C2)cc1 849350085 JYLAFEXLORFWMK-KKUMJFAQSA-N 289.423 2.133 10 10 CECE CCO[C@@H]1[C@@H](C)[C@@H]1C(=O)N[C@@H](C)c1ccccc1O 913763440 GVOCHUCFABDXIA-TXFQPVFDSA-N 263.337 2.240 10 10 CECE CN(C)c1ccc(CN2CC[C@H](Nc3ncccn3)C2)cc1 843414899 FBQVKKMCJGAXTA-HNNXBMFYSA-N 297.406 2.229 10 10 CECE C[C@@H]1CNCCN1C/C=C/c1ccc(N(C)C)cc1 843047790 VIHHOHRNXOTLHE-ISZGNANSSA-N 259.397 2.060 10 10 CECE CCOc1ccc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c(O)c1 846110308 GLCOEFGBKBPGDS-VXGBXAGGSA-N 269.291 2.488 10 10 CECE C[C@@H]1CCC[C@@H](CNC(=O)NCCc2ccc(N)cc2)O1 851662156 AVIUXJMKTAGZDA-DOMZBBRYSA-N 291.395 2.068 10 10 CECE C[C@@H]1CCC[C@@H](CNC(=O)c2cc(O)cs2)O1 855796633 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276.380 2.146 10 10 CECE CC[C@H](N[C@@H](C)c1ccc(C)cc1O)C(=O)OC 394129090 GCIBPWFEISJDDI-JQWIXIFHSA-N 251.326 2.303 10 10 CECE Cc1cc(N)cc([C@@]2(C)CO[C@H](C(C)C)CN2)c1O 83479690 KDEFDJUBUGPOOA-DZGCQCFKSA-N 264.369 2.142 10 10 CECE Cc1nc(NCc2ccc(N3CCCC3)cc2)nn1C 1327709087 QSTDPBCOMYOTJO-UHFFFAOYSA-N 271.368 2.336 10 10 CECE Oc1c(F)cc(Cl)cc1CN[C@@]12COC[C@@H]1C2 1179606995 BWNJSUIAOWTEHA-UFBFGSQYSA-N 257.692 2.063 10 10 CECE Oc1c(Cl)cccc1CN1CCO[C@@]2(CCOC2)C1 187536095 NZZZARFRNNPRFH-AWEZNQCLSA-N 283.755 2.037 10 10 CECE CC(C)N(CC(C)(C)O)c1ccc([C@H](C)O)c(O)c1 690961786 GOGLNWZTNOWMMR-NSHDSACASA-N 267.369 2.431 10 10 CECE CC[C@H](N)c1ccc(N2C[C@H]3CN(C)C[C@@H]3C2)cc1 706997542 YCTPUYVCARTIIL-FMKPAKJESA-N 259.397 2.094 10 10 CECE CN(CCc1ccc(N)cc1)[C@@H]1CO[C@@H](C2CC2)C1 691766596 NJRRLONWDNRMAM-JKSUJKDBSA-N 260.381 2.311 10 10 CECE COc1ccc(N2[C@H]3CC[C@H]2[C@H](C)[C@H](O)C3)c(N)c1 686169897 BBYNFOASGLEREI-WIHQQPEOSA-N 262.353 2.016 10 10 CECE CN1CCc2cc(CNCCCOC(F)F)ccc21 193656786 MFURYTXAOXFNHW-UHFFFAOYSA-N 270.323 2.398 10 10 CECE CC(C)N1C(=O)CC(=O)[C@@]1(C)c1ccc(N(C)C)cc1 712558713 SFAARVCSHZMERY-MRXNPFEDSA-N 274.364 2.178 10 10 CECE CCC[C@H]1COC[C@H]1N(C)CCOc1ccc(N)cc1 688261059 MEVXZWGPTZEQIS-XJKSGUPXSA-N 278.396 2.395 10 10 CECE CCN(C[C@@H]1CN(C(C)C)CCO1)c1ccc(N)cc1 80747159 UWXRMFVGGMMCSI-MRXNPFEDSA-N 277.412 2.204 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)C[C@H]1CCCSC1 718420963 XBDYWFJQSKDEIY-GFCCVEGCSA-N 293.436 2.282 10 10 CECE C[C@@H]1CC[C@H](N(C)CC(=O)Nc2ccc(N)cc2)CS1 689618608 HUYJCGDPENHCKB-RISCZKNCSA-N 293.436 2.423 10 10 CECE CC(C)[C@H](CO)Nc1c(N)cccc1Br 697740807 NKXGBZXTQCIWJH-JTQLQIEISA-N 273.174 2.460 10 10 CECE [N-]=[N+]=NC1CN(Cc2ncccc2Br)C1 1912193700 PYUBMXFGWNNUNK-UHFFFAOYSA-N 268.118 2.339 10 10 CECE CC(=O)N1CCN(Cc2ccc(Cl)cc2O)[C@H](C)C1 1461957138 HKAWYDBCOAJXCL-SNVBAGLBSA-N 282.771 2.098 10 10 CECE COc1ccc(N2C[C@@H](C)NCC[C@@H]2C)cc1OC 217113462 RIMCXPJJVJZQOZ-NEPJUHHUSA-N 264.369 2.281 10 10 CECE CC[C@@H](C(F)F)N(C)C(=O)COc1ccc(N)cc1 2122249439 TUAPUOXEKFYJSQ-NSHDSACASA-N 272.295 2.150 10 10 CECE CCc1ncncc1CN(C)c1ccc(CO)cc1 2122278669 SKZXWVACTJTVBA-UHFFFAOYSA-N 257.337 2.168 10 10 CECE CC(C)N1CCC[C@@H](C(=O)NCc2c(O)cccc2F)C1 1645050138 DKNFIDZQWKYGTF-GFCCVEGCSA-N 294.370 2.268 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)c2ccncn2)C1 1912164156 SSSLQAKSTSERTR-JTQLQIEISA-N 260.301 2.029 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1nc(C)c(C)s1 1912186413 DECDDLOPRGGXKV-SECBINFHSA-N 283.357 2.264 10 10 CECE [N-]=[N+]=NC1CN(C(=O)c2cc(Cl)c3c(c2)OCCO3)C1 1912158863 ACDKHUCOVCRWRU-UHFFFAOYSA-N 294.698 2.246 10 10 CECE C[C@@H](NCc1cc(F)cc(F)c1O)C(C)(C)CO 1966038939 ZUMIPUYRHBMTOS-MRVPVSSYSA-N 259.296 2.167 10 10 CECE C[C@@H](NCc1ccc2c(c1)CCN2C)c1ncc[nH]1 138895725 WHJZOJCRHUBXKA-LLVKDONJSA-N 256.353 2.253 10 10 CECE O[C@H]1CCCN(c2ccc3c(c2)CCC[C@@H]3O)CC1 2128269226 PTXFHZOYEMLKTR-HOCLYGCPSA-N 261.365 2.408 10 10 CECE C[C@@H]1COC[C@H]1N(C)c1ccc2c(c1)CCC[C@@H]2N 2128274011 YJSDHOPBILSHDU-XFBWCDHKSA-N 260.381 2.494 10 10 CECE CN[C@H]1CCc2cc(N3CC4(CCCO4)C3)ccc21 2128297115 VNOQVLCSMGTOAQ-HNNXBMFYSA-N 258.365 2.263 10 10 CECE CCN(CC)C1CN(c2ccc3c(c2)CC[C@@H]3N)C1 2128326286 FGZUMGOHQHKDJH-INIZCTEOSA-N 259.397 2.163 10 10 CECE O[C@@H]1CCc2cc(N3CC[C@@]4(CCOC4)C3)ccc21 2128321434 IMWUYZVWTSGNTC-HZPDHXFCSA-N 259.349 2.283 10 10 CECE NCC(F)(F)C[C@H](O)c1ccc(N2CCCC2)cc1 2128359331 KRWIQKHVYKIUDY-ZDUSSCGKSA-N 270.323 2.304 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccn(C3CC3)n2)C1 2130247448 BUKQWYQBDWGLLE-SECBINFHSA-N 260.301 2.133 10 10 CECE C[C@@H](c1ccccc1O)N(C)[C@@H]1CCN(C)C(=O)C1 2131933006 YYZNLYIIOGXAAH-NWDGAFQWSA-N 262.353 2.006 10 10 CECE Oc1ccc(Cl)cc1CN1CC[C@]12CCOC2 1203664525 IVTBMKXAWLGQMF-CYBMUJFWSA-N 253.729 2.410 10 10 CECE CCCNCc1ccc(N(C)C[C@H](C)C(=O)NC)cc1 233105180 BMNSYBFRFWBZHZ-ZDUSSCGKSA-N 277.412 2.005 10 10 CECE O=C(NCc1ccccc1O)[C@@]12CCCC[C@H]1OCC2 934936668 WCQQOQLOOZHORR-GDBMZVCRSA-N 275.348 2.358 10 10 CECE O[C@@H]1CCC[C@@H]1CCNCc1ccc2c(c1)CCO2 1913742827 SSZHFNBKPDALBZ-UKRRQHHQSA-N 261.365 2.262 10 10 CECE CP1(=O)CCN(c2ccc(OCC(N)=S)cc2)CC1 2134913911 MUWQFXKPWHATFV-UHFFFAOYSA-N 298.348 2.164 10 10 CECE CC(C)NCc1ccc(N(CCO)C2COC2)cc1Cl 1915502777 ULQAIMWWHMBWTC-UHFFFAOYSA-N 298.814 2.036 10 10 CECE CN[C@@H]1CN([C@H](C)c2cc(C)ccc2O)CC12CC2 2140955219 PNZUSSUTKBOGBO-IUODEOHRSA-N 260.381 2.445 10 10 CECE Cc1ccc([C@@H](C)NC2CC([C@@H](F)CO)C2)c(O)c1 1907285474 QRBCAMBAIYEWDO-NPZBDFSRSA-N 267.344 2.460 10 10 CECE CCNCc1ccc(N2CCOC[C@H]2C)cc1OC 2139685798 HGSXCYKTGULIED-GFCCVEGCSA-N 264.369 2.030 10 10 CECE C[C@H](N)[C@H]1CCN([C@@H](C)c2ccc(N(C)C)cc2)C1 227199434 OIILDWIOWOIMBW-YDHLFZDLSA-N 261.413 2.483 10 10 CECE CN(Cc1ccc(F)cc1O)[C@H](CC(=O)O)C(F)F 2139772980 XLZYDGPWLSNLHA-SECBINFHSA-N 277.242 2.072 10 10 CECE CN(Cc1ccc(F)cc1O)[C@@H]1C[C@@H]2CC[C@H](C1)N2 2139769995 BTOCDWMUSFRBNE-WDNDVIMCSA-N 264.344 2.246 10 10 CECE Cc1cccc(CNC(=O)N2C[C@H]3CC[C@H]3C2)c1O 2139747056 ZGBBGANKMNQLMU-BETUJISGSA-N 260.337 2.252 10 10 CECE CC[C@H](OC)C(=O)N(C)[C@H](C)c1ccccc1O 1924084129 RDXUJLOPAUCICA-MFKMUULPSA-N 251.326 2.337 10 10 CECE C[C@@H](N[C@@H]1CCN(C)C1(C)C)c1c(O)cccc1O 1924310023 AJQDMWJIKGSNLR-ZWNOBZJWSA-N 264.369 2.231 10 10 CECE Oc1ccc(F)cc1CNCc1cccn2ccnc12 1967691507 CLJRHCOQKDUWMM-UHFFFAOYSA-N 271.295 2.469 10 10 CECE COc1ccc([C@@H](C)N(C)C[C@H]2CCCN2C)c(O)c1 251533274 NCNPUHNNUSOTJW-CHWSQXEVSA-N 278.396 2.488 10 10 CECE C[C@H](N)[C@H]1CCCCN1[C@H](C)c1ccc(O)cc1O 251565701 TUABCKSLILWYKW-MISXGVKJSA-N 264.369 2.361 10 10 CECE COc1cc(Cl)cc(CN(CCC(=O)O)C2CC2)c1O 229118223 DMBWYINAMYDFNH-UHFFFAOYSA-N 299.754 2.493 10 10 CECE COc1ccc([C@H](C)NCCOCC2CC2)c(O)c1 230661287 KYXQCTMAYXAOPE-NSHDSACASA-N 265.353 2.478 10 10 CECE CCCN(Cc1ccccc1O)C[C@H]1CCOCO1 1969162955 OAXQMGPZIRPSSV-CQSZACIVSA-N 265.353 2.367 10 10 CECE O=C(O)[C@@H]1C[C@H]2C[C@H]1CN(Cc1c(O)cccc1F)C2 1968222719 HCQLQCXMXQDBOY-OUAUKWLOSA-N 279.311 2.074 10 10 CECE [N-]=[N+]=NCCN[C@]1(C(=O)O)CC[C@H]1OCc1ccccc1 1934875006 OXBTXZFIDPQELV-TZMCWYRMSA-N 290.323 2.089 10 10 CECE CC1([C@@H]2CCCCN2c2ccc(CN)cc2)OCCO1 1941975970 BOPRLTPKVXFULL-HNNXBMFYSA-N 276.380 2.267 10 10 CECE Cc1cncc(C(=O)[C@@H](O)c2ccc(N(C)C)cc2)c1 2147008872 UGMMMOVBMHSPMS-HNNXBMFYSA-N 270.332 2.372 10 10 CECE CN1CCCc2cc(CN[C@H](CO)C3(C)CC3)ccc21 2150528080 JCHQFVNAPWFYCT-MRXNPFEDSA-N 274.408 2.320 10 10 CECE CC(C)(C)OC(=O)N1CC[C@H](N)[C@H]1c1cc(O)ccc1O 1952309461 WCNZTTHWQQPRQE-WCQYABFASA-N 294.351 2.107 10 10 CECE Cc1cccc([C@]2(N)C[C@H]2C(=O)OC(C)(C)C)c1O 1952777004 XSNHLCTZECGMBJ-XHDPSFHLSA-N 263.337 2.216 10 10 CECE O=C(O)[C@H]1CCN[C@@H]1c1cc(Cl)cc(Cl)c1O 1952818853 MZPYJPMLOKCRSV-RCOVLWMOSA-N 276.119 2.434 10 10 CECE CCN(CC)c1ccc([C@@H]2NCC[C@@H]2C(=O)O)cc1 1952855969 DQHHSZKOUIECBG-KBPBESRZSA-N 262.353 2.268 10 10 CECE C[C@@H](NCC[C@@H]1CCCN(C)C1)c1ccc(O)cc1O 2151292908 RXVWQZNWWYEDFU-OLZOCXBDSA-N 278.396 2.480 10 10 CECE Cn1cnc2ccc([C@H](O)Cc3ccc(N)cc3)cc21 2144026560 JVPJSMIIMGBJTK-MRXNPFEDSA-N 267.332 2.432 10 10 CECE N[C@H]1[C@@H](Sc2nccs2)CCOC12CCC2 1976001034 MHFHBWMYKMPKEH-IUCAKERBSA-N 256.396 2.274 10 10 CECE COc1ccc(N2CC[C@@H](CN)C[C@H]2C)c([N+](=O)[O-])c1 2148112947 FMWDQWXABCYJPU-GHMZBOCLSA-N 279.340 2.167 10 10 CECE Nc1ccc(NC(=O)N[C@H]2C[C@@H]3CCCCN3C2)cc1 2144866952 PSVNSNZQISLDCK-KBPBESRZSA-N 274.368 2.017 10 10 CECE COC(=O)c1cc2c(-c3cnoc3)nsc2n1C 259257153 FGLSKXVHQRETEV-UHFFFAOYSA-N 263.278 2.076 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@]3(CCCO3)C2)cc1O 2145051651 WNVSNVZTTLDLCN-LRDDRELGSA-N 276.380 2.432 10 10 CECE Nc1ccc(CCC(=O)Nc2nnc(C3CC3)o2)cc1 158143652 UTJZNIKHMMOWIK-UHFFFAOYSA-N 272.308 2.101 10 10 CECE CCOC(=O)C[C@@H](N)c1cc(O)cc(C(F)(F)F)c1O 260508959 IQXLSANJEMJGNB-SECBINFHSA-N 293.241 2.070 10 10 CECE Cc1ccc(C(=O)N(C)Cc2ccc(N)cc2)cn1 35360170 XDSAGLRWBPHJCG-UHFFFAOYSA-N 255.321 2.244 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](O)CC3(CCC3)C2)cc1O 2151345769 GDBRRZBBWFBRQB-WCQYABFASA-N 276.380 2.153 10 10 CECE COC[C@]1(OC)CCN(c2ccc([C@H](C)O)cc2F)C1 2151847151 VHPIKIUMNHGXTJ-NHYWBVRUSA-N 283.343 2.121 10 10 CECE CSCCNC(=O)N1CCC(CN=[N+]=[N-])CC1 2011230353 PTIRSYBABGEJCP-UHFFFAOYSA-N 257.363 2.081 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H]3[C@H]2CN)cc1Cl 2024011230 SGFYTXDPRRYOSY-MKPLZMMCSA-N 252.745 2.132 10 10 CECE CCOC[C@H]1CCN(Cc2ccc(F)cc2O)C1 294279680 OUSQYGRQBFNZBH-NSHDSACASA-N 253.317 2.390 10 10 CECE NCc1ccc(N(Cc2cnns2)C2CC2)cc1 2027254087 MICJICIXAQNBKY-UHFFFAOYSA-N 260.366 2.166 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@H](C2(C)OCCO2)C1 2029121774 SAKXSFPYPFUKPD-OAHLLOKOSA-N 290.407 2.433 10 10 CECE CC[C@]1(CNCc2ccc(O)c(O)c2)CCCO1 2030263038 UOPOJVKNDGTWAV-CQSZACIVSA-N 251.326 2.147 10 10 CECE Oc1ccc(CNCC2CCC3(CC2)OCCO3)c(O)c1 2030322318 HSEOZYYJSIUZDM-UHFFFAOYSA-N 293.363 2.121 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3C[C@H](O)[C@H]3C2)c(Cl)c1 2033982670 ZRHHHRRWCPEIGJ-ORMVGFHCSA-N 266.772 2.177 10 10 CECE C[C@]12CCO[C@@H]1[C@@H](NCc1cc(F)ccc1O)C2 2036585770 DMLBPENPUKNCLK-IACUBPJLSA-N 251.301 2.188 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 403676864 PFWCZFJTPLCPSL-QMMMGPOBSA-N 262.269 2.013 10 10 CECE Nc1ccc(OCc2nc(C3CSC3)no2)cc1 404687191 MTXOIGJYZRLJRB-UHFFFAOYSA-N 263.322 2.061 10 10 CECE C[C@H](N[C@H]1CCC[C@@H](CO)C1)c1cc(O)ccc1O 311388955 CLIVTWJNWAGZJU-TUAOUCFPSA-N 265.353 2.300 10 10 CECE CC(C)NCc1ccc(N(C)[C@H]2CN3CC[C@H]2C3)cc1 2158734845 OJIMBHRZSFTTJH-RDJZCZTQSA-N 273.424 2.325 10 10 CECE O=C(O)[C@H]1C[C@@H]2CN(Cc3cc(F)ccc3O)C[C@@H]2C1 2158876551 AARHPNVFSKADSS-JGPRNRPPSA-N 279.311 2.074 10 10 CECE Nc1ccc(NC(=O)CCCN2CCC(F)(F)C2)cc1 313276847 KCQBBSQTRBDRPK-UHFFFAOYSA-N 283.322 2.329 10 10 CECE COCCNCc1ccc(N(C)C[C@H](C)COC)cc1 313279991 CPJHKLMRUVJCEM-AWEZNQCLSA-N 280.412 2.141 10 10 CECE c1cc2c(cc1CN[C@@H]1CNCC3(CC3)C1)CCCO2 2160556936 PMRAETXHTYXYQZ-HNNXBMFYSA-N 272.392 2.243 10 10 CECE CCOC(=O)[C@H](C)CNCc1ccc2c(c1)CCCO2 2160562552 WVLUMGXFVCXHQR-GFCCVEGCSA-N 277.364 2.300 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H](C(F)(F)F)[C@H](N)C1 2160787596 ZIRCVRZPCJWXSL-VXGBXAGGSA-N 288.313 2.412 10 10 CECE Cc1cccc(O)c1CNC[C@H]1CCc2nccn2C1 2160792419 GALCURQQHAGMLF-CYBMUJFWSA-N 271.364 2.249 10 10 CECE CN(C[C@@H]1[C@@H]2CCO[C@@H]21)c1ccc(CNC2CC2)cc1 2176459399 ZTPMDHPIHADKLV-BBWFWOEESA-N 272.392 2.410 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@@H]1[C@H]2CCO[C@@H]12 2176444268 FUSRYMBLDWHLJB-BZUAXINKSA-N 276.380 2.004 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CCO[C@@H](C(C)C)C1 90257209 SHBFXZNCUGSFLF-DGCLKSJQSA-N 284.360 2.023 10 10 CECE CCOc1cc(NCCc2ccc(N)cc2)nc(C)n1 90787851 YVZKUPIRULALDT-UHFFFAOYSA-N 272.352 2.421 10 10 CECE COC[C@H](NCc1ccc(F)c(F)c1O)C1CC1 703346521 FICIFRXSYGYJIF-NSHDSACASA-N 257.280 2.185 10 10 CECE C[C@H]1C[C@]1(C)CN(C)CC(=O)N(C)c1ccc(N)cc1 704093546 YMNGLPVNNZNJHI-BLLLJJGKSA-N 275.396 2.210 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H](c2ccnn2C)C1 2171777864 HGVSSJVKPUMCRE-AWEZNQCLSA-N 271.364 2.215 10 10 CECE Oc1cccc(Br)c1CNCCCN1CCC1 706825178 PLIBXXQHPRLADG-UHFFFAOYSA-N 299.212 2.340 10 10 CECE COc1cc(C)c(N2C[C@H](N)C[C@]23CCOC3)cc1C 2162633679 AODQCGYYCBXEQN-CJNGLKHVSA-N 276.380 2.009 10 10 CECE 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CSc1cc(N(C)[C@@H]2CCN(C)C2)ccc1CN 2328548362 CQWMFAAZDGCHEF-CYBMUJFWSA-N 265.426 2.008 10 10 CECE CC1(C)[C@@H](O)[C@@H]2CCN(c3ccc4c(c3)CCO4)[C@@H]21 2333689724 PFBSUZMLHUGITE-SNPRPXQTSA-N 259.349 2.217 10 10 CECE OCc1ccc(N2CC(OC(F)F)C2)cc1C1CC1 2339164097 SZNIVCSPAUOXHS-UHFFFAOYSA-N 269.291 2.484 10 10 CECE CCc1cnccc1CNCc1cccc(O)c1O 2340224698 LMSUPPGLGWQHKD-UHFFFAOYSA-N 258.321 2.345 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC=C(CO)CC2)c1C 2340855184 ILMKQXRVDJGWQP-ZDUSSCGKSA-N 260.381 2.452 10 10 CECE C[C@@]12CNC[C@]1([C@H](O)c1ccc(N3CCCC3)cc1)C2 2354742094 VHJLBDDQAMZNLH-ZACQAIPSSA-N 272.392 2.320 10 10 CECE CCOc1cccc(CN2[C@H]3CC[C@@H]2C[C@@H]3CN)c1O 2355418958 FXFFKIUALHBGMY-MCIONIFRSA-N 276.380 2.103 10 10 CECE CN1CCCc2cc([C@@H](N)[C@H]3[C@@H]4CCOC[C@@H]43)ccc21 2355980402 LNGIJVBZQPWSRB-YQFWSFKMSA-N 272.392 2.351 10 10 CECE CCNC[C@@H](CC)N1CCN(c2ccc(OC)cc2)CC1 52418126 LSTUESUULVNTLE-OAHLLOKOSA-N 291.439 2.205 10 10 CECE CCOC1CCN(Cc2cc(CNC)ccc2OC)CC1 50125042 LIUMHYICYMGCBH-UHFFFAOYSA-N 292.423 2.416 10 10 CECE COCCNCc1ccc(N(C)CC2CCOCC2)cc1 111167297 YWYHMNQMNRJPCQ-UHFFFAOYSA-N 292.423 2.285 10 10 CECE CCc1cc(Br)c(O)c([C@H]2COCCN2)c1 309271698 ADEQDIKFUQNDBF-LLVKDONJSA-N 286.169 2.378 10 10 CECE CCN(Cc1ccc(N)cc1)c1cc(C)nc2ncnn12 37671556 WXLFNOFLTKMJIA-UHFFFAOYSA-N 282.351 2.041 10 10 CECE CCOc1cccc(CN2CCCC[C@H]2C(=O)OC)c1O 122285884 SOMYQVOZLVJKLU-ZDUSSCGKSA-N 293.363 2.318 10 10 CECE COc1ccc(N(C)[C@@]2(CN)C[C@H](C)N(C3CC3)C2)cc1 123184263 ZCAAVQFIHMYLPU-SUMWQHHRSA-N 289.423 2.086 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H](C)N2CCOCC2)c1 184934321 LPSWGAAPOCUUQP-KBPBESRZSA-N 278.396 2.072 10 10 CECE CN[C@H](C)c1ccc(N2CCC(CC(N)=O)CC2)c(F)c1 42429273 RBBNIFKWFKKSCS-LLVKDONJSA-N 293.386 2.198 10 10 CECE Nc1ccc(CC(=O)OCc2cn3ccccc3n2)cc1 41098543 AIJNBNSRRBVHBD-UHFFFAOYSA-N 281.315 2.202 10 10 CECE COc1ccc([C@H](C)N[C@@H]2C[C@@H]3CC[C@@H]2O3)c(O)c1 132136029 RRUUODPXPCOCQM-GVAXYQGFSA-N 263.337 2.371 10 10 CECE Cc1cncc(/C=C/C(=O)N2CCc3cnccc32)c1 130058270 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C[C@H](NC[C@H]1COCCC1(F)F)c1cc(O)ccc1O 2166659451 GLBREPBMKBIIBN-UWVGGRQHSA-N 287.306 2.420 10 10 CECE C[C@@H](N[C@H]1C[C@H]2CCCN(C1)C2)c1ccc(O)cc1O 717002975 VVTRMBYRDUAKHW-UPJWGTAASA-N 276.380 2.233 10 10 CECE CN1CCCc2cc(CNC(=O)[C@@H]3CC34CC4)ccc21 817430856 OJBHETQYJROXEP-AWEZNQCLSA-N 270.376 2.485 10 10 CECE C[C@@H]1CN([C@@H](C)c2cc(O)ccc2O)C[C@@H]1CCN 723920829 ZWTLYTCKYJALSP-WOPDTQHZSA-N 264.369 2.076 10 10 CECE CCn1ncnc1CNC/C=C/c1ccc(N(C)C)cc1 835051821 KCXKXYHUTHNSBH-AATRIKPKSA-N 285.395 2.167 10 10 CECE NC[C@@H]1c2ccccc2CCN1Cc1ccccc1O 843127553 DWUYPTPWZUIHQE-MRXNPFEDSA-N 268.360 2.450 10 10 CECE CN(C)CC[C@H]1CCCN(c2ccc(CO)cc2)C1 700828617 GYMIVEHUDCMYDI-CQSZACIVSA-N 262.397 2.347 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@@H](C)CO 840933633 IRKJCVDWHZQNEK-STQMWFEESA-N 250.386 2.168 10 10 CECE CC[C@](C)(CO)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 847761465 SDSFBXOCJXUCIU-BLLLJJGKSA-N 278.396 2.338 10 10 CECE Cc1cc(N(C)C)ccc1CN1C[C@@H](C)[C@](C)(CN)C1 841090870 OXOSVGOFOGZSKO-RHSMWYFYSA-N 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CCN(CC)c1ccc([C@@H](NN)[C@@H]2CSCCO2)cc1 2163144352 MIYYDCZEBNSTQY-LSDHHAIUSA-N 295.452 2.169 10 10 CECE C[C@]1([C@H](NN)c2ccc(N3CCCC3)cc2)CCOC1 2163157865 ISMBJJFHCPVWQS-CVEARBPZSA-N 275.396 2.218 10 10 CECE CN(C[C@H]1C[C@@H](O)C1)c1ccc(CO)c(C(F)(F)F)c1 703785578 HAGDYQNPPKOBHW-WVSHTKLVSA-N 289.297 2.405 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)Cc1cc(OC)ccc1O 2163614227 RRELNDNTOQOKMY-WFASDCNBSA-N 278.396 2.221 10 10 CECE C[C@@H](N[C@H]1CC12CC(O)C2)c1ccc(N(C)C)cc1 724959725 SYFSLBGUFMLSEF-DIPIGXQDSA-N 260.381 2.317 10 10 CECE Oc1c(F)cc(Cl)cc1CN1C[C@H]2CC[C@H]1CN2 817865362 OHQJAQGHPIPNGH-MNOVXSKESA-N 270.735 2.121 10 10 CECE CCN[C@@H](CC)c1ccc(N2CC(CC(N)=O)C2)cc1 723183201 RHKISBGOWHLEPM-HNNXBMFYSA-N 275.396 2.059 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1CCn2ccnc21 824526369 KGIUVNCJCPCJHG-NSHDSACASA-N 263.728 2.477 10 10 CECE C[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCS1 588406806 XSQCMWFMGIAGPV-ATPLWMGHSA-N 279.361 2.075 10 10 CECE COc1ccc(O)c(CNC(=O)C2CC3(C2)CC3(F)F)c1 830543747 DMGCFNHXZSLGSL-UHFFFAOYSA-N 297.301 2.452 10 10 CECE Cc1cc(N(C)C)ccc1CN1C[C@H](C(N)=O)CC[C@H]1C 840910772 RTBQWEPRCCADRP-UKRRQHHQSA-N 289.423 2.147 10 10 CECE C[C@@H](CCCN)NC/C=C\c1ccc(N(C)C)cc1 841081714 XGRJHUXRBKHSDO-VSKVDJIOSA-N 261.413 2.483 10 10 CECE COc1ccc(N(C)C[C@@H]2CCC3(COC3)O2)cc1F 929827495 ULCKTGFTCONWHF-LBPRGKRZSA-N 281.327 2.219 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC[C@@]3(O)C[C@H]3C2)c1O 852536961 LJUGRRTWSHGMNX-XHDPSFHLSA-N 295.766 2.205 10 10 CECE COc1cc(CN2CC[C@@H]3COC[C@H]3C2)c(O)cc1C 853591322 PTVNZQXEVQQVLD-TZMCWYRMSA-N 277.364 2.178 10 10 CECE CC1(C)CO[C@H](CC(=O)NCc2c(O)cccc2F)C1 928710994 OWMAXQCOHKPCMB-SNVBAGLBSA-N 281.327 2.353 10 10 CECE O=C(O)/C=C/c1ccc(N2CC3(COC3)C2)c(Cl)c1 697120730 MJAQKVWQMMFBOJ-DUXPYHPUSA-N 279.723 2.274 10 10 CECE Cc1ccncc1CCNC(=O)c1ccc(C)c(O)c1O 855395009 VUBSBFHRQOYAHK-UHFFFAOYSA-N 286.331 2.082 10 10 CECE Oc1cc2c(cc1CN1CCC[C@H]3COCC[C@@H]31)OCO2 756887101 MUJXBNZYQWBEFG-AAEUAGOBSA-N 291.347 2.122 10 10 CECE Nc1cccc(Br)c1N[C@@H]1CCC[C@@H]1O 697486490 PXTRVFNSZSHKOZ-ZJUUUORDSA-N 271.158 2.357 10 10 CECE CCO[C@H](CS(=O)(=O)Nc1ccc(O)cc1C)C1CC1 863405504 WYUXYPHCEUWHBF-CQSZACIVSA-N 299.392 2.257 10 10 CECE CC[C@@H]1CCNC[C@@H]1N(C)c1ccc(OC)cc1N 1876367721 ZFPVJFWRKDTJGC-ABAIWWIYSA-N 263.385 2.102 10 10 CECE Nc1ccc(N2C[C@H](N)[C@H](c3ccccc3)C2)cc1 1876333805 TVGMMZPPVQAKJV-HOTGVXAUSA-N 253.349 2.200 10 10 CECE CC[C@@H](COC)NC(=O)c1cc2cc(O)c(O)cc2s1 896499671 SPJKIDXUOLGQKV-VIFPVBQESA-N 295.360 2.467 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N(C)CCN(C)C 1879782253 KRIUONSXSIWGIS-UHFFFAOYSA-N 262.353 2.091 10 10 CECE COc1cc(NS(=O)(=O)c2ccccc2F)ccc1O 797819579 NENHJRXHAFPQER-UHFFFAOYSA-N 297.307 2.341 10 10 CECE Cc1ccc(C(=O)NCc2ccc(O)cc2O)cc1F 1142531241 YUXKIUBASWEUIM-UHFFFAOYSA-N 275.279 2.475 10 10 CECE CCOc1cccc(CN2CC[C@H]3COC[C@H]32)c1O 1899148041 KMRBIOMRMZUOLO-QWHCGFSZSA-N 263.337 2.012 10 10 CECE COc1cccc(CNC[C@@H]2CC[C@H]3C[C@H]2CO3)c1O 897498292 NLTYBRLLOVVTMC-UBHSHLNASA-N 277.364 2.306 10 10 CECE Cc1cccc(CN2CCN(C(=O)C(C)C)CC2)c1O 271864538 ZZXGTCWPCUEKDK-UHFFFAOYSA-N 276.380 2.001 10 10 CECE CCCOCc1noc(CCc2ccc(N)cc2)n1 134683276 JHOJHHZVOSWPBN-UHFFFAOYSA-N 261.325 2.364 10 10 CECE Cc1cn(C)nc1CNCc1ccc2c(c1)CCCO2 1964048142 KFUNLXXLHHYAKG-UHFFFAOYSA-N 271.364 2.343 10 10 CECE Nc1ccc(CC(=O)Nc2ccc(C(=O)O)cc2)cc1 40472911 CGNMZPMXCBWLAU-UHFFFAOYSA-N 270.288 2.148 10 10 CECE CC[C@H]1CNCCN1Cc1cc(Cl)ccc1O 83407840 XKPVENCOWFOTCZ-LBPRGKRZSA-N 254.761 2.229 10 10 CECE CCN(CC)c1ccc([C@@H]2CN[C@H](C)CN2C)cc1 83449937 VFBSNVBMCQMVQK-CJNGLKHVSA-N 261.413 2.497 10 10 CECE Cc1cccc([C@H](N)c2nnc(-c3ccoc3)o2)c1O 83518827 MJAWUKYWVSUFBJ-NSHDSACASA-N 271.276 2.392 10 10 CECE C/C=C/C=C/c1nnc([C@H](N)c2cccc(O)c2O)o1 83537671 NTGLRXSVYKYZQT-LENVYROZSA-N 273.292 2.118 10 10 CECE Oc1ccc([C@@H]2NCCc3ccc(O)c(O)c32)c(F)c1 83621059 YSOIOKMFWAAIRT-AWEZNQCLSA-N 275.279 2.178 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CSCC(C)(C)C1 94490193 RWQIZXKKCKYXOD-GFCCVEGCSA-N 286.401 2.351 10 10 CECE C[C@@H]1CCO[C@@H]1CC(=O)N(C)Cc1ccccc1O 1964874156 PEKUEUNCPZOFSJ-BXUZGUMPSA-N 263.337 2.166 10 10 CECE CO[C@@]1(CN(Cc2ccc(N)cc2)C(C)C)CCOC1 692423733 JQWBCDUAWBDWSR-MRXNPFEDSA-N 278.396 2.285 10 10 CECE O=C1[C@H](NCc2cccc(Cl)c2O)CCN1C1CCC1 708677960 AIAWFRWZGFQPJK-CYBMUJFWSA-N 294.782 2.289 10 10 CECE O=C(NCc1csc(C2CC2)n1)c1ccc(O)c(O)c1 708852338 VZOSJRCYNKCXNN-UHFFFAOYSA-N 290.344 2.362 10 10 CECE CCNCc1ccc(N(CCO)CC2CC2)c(C)c1 688424957 LUGGXELXGPKZRA-UHFFFAOYSA-N 262.397 2.313 10 10 CECE Cc1ccc(O)c(CN2CC[C@H](C)[C@@H](C(=O)O)C2)c1 693468523 DZJMPNOKPBDGLI-AAEUAGOBSA-N 263.337 2.243 10 10 CECE C[C@@H]1CN(C)C[C@H]1NCc1ccc(N2CCCC2)cc1 722295802 VJXJLDQWGZKZMQ-RHSMWYFYSA-N 273.424 2.327 10 10 CECE COc1ccc(O)c(CNC[C@@H]2CC[C@H](C3CC3)O2)c1 722334333 SSPSWAOLPCBCSK-GOEBONIOSA-N 277.364 2.448 10 10 CECE COCc1nc(COc2ccc(N)cc2)cs1 694983236 YNHDKOUCDUBAFH-UHFFFAOYSA-N 250.323 2.451 10 10 CECE CCN[C@@H](C)c1ccc(N(CCO)C2CC2)cc1O 93671057 PCYYJZKGGQBFAM-NSHDSACASA-N 264.369 2.024 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)COC1(C)CCCC1 1912152456 UDENBRGJVJROQG-UHFFFAOYSA-N 254.334 2.495 10 10 CECE CCOc1cccc(CN(C)[C@]2(C)CCOC2)c1O 2119020966 TXNYVCCMRKOQNA-OAHLLOKOSA-N 265.353 2.402 10 10 CECE NCc1cc(F)c(N2CCOC[C@H]2C(F)F)cc1Cl 2120890262 AVMUVBSBBSIHGY-NSHDSACASA-N 294.704 2.408 10 10 CECE CCc1ncncc1[C@@H](O)c1ccc(N(C)C)cc1 2122250817 HSHNOGJGHNDTEO-HNNXBMFYSA-N 257.337 2.187 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/c1ccncn1 1623387020 OLROIMIJAUTIBT-RMKNXTFCSA-N 296.374 2.214 10 10 CECE CCc1ncoc1C(=O)NCc1ccc2cccnc2c1O 1639625004 SXEZSSSNCIPSQI-UHFFFAOYSA-N 297.314 2.421 10 10 CECE O=C(CC[C@H]1CCCCO1)NCc1cc(O)ccc1O 1643882135 ONGMNELCWBPAMT-CYBMUJFWSA-N 279.336 2.063 10 10 CECE COCc1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1643101176 XVFASFDTCFBLIE-UHFFFAOYSA-N 287.315 2.174 10 10 CECE COc1ccc(C)cc1CC(=O)N1CC[C@@H](N=[N+]=[N-])C1 1912177392 JDZPQTQAFFAWGY-GFCCVEGCSA-N 274.324 2.457 10 10 CECE [N-]=[N+]=NC1CN(C(=O)COc2ccc(Cl)cc2)C1 1912185839 WLLVBOMFKJHXPO-UHFFFAOYSA-N 266.688 2.240 10 10 CECE CCn1cc(C(=O)N2CCC[C@H]2CN=[N+]=[N-])c(C)n1 1912211109 RYQJECQRJRUVCA-JTQLQIEISA-N 262.317 2.126 10 10 CECE CCc1cc(CNC)c(O)c(Br)c1OC 218620407 MKMOTDHZMPJNQQ-UHFFFAOYSA-N 274.158 2.445 10 10 CECE COc1ccc(CN[C@@H](C)c2cc(C)ccc2O)nn1 1913557291 HHWCRSDOSDLHLR-NSHDSACASA-N 273.336 2.350 10 10 CECE Cc1ccc([C@H](C)NCCSCCO)c(O)c1 2299187102 CSAITHYSGJJLSB-NSHDSACASA-N 255.383 2.077 10 10 CECE C[C@H](N[C@H]1C[C@@H](n2cncn2)C1)c1ccccc1O 2127666916 QBIRINWYGNBYIH-SDDRHHMPSA-N 258.325 2.038 10 10 CECE C[C@H]1C[C@@H](O)[C@H](C)CN1c1ccc2c(c1)CC[C@@H]2N 2128326464 HNNMTYSFBNGDPV-LZJQFABFSA-N 260.381 2.228 10 10 CECE CN(C[C@H]1CCC[C@@H]1O)c1ccc2c(c1)CC[C@@H]2N 2128327586 NOKBNWCCUWOMJW-KCXAZCMYSA-N 260.381 2.230 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H]4CO[C@@H](C4)C3)ccc21 2128308740 JETMWDHLYTYJML-HZUKXOBISA-N 258.365 2.118 10 10 CECE O=C(O)C=Cc1ccc(N2C[C@H]3COC[C@@H]32)cc1Cl 2129733228 XTESRNOVGCQPRH-GWCFXTLKSA-N 279.723 2.273 10 10 CECE C[C@H](N[C@H]1CCc2cccc(O)c21)c1nccn1C 850573220 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CCN(CCCCO)c1ccc(OC)c(OC)c1 1968816167 UCNIAVPFYISJFB-UHFFFAOYSA-N 253.342 2.303 10 10 CECE CNC(=O)C1(NCc2cc(Cl)cc(Cl)c2O)CC1 1967771398 GMOIXEXEWZNFDS-UHFFFAOYSA-N 289.162 2.067 10 10 CECE CN(c1cc2c(cc1Cl)[C@H](N)C(=O)N2)[C@@H]1CCSC1 118587555 AMLQRBJWGLIKDL-KRTXAFLBSA-N 297.811 2.234 10 10 CECE CNCc1ccc(OC)c(CN2CC[C@@H]3CC[C@@H]32)c1 1923959601 HSSUNXTYANWCQG-ZFWWWQNUSA-N 260.381 2.399 10 10 CECE Cc1cccc(CN[C@H]2C[C@H]3CC[C@H]2[C@H](O)C3)c1O 2139748067 IWCYFTYAFNCXKR-REBRKWNGSA-N 261.365 2.340 10 10 CECE COc1cc(N(C)[C@@H]2CC[C@H](C)OC2)ccc1CN 2139704676 PEAWFOKUEPUUIN-SMDDNHRTSA-N 264.369 2.158 10 10 CECE CC(C)=CC[C@@H](N)C(=O)NCc1cccc(C)c1O 2139752220 XFDXQGIDQJYKGB-CYBMUJFWSA-N 262.353 2.000 10 10 CECE C[C@@H]1CCCN(Cc2ccc(F)cc2O)[C@@H]1CCN 2139765504 KSLFMFANCYBXGY-BXUZGUMPSA-N 266.360 2.481 10 10 CECE Oc1cc(F)ccc1CNC[C@H]1C[C@@]12CCCOC2 2139884109 CINLWQALLNZHRH-IUODEOHRSA-N 265.328 2.438 10 10 CECE CCN(CC1CCC1)c1ccc2c(c1)N(C)C(=O)[C@H]2N 230319901 DHNAKRSXXPFOBM-HNNXBMFYSA-N 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IAZUKXYYBZTXNP-ZFWWWQNUSA-N 278.396 2.106 10 10 CECE CN(C(=O)C=Cc1cnc2ccccc2n1)c1cnn(C)c1 2297666233 RFYUZZRINSZGSO-UHFFFAOYSA-N 293.330 2.040 10 10 CECE CCCc1nnsc1COc1cccnc1N 2299427842 UAODGDQPPQEDAU-UHFFFAOYSA-N 250.327 2.047 10 10 CECE C[C@@H]1[C@H](CO)CCN1c1ccc2c(c1)OCCCO2 1144499255 IGVVWGKFCFREOV-NEPJUHHUSA-N 263.337 2.055 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)c(Cl)c1 2309945449 ZELZTQKTKJRVEX-AWRWRYAPSA-N 267.756 2.353 10 10 CECE C[C@H](O)CCCN(C)c1c(F)cc(CN)cc1F 2314573645 FUGGAAPODHIQPE-VIFPVBQESA-N 258.312 2.021 10 10 CECE COC(=O)[C@H](CCC1(C)CC1)NCCCN=[N+]=[N-] 2318728152 CBASBNOCJBPBPN-JTQLQIEISA-N 254.334 2.398 10 10 CECE COc1ccc(N(C)[C@]2(CN)CC[C@H]2SC)cc1 2328232307 WTBOFHQAPKMBSZ-KGLIPLIRSA-N 266.410 2.354 10 10 CECE CCc1cccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@H]3O)c1O 2330917737 UJRWQXXSJKIYAR-BYNSBNAKSA-N 261.365 2.204 10 10 CECE CCN1[C@H]2CC[C@@H]1CN(c1ccc(CN)cc1C)C2 2335526673 ZODWAZWYMTUMFD-GASCZTMLSA-N 259.397 2.127 10 10 CECE COc1ccc(N(C)Cc2snnc2C)c(C=O)c1 2335734043 ZSCWOVSDZSQPDM-UHFFFAOYSA-N 277.349 2.304 10 10 CECE C[C@H]1[C@H](O)CCCN1c1ccc(CN)c(C2CC2)c1 2339157739 MYFGPRYIIBWECI-MEDUHNTESA-N 260.381 2.372 10 10 CECE CC(C)[C@@H](O)C(C)(C)NC(=O)Nc1ccc(N)cc1 2340410062 HZPITNVAXIQTKC-GFCCVEGCSA-N 265.357 2.186 10 10 CECE Cc1ccc(O)c(CN2C[C@@H]3C[C@H]2C[C@@H]3N(C)C)c1 2341129847 BWUAECVCCRKAGH-QEJZJMRPSA-N 260.381 2.225 10 10 CECE CN(Cc1ccccc1O)[C@](C)(C(=O)O)C(F)(F)F 2351140149 RYFLNNMBXVVXGD-LLVKDONJSA-N 277.242 2.230 10 10 CECE C[C@H]1CC[C@@H](C(=O)N(C)[C@H](C)c2ccccc2O)CN1 2354101820 AMVKNKCXSZLJDF-YNEHKIRRSA-N 276.380 2.300 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@@H]2[C@@H]3CCCO[C@@H]32)c1 2355560791 FPUVGNRCMAEQGO-FTYZYXLQSA-N 277.364 2.476 10 10 CECE O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C\c1ccco1 2990207 YJPITOYGJDCZPA-XFXZXTDPSA-N 288.303 2.074 10 10 CECE Cc1cc(CNC(C)(C)C)ccc1N1CCNC(=O)CC1 62101578 GFACATJDGFQUPF-UHFFFAOYSA-N 289.423 2.209 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CC[C@H](OC)C1 300647226 PQQDSPZTFMZHJS-UWVGGRQHSA-N 264.325 2.035 10 10 CECE CN1CCC[C@@H]2CN(c3c(F)cc(CN)cc3F)CC[C@@H]21 126353305 GSZDWHRETCKFTB-DOMZBBRYSA-N 295.377 2.344 10 10 CECE C[C@H](N)c1ccc(N(C)C2CCOCC2)c(F)c1 36321427 KUPFXPFQQHSJHI-JTQLQIEISA-N 252.333 2.461 10 10 CECE N[C@@H](Cc1ccc(O)c(O)c1)c1nc(C2CCCC2)no1 40225993 MYFOMCFKDMFAMS-NSHDSACASA-N 289.335 2.381 10 10 CECE CN1CCC[C@@H]2CN(c3c(F)cc(CN)cc3F)CC[C@H]21 227342373 GSZDWHRETCKFTB-IUODEOHRSA-N 295.377 2.344 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)CC(C)(C)C 80186384 UUAXYRDRIXOCCS-UHFFFAOYSA-N 256.371 2.081 10 10 CECE CCN[C@@](C)(CCCCSc1nccs1)C(N)=O 45596444 IJQPNOQTZDURDG-LBPRGKRZSA-N 287.454 2.259 10 10 CECE Nc1ncnc(Sc2nccs2)c1Br 236367337 UMKJSARCXUNCKF-UHFFFAOYSA-N 289.183 2.429 10 10 CECE Oc1c(Br)cc(F)c(F)c1[C@H]1COCCN1 95719178 REBGMYHXQDTVGB-SSDOTTSWSA-N 294.095 2.094 10 10 CECE O=C(O)C[C@@H]1CCCCN1Cc1cc(F)ccc1O 236427257 BICGEVJDSGMNBJ-LBPRGKRZSA-N 267.300 2.361 10 10 CECE COC(=O)C[C@H](N)c1c(O)cc(Cl)cc1Cl 95638516 KINSSCLZNMUNSE-ZETCQYMHSA-N 264.108 2.262 10 10 CECE CC[C@H](C)CS(=O)(=O)CCc1ccc(N)cc1 233990175 OJWKBMVMZQAHRS-NSHDSACASA-N 255.383 2.272 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@]1(C)C[C@H]2CC[C@H]1O2 249298410 CKXNJHBXGNRJIX-XNRPHZJLSA-N 275.348 2.308 10 10 CECE Cc1cc(C)c([C@@H](N)CC(=O)O)c(O)c1Br 258714725 YQSTZZYQGDFCIU-ZETCQYMHSA-N 288.141 2.246 10 10 CECE CC[C@H](C)NC(=O)CCNCc1ccc(F)c(F)c1O 700742274 HFWQUPPLNMSNNV-VIFPVBQESA-N 286.322 2.065 10 10 CECE COc1ccc(N(C)CC2CC(O)C2)c(OC)c1C 2277991010 CVLOCPIPOFTHEV-UHFFFAOYSA-N 265.353 2.219 10 10 CECE C[C@@H](Cn1cncn1)N[C@@H](C)c1ccc(N(C)C)cc1 269056277 WUQBDPZFDWTDLT-STQMWFEESA-N 273.384 2.083 10 10 CECE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCOC[C@H]2C)c1 278377877 CGDSOPBEAPWQEW-SUNKGSAMSA-N 293.363 2.254 10 10 CECE O=C(NCCc1ccc(O)c(O)c1)c1cc[nH]c1C1CC1 285437327 YFCPSPXVDBUCPZ-UHFFFAOYSA-N 286.331 2.276 10 10 CECE Oc1ccc(Br)cc1CN1C[C@H](O)C2(CC2)C1 372369567 UXBVKRDKPRRPGQ-LBPRGKRZSA-N 298.180 2.111 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N(C)Cc1nccs1 387318004 SIBRFKKNRIHYTE-SNVBAGLBSA-N 290.392 2.184 10 10 CECE CC(C)N1CC(NCc2ccc(N3CCCC3)cc2)C1 381094102 ZCTVFBCXEJSSGH-UHFFFAOYSA-N 273.424 2.469 10 10 CECE CCN(Cc1cc(Cl)c(F)cc1O)[C@@H](C)CO 293665948 OJEBXSDPWPYQBS-QMMMGPOBSA-N 261.724 2.387 10 10 CECE CCc1ccc2occ(C(=O)OCC(=O)C(C)=O)c2c1 808549536 GRUJSKNHXVKZMG-UHFFFAOYSA-N 274.272 2.310 10 10 CECE CCOC(=O)[C@@H](C(=O)Nc1ccc(N)cc1)C(C)(C)C 2162277540 DMADLODLMRCODU-GFCCVEGCSA-N 278.352 2.433 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H](C)CC[C@H]2CO)c1 2166916447 NNWTVSBGSDTBCJ-NHYWBVRUSA-N 277.364 2.188 10 10 CECE CCOc1ccc(N2C[C@@H](N)CC23CCOCC3)cc1 2162640793 UXMGDTMCFSPTAT-ZDUSSCGKSA-N 276.380 2.172 10 10 CECE C[C@@H]1CNCC[C@@H]1[C@@H](O)c1ccc2c(c1)CCCN2C 2163103717 XCQSLRIRKABFMU-PVUWLOKVSA-N 274.408 2.348 10 10 CECE CCN[C@H](c1ccc2c(c1)CCN2C)[C@](C)(O)CSC 2163129121 ZJRGHSJKNPKDFZ-HZPDHXFCSA-N 294.464 2.444 10 10 CECE Cc1csc([C@@](C)(O)[C@H](N)c2ccc(N(C)C)cc2)n1 2163134783 COWARPBAGDWFNJ-HIFRSBDPSA-N 291.420 2.425 10 10 CECE CN[C@@H](c1ccc(N2CCCC2)cc1)[C@@]1(O)CCSC1 2163231620 VJXNVANABAJLIA-JKSUJKDBSA-N 292.448 2.415 10 10 CECE Oc1ccc(Cl)cc1CN1C[C@H]2CCCN[C@H]2C1 299921296 PRKRPGQKKLJBNS-MFKMUULPSA-N 266.772 2.229 10 10 CECE CN(C[C@@H](O)COc1ccc(N)cc1)C1CC(C)(C)C1 395464686 GWVUONLEASPSME-CQSZACIVSA-N 278.396 2.129 10 10 CECE Cc1cc(Br)cc([C@@H](C)NCC2CNC2)c1O 817964755 HAIQURYTSZJDCR-SECBINFHSA-N 299.212 2.333 10 10 CECE CCOC(C)(C)C(=O)N[C@@H](C)c1ccccc1O 827957368 VEXZWJGFASIGTD-JTQLQIEISA-N 251.326 2.385 10 10 CECE C[C@H]1CN(Cc2cc3c(cc2O)CCC3)CCCO1 738159206 ATDJTKMKFXRDJZ-LBPRGKRZSA-N 261.365 2.492 10 10 CECE Cc1cc(O)c(CN2CC[C@@H](n3cncn3)C2)c(Cl)c1 840937507 ICVWLUGBPIKJCU-LLVKDONJSA-N 292.770 2.393 10 10 CECE Cc1cc(O)c(CNCCCc2ncn(C)n2)c(Cl)c1 842738600 OWPUAXUWMDOLRF-UHFFFAOYSA-N 294.786 2.205 10 10 CECE C[C@H](N[C@H](C)Cn1cncn1)c1ccc(Cl)cc1O 841746598 IZLMYZCWCKKWIB-ZJUUUORDSA-N 280.759 2.376 10 10 CECE CC(=O)C(=O)COC(=O)/C=C/C1CCCCCC1 845271326 VZGGYLUVPJYDIF-CMDGGOBGSA-N 252.310 2.214 10 10 CECE Cc1cc(O)c(CN2CCNC[C@H]2C(F)F)cc1C 843124975 UEMYHWDDKKOCGH-LBPRGKRZSA-N 270.323 2.048 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CCNC[C@@H]1C(F)F 843124942 QPVRJEIBHGLXEM-SNVBAGLBSA-N 294.704 2.224 10 10 CECE CC1(C)[C@@H](CNC(=O)c2c(F)ccc(O)c2O)C1(F)F 857328656 FMVLOJRUKAYXAR-MRVPVSSYSA-N 289.253 2.258 10 10 CECE CCOc1cccc(CNC[C@H](C(=O)O)C2CCC2)c1O 854245901 GGIALAYJQKYYPQ-ZDUSSCGKSA-N 293.363 2.381 10 10 CECE C[C@H](NC(=O)CC[C@@H]1CCCN1)c1ccccc1O 870988397 ONXYDYVKNRWPHI-RYUDHWBXSA-N 262.353 2.102 10 10 CECE Oc1ccc2ccccc2c1CN[C@H]1COC[C@H]1F 1876140232 OKZFQMYYMNZYMA-KGLIPLIRSA-N 261.296 2.372 10 10 CECE Nc1ccc(C[C@H](O)C[C@@H]2C[C@@]23CCCOC3)cc1 1895678897 GSSDEFQOJLYGAS-VNQPRFMTSA-N 261.365 2.379 10 10 CECE COc1cccc(N)c1C(=O)Nc1ccc(N)cc1 1876511078 LJCJJWRRHBLXEO-UHFFFAOYSA-N 257.293 2.112 10 10 CECE Oc1ccc(CN[C@H]2CC[C@@H]2C2CCC2)c(O)c1O 1876632819 MRBLXUIZOREHFK-NEPJUHHUSA-N 263.337 2.472 10 10 CECE Cc1ccc(C(=O)N2CC[C@H](C)[C@@H](F)C2)c(O)c1O 781019703 HKPYVSIZKYUJIQ-KWQFWETISA-N 267.300 2.226 10 10 CECE CNCc1ccc(N(C)CC23CC(CO2)C3)c(C)c1 1878439844 DXTVQYZEDAYNOV-UHFFFAOYSA-N 260.381 2.330 10 10 CECE C[C@H](N)c1cc(F)c(N2CCOCC23CC3)c(F)c1 1880928582 RNLQIFVKWLBWBS-VIFPVBQESA-N 268.307 2.354 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC[C@H](O)C[C@H]2C)c(F)c1 1880969923 DJDMRSSDPFJNJR-KKZNHRDASA-N 270.323 2.334 10 10 CECE COCCN(CCF)c1c(F)cc([C@H](C)N)cc1F 1880923678 KCLIHKMYGHLDLP-VIFPVBQESA-N 276.302 2.407 10 10 CECE c1cc(N2CC[C@H]3COC[C@@H]32)ccc1CNC1CC1 1899148276 MBABLPBBHLEZDW-BBRMVZONSA-N 258.365 2.164 10 10 CECE C[C@H](NCCCCN(C)C)c1cc(O)ccc1O 45663249 JFUOIZLQUVEAFA-NSHDSACASA-N 252.358 2.090 10 10 CECE CN(C)c1ccc(CN[C@H]2COC[C@H]2C2CC2)cc1 898384988 AUVMYSJPBARROU-HOTGVXAUSA-N 260.381 2.267 10 10 CECE OC[C@@]1(CNCc2c(O)cccc2F)CC12CCC2 1964070393 SKKJNJPLJIVPST-HNNXBMFYSA-N 265.328 2.174 10 10 CECE CC[C@H]1CN2CCC[C@H]2CN1Cc1ccccc1O 248404140 ZWTRZZCDIWBVEN-GJZGRUSLSA-N 260.381 2.451 10 10 CECE C[C@H](CN(Cc1cc(F)ccc1O)C1CC1)C(=O)O 1962949685 MAACEFAQXNEJNS-SECBINFHSA-N 267.300 2.216 10 10 CECE Cc1ccc(CNC[C@@H](CO)CC(C)C)c(O)c1 1963051876 VSKBNOZMSLJZKF-ZDUSSCGKSA-N 251.370 2.445 10 10 CECE COCCCNCc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1 75824298 JNOONYBXQYSKGA-GJZGRUSLSA-N 292.423 2.426 10 10 CECE Cc1[nH]nc([C@H](C)Cc2ccc(N)cc2)c1C(=O)O 82568784 GDSYQSBOWXJTGI-MRVPVSSYSA-N 259.309 2.345 10 10 CECE CC(C)Cc1nnc([C@@H](N)c2cccc(F)c2O)o1 83481148 CLYOVZBPTBUVHG-NSHDSACASA-N 265.288 2.161 10 10 CECE N[C@H](c1nc2c(s1)CCCC2)c1cccc(O)c1O 83548261 VIAVEIJWWWKRSS-LBPRGKRZSA-N 276.361 2.481 10 10 CECE Oc1ccc(F)cc1[C@@H]1NCCc2ccc(O)c(O)c21 83621039 BOYLMBUOUKLKNP-AWEZNQCLSA-N 275.279 2.178 10 10 CECE Cc1cc(F)ccc1S(=O)(=O)NCCCN=[N+]=[N-] 42013232 HOUZQFLCOSXMCY-UHFFFAOYSA-N 272.305 2.113 10 10 CECE FC(F)[C@@H]1CNCCN1Cc1ccc(N2CCCC2)cc1 1328412182 FWZONTXDAAKWSJ-HNNXBMFYSA-N 295.377 2.326 10 10 CECE C[C@H](NC[C@@]1(C)CCCO1)c1ccc(O)cc1O 94798186 DPAIAJAQXPLKFO-IINYFYTJSA-N 251.326 2.318 10 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CN[C@@H](C)c1ccc(N2CCN3CC[C@H]2C3)c(C)c1 2232036623 YINJZFUZZPHZNT-ZFWWWQNUSA-N 259.397 2.170 10 10 CECE COc1ccc(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])c(O)c1 2234168448 JJZHOLCISGAGTK-QWRGUYRKSA-N 276.296 2.362 10 10 CECE c1cc(N2CCCC2)ccc1CNCCN1CCCO1 2234120042 VCOZURSOOLUVKY-UHFFFAOYSA-N 275.396 2.014 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]3C2)c(F)c1 2224588239 MAUMYHLAOMCHSX-NYMYIZQJSA-N 265.328 2.086 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@H](OC)C[C@@H]1C 2235969007 YGFHNZQTSVTBFL-WFASDCNBSA-N 278.396 2.418 10 10 CECE CCN1CCc2cc([C@]3(O)C[C@H](C)CN[C@H]3C)ccc21 2235908487 WCDJIYGDVWOKTE-DCGLDWPTSA-N 274.408 2.275 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](N(C)C)C3(CC3)C2)c(F)c1 2236242936 BVUJBQLHEGNURG-XHDPSFHLSA-N 277.387 2.376 10 10 CECE CNCc1ccc(N2[C@H]3CCC[C@@H]2CN(C)C3)cc1 2226362471 WMYOMGPFFAEIMI-IYBDPMFKSA-N 259.397 2.079 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)C[C@@H](C)O3)C[C@@]1(C)CO 2226704916 ZUVNBPFPGYRKAT-HSMVNMDESA-N 261.365 2.465 10 10 CECE COc1ccc(N2CCOC[C@@H]2CO)cc1C(C)C 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CCCN(C[C@@H](C)O)c1ccc([C@@H](C)N)cc1F 2259746610 XIPUIDFZCCIICZ-GHMZBOCLSA-N 254.349 2.443 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H]2C[C@H](C1)C2(C)O 2270690626 RJWIQXJJBOQPES-ILMGOGQSSA-N 260.381 2.222 10 10 CECE Cc1cc(N2CC3(CC3)C[C@H]2CO)ccc1[C@H](C)N 2269661103 NDOHHQHJYZNNJE-JSGCOSHPSA-N 260.381 2.366 10 10 CECE C[C@@H]1C[C@H]2CCC[C@@H]2N1C(=O)c1cc(O)c(O)c(O)c1 2280165218 AQDHZODPIFYCQL-KKZNHRDASA-N 277.320 2.207 10 10 CECE Cc1cc(N(C)[C@@H]2CCC(=O)N(C)C2)ccc1[C@H](C)N 2285120660 HZVYISBONWVJJT-GXTWGEPZSA-N 275.396 2.072 10 10 CECE CNC(=O)[C@@H]1CCCCN1c1ccc([C@@H](C)N)c(C)c1 2285130114 QHIOPGVNZPRFIA-DOMZBBRYSA-N 275.396 2.120 10 10 CECE Nc1ccc(CC[C@@H](O)c2ccn(CC(F)F)n2)cc1 2296122132 YWCSSAPQXBATBI-CYBMUJFWSA-N 281.306 2.397 10 10 CECE CN(Cc1cccnc1O)c1ccc2c(c1)CC[C@@H]2O 2288572880 JHDFHCYAGUREAR-HNNXBMFYSA-N 270.332 2.403 10 10 CECE O=C(/C=C\c1cnccn1)N1CCc2ccccc21 491119094 NGTUIIIZURVMDJ-WAYWQWQTSA-N 251.289 2.079 10 10 CECE Cc1ccc(/C=C\C(=O)N(C)c2ccccn2)cn1 492434625 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10 10 CECE COc1ccc(N2CC[C@@](F)(C(F)F)C2)c(CN)c1 2337748392 RWUCOBUMINCPJQ-ZDUSSCGKSA-N 274.286 2.337 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@H]3C(CO)[C@@H]3C2)c1C 2340846964 QSYODJOTNVMWQJ-MRVWCRGKSA-N 261.365 2.031 10 10 CECE CO[C@@H](C)CCS(=O)(=O)Nc1cc(C)c(O)c(C)c1 2340882999 NZECTZCTTOLSFX-NSHDSACASA-N 287.381 2.176 10 10 CECE Oc1cc2c(cc1O)CN(Cc1ccccn1)CC2 2341216408 LAXUTFXWKLIXMG-UHFFFAOYSA-N 256.305 2.051 10 10 CECE Cc1ncc(CN(C)CCOc2ccc(N)cc2)o1 2342832269 WRHMJKXYACALCE-UHFFFAOYSA-N 261.325 2.076 10 10 CECE COc1ccc(N2C[C@@H](O)C[C@@H]2C(C)C)cc1OC 2344600155 FTZJICYIAWJDQP-QWHCGFSZSA-N 265.353 2.299 10 10 CECE CC(C)[C@H]1C[C@H](O)CN1c1ccc([C@H](C)N)cc1F 2344614363 PRVLVGWAXUYKHX-ITDIGPHOSA-N 266.360 2.441 10 10 CECE CO[C@H]1COCCN([C@@H](C)c2cc(C)ccc2O)C1 2351625238 AGXVHHWJQSXFST-QWHCGFSZSA-N 265.353 2.109 10 10 CECE CSc1cc(N2C[C@H](C)N(C)[C@H](C)C2)ccc1CN 2353855688 OWUHXTBNAISLOP-TXEJJXNPSA-N 279.453 2.396 10 10 CECE Oc1ccsc1-c1nc(C[C@H]2CCCO2)no1 111686921 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CCCNC(=O)CN(C)Cc1ccc(OCCC)cc1O 132980464 JKVZGTHHIKCWPF-UHFFFAOYSA-N 294.395 2.139 10 10 CECE CC(C)[C@@H](CN(C)C)N[C@H](C)c1ccc(O)cc1O 49195836 FPWCIRZSPCHXSJ-BXUZGUMPSA-N 266.385 2.335 10 10 CECE COc1ccc([C@@H](C)N[C@@H]2CCO[C@@H]2C)c(O)c1 226433885 DBCXIGNXDBHPDO-GIPNMCIBSA-N 251.326 2.229 10 10 CECE Nc1ccc(N2C(=O)[C@H]3CC[C@@H](C3)C2=O)cc1Cl 236393154 SNWLMXLHXZHENM-YUMQZZPRSA-N 264.712 2.212 10 10 CECE Nc1ccc(NC(=O)Cn2ncc3ccccc32)cc1 50523919 CYHILQRWUKVQDZ-UHFFFAOYSA-N 266.304 2.257 10 10 CECE COc1ccc(O)c([C@H](C)N2CCC[C@H]2C(=O)O)c1 251698036 MXOYUCGGSCOUGJ-CABZTGNLSA-N 265.309 2.011 10 10 CECE COC(=O)C[C@H](N)c1ccc(C)c(Br)c1O 260534222 XZBYNVGECCXHHI-QMMMGPOBSA-N 288.141 2.026 10 10 CECE Nc1ccc(OCCCS[C@H]2CC[C@H]2O)cc1 2252705472 JAUUKWMAXHFPFG-OLZOCXBDSA-N 253.367 2.294 10 10 CECE C[C@H](CN(C)c1ccc2c(c1)N(C)C(=O)[C@@H]2O)C1CC1 2164334558 NNGGVJXIPSDRPI-MEBBXXQBSA-N 274.364 2.179 10 10 CECE Cc1cc(O)c(CN2[C@H]3CC[C@H]2[C@H](CO)C3)cc1C 290865930 JWZVGFICBWPGQK-KKUMJFAQSA-N 261.365 2.354 10 10 CECE CN(C[C@H]1CCCNC1)c1ccc2c(c1)OC(F)(F)O2 2162620037 APAPAJUONZKKJN-JTQLQIEISA-N 284.306 2.444 10 10 CECE CCN1CCc2cc([C@H](O)[C@]34CCNC[C@H]3C4)ccc21 2163067536 XUMADXHKFHNFRK-PVAVHDDUSA-N 272.392 2.102 10 10 CECE CN[C@H](c1ccc(N2CCCC2)cc1)c1ccnnc1 2163100107 NXICEPDBRKWQLR-MRXNPFEDSA-N 268.364 2.386 10 10 CECE CCN(CC)c1ccc([C@]2(N)CCOC[C@@H]2OC)cc1 2163104483 FDYMBSLAMAOCOL-JKSUJKDBSA-N 278.396 2.122 10 10 CECE CCC[C@@H](OCC)[C@H](NN)c1ccc2c(c1)CCN2C 2163135049 GGWAEPBKANHAHA-HZPDHXFCSA-N 277.412 2.389 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H](O)[C@@H]3CCSC3)ccc21 2163242594 JSVQNFXUDWMOAP-KBMXLJTQSA-N 292.448 2.183 10 10 CECE CN(c1ccc2c(c1)COCC2)[C@H]1CC[C@H](O)CC1 2226714492 ZJKGGLAUSGSRSC-KOMQPUFPSA-N 261.365 2.499 10 10 CECE Cc1nc(CN)ccc1[C@H](C)NCCc1ccc(N)cc1 817956852 FEAIAAWSZAODIW-LBPRGKRZSA-N 284.407 2.324 10 10 CECE CCOc1ccc(CN2CCC[C@H](C)[C@H]2C(=O)O)c(O)c1 818631027 AGOMPPBHQCUDRM-NHYWBVRUSA-N 293.363 2.476 10 10 CECE CCOc1ccc(O)c(CN2C[C@H](C(=O)O)CC[C@@H]2C)c1 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10 10 CECE O=C(O)C=Cc1ccc(N2C[C@@H]3COCC[C@@H]32)cc1 1878798020 GJBKFWSJWQIXFP-OCCSQVGLSA-N 259.305 2.010 10 10 CECE Cc1nsc(Sc2ncc([C@H](C)N)s2)n1 1958554291 BAQJRAVLOMPGOQ-BYPYZUCNSA-N 258.397 2.474 10 10 CECE FC(F)(F)COc1ccc(N2CCN[C@H]3C[C@H]32)cc1 1879915221 OFUHLMBOXCTUFJ-NWDGAFQWSA-N 272.270 2.178 10 10 CECE CN(CC1CCCC1)C(=O)Cc1ccc(O)c(O)c1 1136435465 LTKLITRWSLBFJT-UHFFFAOYSA-N 263.337 2.289 10 10 CECE CC1(C)COCC[C@H]1NCc1cc(F)ccc1O 1962973120 ZMNRIVHZXJFFSL-CYBMUJFWSA-N 253.317 2.436 10 10 CECE Nc1ccc(Cn2c(CO)nc3cc(F)ccc32)cc1 76079310 FCDWCAXQXFQJIB-UHFFFAOYSA-N 271.295 2.298 10 10 CECE CO[C@@H](CO)CN[C@@H](C)c1ccc2ccccc2c1O 1964493392 KDACCUHQFXKMER-WCQYABFASA-N 275.348 2.203 10 10 CECE Cc1nc(=O)c2ccccc2n1-c1ccc(N)cc1 82659345 PQAXOAMNBAMENP-UHFFFAOYSA-N 251.289 2.276 10 10 CECE Cc1ccc(CNCc2ccc(O)c(O)c2O)cc1 83431960 OVYJXTAXKCGUPS-UHFFFAOYSA-N 259.305 2.402 10 10 CECE Cn1nccc1CNCc1c(O)cccc1Cl 83551856 DRBJPQBPFGWSFK-UHFFFAOYSA-N 251.717 2.069 10 10 CECE Cc1ccc(O)c([C@H]2NCCc3c(O)cc(O)cc32)c1 83598338 YMQUNAZKHGTBJW-INIZCTEOSA-N 271.316 2.347 10 10 CECE Oc1ccc([C@@H]2NCCc3c(O)ccc(O)c32)c(F)c1 83657929 FSPFJPZJSCHMGF-HNNXBMFYSA-N 275.279 2.178 10 10 CECE C[C@@H]1CN(c2ccc(CN)c(C(F)(F)F)c2)C[C@H]1CO 709374664 MLXZGAZLNVLPJZ-KOLCDFICSA-N 288.313 2.229 10 10 CECE Nc1ccc(CCCN[C@@H]2CO[C@@H](C3CC3)C2)cc1 691767553 UHQJTDKNHPPSRN-JKSUJKDBSA-N 260.381 2.359 10 10 CECE Oc1cccc2c1CN(c1ncncc1Br)C2 1187403963 GOFXNPIUNVILEF-UHFFFAOYSA-N 292.136 2.465 10 10 CECE CCCn1cc([C@@H](CSc2nccs2)NC)nn1 714979829 FVVZHNRXGBPMDL-SNVBAGLBSA-N 283.426 2.197 10 10 CECE CCN(CCS(C)(=O)=O)c1ccc2c(c1)CC[C@@H](C)N2 688491345 BEYNZTFOXWBWMQ-GFCCVEGCSA-N 296.436 2.304 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CNC(=O)c1cccc(O)c1O 717053316 SVSYWAZBMYIRTR-PKZYVASSSA-N 261.321 2.120 10 10 CECE Oc1cccc(CNCCCOC2CCC2)c1O 717269892 IBTYPCYXNGQAEH-UHFFFAOYSA-N 251.326 2.147 10 10 CECE CN[C@H](C)c1ccc(N2CCCC[C@H]2[C@H](C)O)cc1O 688641118 AVFFXCQNNDAFLB-XUJVJEKNSA-N 278.396 2.412 10 10 CECE CN[C@@H](C)c1ccc(N2CCSC[C@@H]2CCO)cc1 689748071 ZMDWGZRZEDPCIL-WFASDCNBSA-N 280.437 2.271 10 10 CECE O=C1NC(=S)SC1=Cc1cc(F)ccc1O 2303969028 OYVGSDJFPJGOKG-UHFFFAOYSA-N 255.295 2.020 10 10 CECE CCN(C)C(=O)CCN(C)[C@@H](C)c1ccccc1O 2117137585 YGRUGMUKIKRQIN-LBPRGKRZSA-N 264.369 2.253 10 10 CECE CNCc1ccc(N(C)CC2[C@@H]3COC[C@@H]23)cc1Cl 2118009348 KVFGMCLHGKZCQN-KBPBESRZSA-N 280.799 2.388 10 10 CECE CCN[C@]1(C(N)=O)C[C@H](C)C[C@@H](Sc2nccs2)C1 2118839818 UWQBPTYSTPVBOL-GIPNMCIBSA-N 299.465 2.257 10 10 CECE CN1CCc2cc([C@@H](NN)c3cscc3F)ccc21 2119256516 ZEYHTMHTCMCOFV-CQSZACIVSA-N 277.368 2.432 10 10 CECE C[C@@H]1CN(CCOCCc2ccc(N)cc2)C[C@@H]1C 2119733913 PHWJTNYCZFBJMV-OKILXGFUSA-N 262.397 2.416 10 10 CECE COc1cc(N)c(N2C[C@H]3CC=CC[C@H]32)cc1OC 2120639356 GJOOMCKMHRTDMD-ZYHUDNBSSA-N 260.337 2.441 10 10 CECE C[C@H](NC[C@@H]1C[C@@H]2C[C@@H]2CO1)c1cc(O)ccc1O 2122831599 PBHQHIKVSODMKK-KQXIARHKSA-N 263.337 2.173 10 10 CECE CC(C)N(CC(F)(F)F)c1ccc2c(c1)NC(=O)[C@@H]2N 105486227 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[N-]=[N+]=N[C@H]1CCN(C[C@@H]2COC3(CCCC3)O2)C1 1912183580 QXLKNGVCDGGCKS-WDEREUQCSA-N 252.318 2.057 10 10 CECE Cc1cc(C(=O)N2CC(N=[N+]=[N-])C2)oc1Br 1912180592 CSNCUQDORZZZRU-UHFFFAOYSA-N 285.101 2.485 10 10 CECE CC1C[C@H]2C(=O)N(CCCCN=[N+]=[N-])C(=O)[C@@H]2C1 1912204907 CLOJVPMLSHIIQM-NXEZZACHSA-N 250.302 2.108 10 10 CECE CN(C(=O)CN1CC[C@H](CN=[N+]=[N-])C1)C1CCCCC1 1912201665 XNRGDXHPXDLSHH-GFCCVEGCSA-N 279.388 2.410 10 10 CECE CN[C@@H]1CCc2cc(N3CC=C[C@@H](OC)C3)ccc21 2128296113 FNDYXMROYYFOEX-GDBMZVCRSA-N 258.365 2.285 10 10 CECE CN[C@@H]1CCCc2cc(N3CC=C[C@@H]3CO)ccc21 2128273475 KNIGWARJDFSDSC-GDBMZVCRSA-N 258.365 2.021 10 10 CECE CN[C@H]1CCc2cc(N3CCC[C@@H](O)CC3)ccc21 2128308846 KMKHNKVOAUIURW-ZBFHGGJFSA-N 260.381 2.245 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CC[C@H]3N)C[C@@H]1CO 2128312714 LKVLWJTVICJFLV-AXAPSJFSSA-N 260.381 2.087 10 10 CECE C[C@@H]1Cc2ccccc2[C@@]1(NCCN=[N+]=[N-])C(=O)O 2128958195 HRRXKAONXWDATN-NOZJJQNGSA-N 260.297 2.059 10 10 CECE CCOC(C)(C)CNCc1ccc(OC)cc1O 159277406 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10 10 CECE Oc1ccc(F)cc1CN1CCC[C@H](Cn2cncn2)C1 183257772 ZZOINAVDBIXEPC-LBPRGKRZSA-N 290.342 2.035 10 10 CECE CC(C)CN(CCN(C)C)c1cc2c(cc1N)OCCO2 42740735 JLEVRRJTWWIJSD-UHFFFAOYSA-N 293.411 2.064 10 10 CECE C[C@H]1CCc2cc(N3CCN4C(=O)CC[C@H]4C3)ccc2N1 228052370 SKAQJYIJKBJRLC-WFASDCNBSA-N 285.391 2.244 10 10 CECE CN[C@@H]1CCN(c2ccc(OC)c(F)c2)[C@@H](C)C1 49710995 QOMZOYSCLWYKPN-WDEREUQCSA-N 252.333 2.411 10 10 CECE CCC[C@@H](N[C@H](C)c1ccc(F)cc1O)C(=O)O 86734101 OUHAHBHOVXHUFL-LDYMZIIASA-N 255.289 2.435 10 10 CECE CN(C)C(=O)c1cc(NCCc2ccc(N)cc2)ccn1 40675773 ANGHGOGOFHGKBT-UHFFFAOYSA-N 284.363 2.020 10 10 CECE C[C@@H](NC[C@@H]1CCC[C@@H]1C(=O)O)c1cc(O)ccc1O 89447884 TXUGDDNNTGURJC-SCVCMEIPSA-N 279.336 2.249 10 10 CECE COc1ccc(N2CCN(CCCC[C@H](C)O)CC2)cc1 45619315 MNCGQQRDKAUNKY-HNNXBMFYSA-N 292.423 2.368 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC[C@H](C(F)(F)F)C3)ccc21 88422127 ANQGGSMUXXYNTO-QPUJVOFHSA-N 299.296 2.417 10 10 CECE COC[C@H](C)[C@@H](C)N[C@@H](C)c1cc(O)ccc1O 386148682 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CCNCc1ccc(N2CCC([C@@H](F)CO)CC2)cc1 2163283869 IUGZZEKWJAWECY-INIZCTEOSA-N 280.387 2.343 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]3OCC[C@@H]3C2)c(F)c1 724796450 IUTSOTPIDGHTDS-HCKVZZMMSA-N 264.344 2.461 10 10 CECE CC[C@H](Cn1cncn1)NCCCSc1nccs1 810219292 PWRPTCQQDIRXPN-LLVKDONJSA-N 297.453 2.285 10 10 CECE Oc1ccc2ccccc2c1CN1[C@H]2CC[C@@H]1CNC2 723876550 JNHHMTIHRDLHBL-OKILXGFUSA-N 268.360 2.482 10 10 CECE CCOc1cccc(CNC[C@@H]2C[C@@H]2COC)c1O 2133504958 OXRUVFAFZJRYEB-QWHCGFSZSA-N 265.353 2.163 10 10 CECE CC(C)NC(=O)CN(C)c1ccc([C@H](C)N)cc1Cl 723160276 UPBWLMILQHLASS-JTQLQIEISA-N 283.803 2.321 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@H]2[C@@H](C1)[C@@H]2C(=O)O 721195869 WGUKTKHFJGIVQN-MPNPMHGUSA-N 279.311 2.245 10 10 CECE CN(Cc1ccc(N)cc1)S(=O)(=O)CC1CC(C)(C)C1 723780829 GFABPEQVFZWYJU-UHFFFAOYSA-N 296.436 2.467 10 10 CECE CC(C)(CNCc1cc(Cl)ccc1O)[C@]1(O)CCOC1 842757841 AWCAMEAVWNZIFZ-HNNXBMFYSA-N 299.798 2.313 10 10 CECE CC(C)[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)C1 841958397 QBWREUCDIWFQFQ-AWEZNQCLSA-N 275.396 2.499 10 10 CECE COCC(C)(C)CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 840417083 OGHJTCLUTRQLJR-NSHDSACASA-N 295.379 2.208 10 10 CECE Cn1nccc1[C@@H]1CCCN1C(=O)c1cc(O)cs1 928371192 SMNPWLUWMOQSMS-NSHDSACASA-N 277.349 2.165 10 10 CECE CN[C@H](C)c1ccc(N(CCF)CCOC)cc1O 697291430 ZDPWEBXVUPPSQK-LLVKDONJSA-N 270.348 2.095 10 10 CECE COCCN(CCF)c1ccc(/C=C/C(=O)O)cc1F 697304132 VPEVPUPLOKLOOA-HWKANZROSA-N 285.290 2.346 10 10 CECE CCN1CCN(Cc2ccc(F)c(F)c2O)[C@@H](C)C1 877516386 DQUIPRLJKIFNLQ-JTQLQIEISA-N 270.323 2.196 10 10 CECE Cc1ccc(CN2CCO[C@]3(CCCOC3)C2)c(O)c1 877514347 KHIFFRBFVIOOQD-MRXNPFEDSA-N 277.364 2.082 10 10 CECE CN(C)c1ccc(CNC[C@H](O)c2cccnc2)cc1F 771981381 VVNKTSDRZJKMGR-INIZCTEOSA-N 289.354 2.110 10 10 CECE Cc1ccc2c(n1)N(C(=O)/C=C/c1cnn(C)c1)CCC2 876490612 BXZOYCLAPLKROJ-SOFGYWHQSA-N 282.347 2.116 10 10 CECE NCc1cc(F)c(N2C[C@@H]3[C@H](C(F)F)[C@@H]3C2)c(F)c1 1877071631 IXNXPGSMBYQYHF-AKZRSSKFSA-N 274.261 2.371 10 10 CECE C[C@H](CCN1CCOC1=O)N[C@H](C)c1ccccc1O 1876028093 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C[C@H](C(=O)NC1CCCC1)N1CCC[C@H]1CN=[N+]=[N-] 2123016361 XDGUYVFUCIWTHQ-PWSUYJOCSA-N 265.361 2.208 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccnc(Cl)c1 1630301698 HJBMNXLSHDELTN-UHFFFAOYSA-N 278.695 2.076 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@H](F)Cc1ccccc1 1570462191 IFTSBDBCMVPESF-CQSZACIVSA-N 289.306 2.295 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])C(C1CC1)C1CC1 1912170581 YXCLLNNOTWWTCD-LBPRGKRZSA-N 266.345 2.254 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(CC(=O)Nc2ccccc2F)C1 1912197737 YATVSVPTKFQORW-SECBINFHSA-N 263.276 2.149 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C[C@@H](O)COCc2ccccc2)C1 1912185162 MKZIYJJSCFJDEO-HUUCEWRRSA-N 290.367 2.339 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C[C@H]2CCCCNC2=O)C1 1912198242 DRQSKHRYXWNLNP-CHWSQXEVSA-N 279.388 2.315 10 10 CECE CS(=O)(=O)CCCCN1CCCC[C@@H](CN=[N+]=[N-])C1 1912158290 WIKHHPNNVMUUDP-LBPRGKRZSA-N 288.417 2.224 10 10 CECE CCCN(CCCCN=[N+]=[N-])S(=O)(=O)C1CC1 1912184024 BGTYPQJPGYIKSL-UHFFFAOYSA-N 260.363 2.281 10 10 CECE CC[C@H](CCOC)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1912192581 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CC1(C)CN(c2ccc3c(c2)CC[C@@H]3O)CC[S@@]1=O 2128316070 ZZPKJAFWBLDYAV-LIRRHRJNSA-N 279.405 2.014 10 10 CECE O[C@@H]1CCc2cc(N3CCOCC34CCC4)ccc21 2128321882 LJBLEOBVKGCIOR-OAHLLOKOSA-N 259.349 2.426 10 10 CECE CCN(CC1(O)CCC1)c1ccc2c(c1)CC[C@@H]2O 2128315876 XJPHISHTSAQGPG-HNNXBMFYSA-N 261.365 2.408 10 10 CECE CN(Cc1ncccn1)c1ccc2c(c1)CC[C@@H]2O 2128321020 GPWQURYNEKZIQF-AWEZNQCLSA-N 255.321 2.093 10 10 CECE CC[C@@H](C(=O)O)N1C[C@@H](C)Nc2cc(OC)ccc21 251208127 IUAINFFUVIJVDL-SKDRFNHKSA-N 264.325 2.179 10 10 CECE Cc1ccnc(C)c1CNCc1ccc(O)cc1O 2129790939 WXYZKQBBYWTXMD-UHFFFAOYSA-N 258.321 2.399 10 10 CECE COc1ccc(O)c(CN(CCN)C2CCCC2)c1 2130094968 ZRDYTFWICLHJLR-UHFFFAOYSA-N 264.369 2.104 10 10 CECE CCC(=O)NC1CCN(Cc2ccc(N(C)C)cc2)CC1 1203933940 IDXUOHMCCDQVCY-UHFFFAOYSA-N 289.423 2.243 10 10 CECE Nc1ccc(CNc2cc(N)ccc2[N+](=O)[O-])cc1 2141775910 LHBZGTUZRIDAGO-UHFFFAOYSA-N 258.281 2.371 10 10 CECE CO[C@@H]1CCN(c2ccc([C@@H](C)O)c(O)c2)C1(C)C 1914252648 YPAFDNCHFACCKT-QMTHXVAHSA-N 265.353 2.449 10 10 CECE CNCc1ccc(N2[C@H]3CCC[C@H]2COC3)c(C)c1 1900706922 GUHMHDXURXJOAR-GJZGRUSLSA-N 260.381 2.472 10 10 CECE CC(=O)C(=O)[C@@H](O)c1cc(F)c(Cl)cc1Cl 1904344215 RDPIFISTUAYHPK-JTQLQIEISA-N 265.067 2.324 10 10 CECE Nc1ccc(NC(=O)[C@H]2C[C@@H]2C2CCOCC2)cc1 2135343422 QKQAKQSRZPHKIT-KGLIPLIRSA-N 260.337 2.270 10 10 CECE CN1CCc2cc([C@@H](O)[C@H](N)C=C3CCC3)ccc21 2135937310 VTKCXEJBMBBAEX-GDBMZVCRSA-N 258.365 2.150 10 10 CECE C[C@H](CCCCCO)NCc1cc2c(cc1O)OCO2 1969742481 GPBRMXBSORFWDV-LLVKDONJSA-N 281.352 2.152 10 10 CECE Oc1cccc(Cl)c1CN1CCO[C@H]([C@H]2CCOC2)C1 1967740285 VJLLMQUSJDXKPX-NHYWBVRUSA-N 297.782 2.283 10 10 CECE OCCCC1(NCc2cc(F)cc(F)c2O)CC1 1967719524 HGFWBORYIXSRPF-UHFFFAOYSA-N 257.280 2.065 10 10 CECE COc1ccc(O)c(CN[C@@H](C)CCCCCO)c1 1969749109 LJBUDQUFPAUFAM-LBPRGKRZSA-N 267.369 2.432 10 10 CECE CCOc1cccc(CNC[C@H]2C[C@H](O)C2(C)C)c1O 1967878398 ZMPLQGKYDVBMEJ-OCCSQVGLSA-N 279.380 2.288 10 10 CECE C[C@H](C(=O)NCc1cc(N)ccc1O)C1CCCC1 1924149324 SNKAWDLXVWUMSQ-JTQLQIEISA-N 262.353 2.417 10 10 CECE CO[C@H](C)COc1ccc(N2CCCNCC2)c(F)c1 228593537 OQQHSCSVSGXGSY-GFCCVEGCSA-N 282.359 2.039 10 10 CECE CCNCc1ccc(N(CC)CCOC)cc1OC 2139685144 CWUYUZRDOOOCSK-UHFFFAOYSA-N 266.385 2.277 10 10 CECE CCC[C@@](O)([C@@H](N)c1ccccc1O)C(F)(F)F 1925664740 SQKFBALQAHMDCE-WDEREUQCSA-N 263.259 2.486 10 10 CECE O=C(O)CN(CCC(F)(F)F)Cc1ccc(F)cc1O 1968120178 BEGCWDMEGMHDCJ-UHFFFAOYSA-N 295.232 2.370 10 10 CECE COc1ccc(N(C)[C@@H]2CNCC[C@H]2C)c(F)c1F 2136988520 OHNFDJNZYBOQQI-MWLCHTKSSA-N 270.323 2.408 10 10 CECE Cc1cccc(CN[C@H]2C[C@H]3CC[C@@H](N3)[C@@H]2C)c1O 2139760556 BAJYYVIDXGRYLI-MYPMTAMASA-N 260.381 2.319 10 10 CECE Oc1cc(F)ccc1CN1CC[C@@H]2CCOC[C@H]2C1 2139796433 OWCZGWWWIKVAQW-DGCLKSJQSA-N 265.328 2.390 10 10 CECE C[C@@H](NCc1ccc(O)cc1O)[C@@]12CC[C@@H](CO1)C2 2137295307 QEQNCIHNHASITI-HFAKWTLXSA-N 263.337 2.145 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H]1OCC[C@H]1C 123950496 NUOVGFCUEBMFAI-UHIISALHSA-N 263.337 2.337 10 10 CECE CC[C@@H]1COC[C@@H]1NCc1cnc(SC)s1 2208766507 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CECE CCCn1cccc1C(=O)NCc1ccc(N)cc1 159401654 OJAXJBMPRJEROC-UHFFFAOYSA-N 257.337 2.410 10 10 CECE CN(C(=O)CN1CC=CCC1(C)C)c1ccc(N)cc1 2150027468 DJPVADMLZIBRMO-UHFFFAOYSA-N 273.380 2.272 10 10 CECE CC(C)NCc1ccc(N2CC[C@@H](CO)C2)c(F)c1 162180413 GCCVFUHYEDQYJP-CYBMUJFWSA-N 266.360 2.142 10 10 CECE CNC(=O)[C@H]1[C@H](C)CCN1c1ccc([C@@H](C)N)c(Cl)c1 2146446480 CPUKOTPWFZUWCT-GPCCPHFNSA-N 295.814 2.321 10 10 CECE CN[C@H](c1ccccc1O)c1cc(Br)nn1C 2000252605 FGDQNPHPOCITGX-GFCCVEGCSA-N 296.168 2.197 10 10 CECE C[C@@H]1CC[C@@H](CNCc2ccc3c(c2)CCN3C)N1C 2151632604 AGRAINOIBKKSLX-CJNGLKHVSA-N 273.424 2.251 10 10 CECE Nc1ccc(NC(=O)NCc2conc2C2CC2)cc1 2152635027 RDYUPNCRQDAAFH-UHFFFAOYSA-N 272.308 2.456 10 10 CECE Cn1ncc(Br)c1CN1CCC[C@@H]1CN=[N+]=[N-] 2009444094 BGYVMVZGVIGFTN-MRVPVSSYSA-N 299.176 2.457 10 10 CECE CC[C@@]1(C)CC[C@@H](CNCc2ccc(O)c(O)c2O)O1 2153960001 FMYCQGAGSPHOSQ-NHYWBVRUSA-N 281.352 2.241 10 10 CECE CN(C[C@H]1COCCCO1)[C@H]1CCc2cccc(O)c21 2153985139 GSTBFBUXBMCZPV-KBPBESRZSA-N 277.364 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2.202 10 10 CECE COc1c(C)ccnc1NC(=O)c1ccc(O)c(O)c1 2238403517 QZRXZVMWYGXFFI-UHFFFAOYSA-N 274.276 2.062 10 10 CECE COc1ccc(N2CC[C@H](OC(F)(F)CF)C2)c(N)c1 2238904315 ROEFZRZUCYAUQR-JTQLQIEISA-N 290.285 2.435 10 10 CECE CN(C)C[C@@H]1C=CCN1c1ccc2c(c1)CCC[C@@H]2O 2239104009 MWNOGBRBQSCANF-RDJZCZTQSA-N 272.392 2.363 10 10 CECE C[C@H](N[C@H](C(F)F)[C@H]1CCOC1)c1ccc(O)cc1O 2239519459 YUHMGIOVBQSVGD-RVBZMBCESA-N 287.306 2.419 10 10 CECE COc1ccc(N2[C@H]3CC[C@H](O)[C@H]2CC3)cc1OC 2229865252 XUGMISMAWGSWDD-RTXFEEFZSA-N 263.337 2.196 10 10 CECE CCN(c1ccc([C@@H](C)O)cc1C)[C@H]1CCCNC1=O 2240841435 HGYSNTYLHOCEQO-DOMZBBRYSA-N 276.380 2.153 10 10 CECE Nc1ccc(OCC(=O)NCC(Cl)=CCl)cc1 2253219234 CKTWBKTVOVINSJ-UHFFFAOYSA-N 275.135 2.083 10 10 CECE N=C(NO)c1cnc(SC2C[C@H]3C[C@@H]3C2)s1 2246272636 GNMZVAHVOOGMTM-PHDIDXHHSA-N 255.368 2.338 10 10 CECE CSc1ncc(CNCc2cnc3n2CCC3)s1 2257103169 QUSZZLJQKRPAAB-UHFFFAOYSA-N 280.422 2.298 10 10 CECE CO[C@H]1CN(c2ccc([C@@H](C)N)c(C)c2)C[C@@H]1F 2257457429 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COc1ncccc1N(C)C(=O)/C=C/c1ccc(C)nc1 492531839 HRAQOQGDZBUHAR-CMDGGOBGSA-N 283.331 2.470 10 10 CECE Cc1cccc(O)c1CN1CCC[C@@H](C(=O)N(C)C)C1 1237489426 HMJYAWUSDACLMR-CYBMUJFWSA-N 276.380 2.001 10 10 CECE Cc1ccc(CN[C@@H]2[C@H]3COC[C@H]32)c(O)c1Br 2307472274 DLBWLPWGDKUTMM-IAZYJMLFSA-N 298.180 2.198 10 10 CECE NC[C@H]1C[C@@H]2CC[C@H]1N2Cc1ccc(Cl)cc1O 2309703769 KEXOPCSHACHMQU-KGYLQXTDSA-N 266.772 2.357 10 10 CECE CCN(CCN=[N+]=[N-])CC(=O)N1CCCC[C@H]1C 2315987985 CKVJNQVKPHMPSX-LLVKDONJSA-N 253.350 2.020 10 10 CECE Cn1cc(Cl)cc1C(=O)NCCOc1ccc(N)cc1 63130414 MKEHIRNUTFLIPF-UHFFFAOYSA-N 293.754 2.070 10 10 CECE C[C@@H](CN(C)C)N(C)c1ccc([C@@H](C)N)cc1F 2326785306 OVOWVJILHGCVQA-WDEREUQCSA-N 253.365 2.232 10 10 CECE FC1(F)CC12CN(c1ccc3c(c1)CNCC3)C2 2326873827 ULBQPFAXXIISCO-UHFFFAOYSA-N 250.292 2.178 10 10 CECE CSc1cc(N2C[C@H]3OCC[C@@H]3C2)ccc1CN 2328542934 GPAKOCOQZCTDST-DGCLKSJQSA-N 264.394 2.092 10 10 CECE CC[C@H](N[C@@H]1C[C@@H](CO)[C@@H]2C[C@H]12)c1ccccc1O 2329878137 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1879185291 OKGPWMCSOFAVHW-UHIISALHSA-N 266.360 2.456 10 10 CECE FC(F)COc1ccc(N2CCN[C@H]3CC[C@H]32)cc1 1879901969 BMOYVKXUFKDFEZ-QWHCGFSZSA-N 268.307 2.271 10 10 CECE C[C@H](c1cc(F)ccc1O)N(CC(N)=O)C1CCCC1 132989459 KPWLVEHUHFLWGG-SNVBAGLBSA-N 280.343 2.322 10 10 CECE C[C@H](N)c1cc(F)c(N2C[C@@H](O)CC2(C)C)c(F)c1 1880924240 PGQMAKODELBKEF-WPRPVWTQSA-N 270.323 2.334 10 10 CECE CC[C@]1(O)CCN(c2c(F)cc([C@H](C)N)cc2F)C1 1880927162 KZIIGNDDQOICKO-XPTSAGLGSA-N 270.323 2.336 10 10 CECE CCN[C@@H](C)c1cc(F)c(N(CC)CCO)c(F)c1 1880962886 PAGYKJICPRKFHH-JTQLQIEISA-N 272.339 2.454 10 10 CECE Cc1nccnc1NC(=O)NCc1ccc(N(C)C)cc1 1350278399 GAGPMVNOEDAHCD-UHFFFAOYSA-N 285.351 2.173 10 10 CECE CC[C@H](CN)Nc1c(N)cccc1Br 1888904582 CJFBGFDFLSQMDU-SSDOTTSWSA-N 258.163 2.181 10 10 CECE Oc1cccc(F)c1CNC[C@H]1CCC[C@H](O)C1 1964044127 WFVRMWDSKFSYPL-QWRGUYRKSA-N 253.317 2.172 10 10 CECE Nc1ccc2c(c1)[C@H](c1c(O)cccc1F)NCC2 75750938 SXBNSLONYVQBAR-OAHLLOKOSA-N 258.296 2.349 10 10 CECE CC[C@H](C)N[C@@H](c1nnco1)c1cc(F)ccc1O 83481300 WPBITAXINSZCLD-QPUJVOFHSA-N 265.288 2.392 10 10 CECE COc1ccc2c(c1)[C@H](c1cccc(O)c1O)NCC2 83619183 BJQSGOFONCQFLN-HNNXBMFYSA-N 271.316 2.342 10 10 CECE CCOC(=O)c1cccn1CCOc1ccc(N)cc1 84888520 WICLTHXSXOKGDY-UHFFFAOYSA-N 274.320 2.326 10 10 CECE COCc1cc(CNCc2ccc(Cl)cc2O)on1 1964616672 YHQMVRMCQNKGQW-UHFFFAOYSA-N 282.727 2.470 10 10 CECE C[C@H]([C@@H]1CCCCO1)N(C)C(=O)c1cccc(O)c1O 706063805 NCQMIJBCGGIPKQ-MFKMUULPSA-N 279.336 2.127 10 10 CECE C[C@H](O)c1ccc(N2CCC[C@H]2C(C)(C)O)cc1O 707366538 NVAJUGQOEULCQM-HZMBPMFUSA-N 265.353 2.185 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](C)[C@H](CO)C2)c(Cl)c1 709196083 NIYZBZFFCWYFKK-SCVCMEIPSA-N 268.788 2.424 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2C[C@H]1CCN(C)C1 691398720 AKLTYBWJTWWNEU-KGLIPLIRSA-N 273.424 2.411 10 10 CECE Oc1cc(Br)ccc1CNCc1cocn1 691430532 YHVQZVIHFNYEAV-UHFFFAOYSA-N 283.125 2.433 10 10 CECE C[C@@H]1CC[C@@H](C)N(CC(=O)N(C)c2ccc(N)cc2)C1 88700037 GILSJZQOFNPSMD-CHWSQXEVSA-N 275.396 2.352 10 10 CECE CCCN(Cc1ccc(N)cc1)C(=O)[C@H]1CCO[C@@H]1C 94173795 RFXPPSZDGBUHLD-DOMZBBRYSA-N 276.380 2.432 10 10 CECE CN(Cc1ccc(N)cc1)[C@H]1CCO[C@]2(CCOC2)C1 94379234 KHSCNZPNWPIONM-JKSUJKDBSA-N 276.380 2.039 10 10 CECE C[C@@H](CCCO)NCc1ccc2c(c1)CCCN2C 94942226 JMLQFMXAUUVNPF-ZDUSSCGKSA-N 262.397 2.320 10 10 CECE CC1(C)CC[C@@H](O)[C@H](NC(=O)c2cc(O)cs2)C1 1352032356 NIHPIOPPUKUBQR-NXEZZACHSA-N 269.366 2.123 10 10 CECE CC(=O)c1ccc(O)c(CN2CCP(C)(=O)CC2)c1 2115298035 IVYPJKMXLFYSFE-UHFFFAOYSA-N 281.292 2.403 10 10 CECE CCNCc1ccc(N2CC[S@@](=O)C[C@@H]2C)c(C)c1 2115327108 YBNVPYDPVRTELC-ORAYPTAESA-N 280.437 2.062 10 10 CECE Nc1ccc(CN[C@H]2c3ccccc3C[C@@H]2O)cc1 2116553268 BCXCWDYXQHPDQO-HOTGVXAUSA-N 254.333 2.017 10 10 CECE CC(F)(F)CCC(=O)NCc1cc(O)ccc1O 1455357815 VSAYAMJSVZXPLP-UHFFFAOYSA-N 259.252 2.149 10 10 CECE Cc1cn2ccc(C(=O)NCc3c(O)cccc3F)cc2n1 1456030955 UFPTYUYYLNDFKM-UHFFFAOYSA-N 299.305 2.417 10 10 CECE CN(C)c1ccc(CN[C@H](CO)c2cscn2)cc1 2118999946 WAXVNFJRNSOPKM-CYBMUJFWSA-N 277.393 2.032 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2[C@@H]3CCO[C@H]32)c(O)c1 2119928551 GVMZPIRUUYIMQW-GCVYGYKWSA-N 263.337 2.086 10 10 CECE C[C@H](N)c1ccc(N2CC(CCN(C)C)C2)c(F)c1 2120158511 GUKAHDQORDSIBB-NSHDSACASA-N 265.376 2.233 10 10 CECE CN(C)[C@H]1CC[C@H](NCc2c(O)cccc2F)CC1 2121441159 HVCZJDNZTOLNPP-HAQNSBGRSA-N 266.360 2.494 10 10 CECE Cc1ccccc1-c1nnnn1Cc1ccc(N)cc1 213320984 FCIOFWNDDROQPK-UHFFFAOYSA-N 265.320 2.279 10 10 CECE COc1ccc(CN[C@@H](CNC(C)=O)C(C)C)cc1C 1715486050 XBQZAXOWOXJPQJ-HNNXBMFYSA-N 278.396 2.254 10 10 CECE COc1ccc(O)c(C(=O)NCc2cc(C)ccc2O)c1 1629736691 MOEASXVDAIJBKV-UHFFFAOYSA-N 287.315 2.345 10 10 CECE O=C(NCc1cccc(Cl)c1O)c1cc[nH]c1 1648606114 IQHBICGLZJRRRJ-UHFFFAOYSA-N 250.685 2.304 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cc(C=O)oc2C)c1 1641733350 SGZQGYFOPMQTRZ-UHFFFAOYSA-N 273.288 2.345 10 10 CECE Cc1nnsc1C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 1912151557 IXCPXHPVQMWQHT-MRVPVSSYSA-N 266.330 2.009 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@@H]1CSC(c2ccccc2)=N1 1912197009 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COc1ccc(O)c(CNC(=O)/C=C/c2cncc(C)c2)c1 153181822 AHSHFLAMMFPICQ-ZZXKWVIFSA-N 298.342 2.434 10 10 CECE CN(C)c1ccc(CN2CCC[C@@H](O)C2(C)C)cc1 258838629 PRFHZCMEKVNEHD-OAHLLOKOSA-N 262.397 2.488 10 10 CECE CCc1cc(CN[C@H](CN)C(C)C)ccc1OC 258792137 JKLIEMAEXAYITR-CQSZACIVSA-N 250.386 2.331 10 10 CECE CNC[C@H](CNCc1ccc2c(c1)CCO2)C(C)C 259005460 OHASRRPZIKMZEY-OAHLLOKOSA-N 262.397 2.203 10 10 CECE Nc1ccc(NC(=O)CCCCn2ccc(=O)cc2)cc1 33507554 PIHOAWSCNOTIJY-UHFFFAOYSA-N 285.347 2.240 10 10 CECE C[C@H](NCc1ccc(Cl)cc1O)c1ncnn1C 1657949216 CULGSLMVJYVNFE-QMMMGPOBSA-N 266.732 2.025 10 10 CECE CC1(C)OCCO[C@@H]1CNCc1cccc(Cl)c1O 2130399442 AHGOPNQNDGQQFU-GFCCVEGCSA-N 285.771 2.329 10 10 CECE COc1ccc([C@H](C)N[C@H]2CC[C@@](C)(O)C2)c(O)c1 2130303134 MKUBIWVVDRPBBY-ZIBATOQPSA-N 265.353 2.355 10 10 CECE C[C@@H]1C[C@@H](N(C)c2ccc3c(c2)NC(=O)[C@@H]3O)CS1 2132955078 WZORQQJENVPCLG-ZDSQKVDBSA-N 278.377 2.002 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCCc3ccc(N)cc3)[C@H]2C1 2133986293 XQMLGFIBJIXSKV-DMRZNYOFSA-N 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CCC[C@H](NC(=O)c1cccc(O)c1O)C(F)F 2069617965 TUHOWWLWIMZTQW-QMMMGPOBSA-N 259.252 2.261 10 10 CECE CC[C@@H](COC)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2073174185 WHASVSNWLNZQEP-QWRGUYRKSA-N 254.334 2.208 10 10 CECE Nc1ccc(CCNC(=O)[C@]23CCC[C@@H]2CSC3)cc1 2201864643 AFUVSRNDAXPQDO-CJNGLKHVSA-N 290.432 2.461 10 10 CECE CC[C@@H](N[C@@H](C)c1cc(F)ccc1O)C(=O)N(C)C 2100227439 CJBVDKJRCXVFNH-JOYOIKCWSA-N 268.332 2.049 10 10 CECE CN(Cc1cc(F)ccc1O)[C@@H](CC(=O)O)C(F)F 2100591812 HNGKJYNYWDFTAB-VIFPVBQESA-N 277.242 2.072 10 10 CECE C[C@]1(C(=O)NCc2ccc(N)cc2)C[C@@H]1C(F)(F)F 2100662460 PSSAPUXXRGTOQE-JQWIXIFHSA-N 272.270 2.474 10 10 CECE CCC[C@@H]1C[C@@H]1CN(C)S(=O)(=O)Cc1ccc(N)cc1 2200157301 ZMHUYPWOFGYMCD-ZIAGYGMSSA-N 296.436 2.467 10 10 CECE C[C@@]12CC[C@H]1CCN2C(=O)COc1ccc(N)cc1 2101049216 GCKBKQMFLFXELR-XHDPSFHLSA-N 260.337 2.049 10 10 CECE CC[C@H]1CNCCCN1Cc1ccc(F)cc1O 2084071706 JLVWNSLIIZARNU-ZDUSSCGKSA-N 252.333 2.105 10 10 CECE CNCc1ccc(N(C)[C@H]2CCSC2)cc1OC 2084012279 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283.322 2.396 10 10 CECE CN(Cc1ccsn1)C(=O)CCc1ccc(N)cc1 705678302 XYIQBJHYAWXMCF-UHFFFAOYSA-N 275.377 2.317 10 10 CECE Cc1cc(N2CCC[C@@H]3CN(C)CC[C@@H]32)ccc1CO 2171164823 HESKAJNJAAASBE-PBHICJAKSA-N 274.408 2.408 10 10 CECE COc1ccc(N2CCC[C@@H](n3ccnc3)C2)c(N)c1 2171258608 WYXHSSAZODRKLJ-GFCCVEGCSA-N 272.352 2.315 10 10 CECE C[C@]1(CO)CCCCN1c1ccc(CO)cc1F 723049607 FQXJZBLRCYIARC-CQSZACIVSA-N 253.317 2.059 10 10 CECE CCC1(C(=O)O)CN(Cc2ccc(N(C)C)cc2)C1 722888523 IYEKIUVKHNOKEC-UHFFFAOYSA-N 262.353 2.049 10 10 CECE OCc1ccc(N2CCO[C@@H](CCF)C2)cc1Cl 691878938 JRBYXXZEFILWCL-LBPRGKRZSA-N 273.735 2.397 10 10 CECE CCc1cccc(CN2CCN(C)C(C)(C)C2)c1O 692130464 XYBCBYIJZXFZAL-UHFFFAOYSA-N 262.397 2.481 10 10 CECE CO[C@H](CN[C@H](C)c1c(O)cccc1O)C(C)C 381894627 KJGKWZPGAASXDM-ZWNOBZJWSA-N 253.342 2.419 10 10 CECE C[C@@H]1CCC[C@@H](C(=O)NCc2cc(N)ccc2O)C1 383253772 KSMCKZUYCIFOGT-GHMZBOCLSA-N 262.353 2.417 10 10 CECE CCOCCCN(C)c1cc2c(cc1N)NC(=O)CC2 383568811 WPSKGXPRHBIGGY-UHFFFAOYSA-N 277.368 2.016 10 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2.304 10 10 CECE Nc1ccc(Oc2nc3cnc(Cl)nc3[nH]2)cc1 2065473814 BRPIZIWJEORICR-UHFFFAOYSA-N 261.672 2.381 10 10 CECE CCN1[C@@H](C)CN(c2ccc([C@@H](C)N)c(O)c2)C[C@H]1C 2186946600 FETBWNGXPGHDDJ-FRRDWIJNSA-N 277.412 2.331 10 10 CECE CN[C@H](C)c1cc(F)c(N(C)CCCO)c(F)c1 2074222031 UKYQOTRVLFUQIW-SECBINFHSA-N 258.312 2.064 10 10 CECE CO[C@@H]1C[C@]2(C(=O)N3CCC[C@H](N=[N+]=[N-])CC3)C[C@@H]12 2101264859 DRRWPJLPUKKHNQ-MEWQQHAOSA-N 264.329 2.103 10 10 CECE COc1ccc(N2C[C@H](C)C[C@@H](N)C2)c(F)c1F 2081863410 PCDNYSHHJWBSHB-RKDXNWHRSA-N 256.296 2.147 10 10 CECE COc1cccc(O)c1CN[C@H](CO)C1CCCC1 2104433410 GFDRBADPIIQQTB-CYBMUJFWSA-N 265.353 2.042 10 10 CECE CC(C)CN1CC[C@@H](NCc2c(O)cccc2F)C1 2104473986 MOGCESGROXWLJY-GFCCVEGCSA-N 266.360 2.351 10 10 CECE Nc1ccc(NC(=O)N[C@H]2CC[C@]23CCCO3)cc1 2104445100 MDCBEEDSXTVDJY-GXTWGEPZSA-N 261.325 2.102 10 10 CECE CO[C@H]1C[C@H](C)CN(Cc2cc(F)ccc2O)C1 2085097638 IVULVPDNNMEHRY-GWCFXTLKSA-N 253.317 2.388 10 10 CECE C[C@@H]1C[C@@H](CN(C)Cc2cc(N)ccc2O)CCO1 2105362887 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COc1cccc(CN[C@@H]2CCC[C@@](C)(O)C2)c1O 2102057113 MYVCOXWBSKBXGZ-IUODEOHRSA-N 265.353 2.184 10 10 CECE NCc1ccc(N2CCC[C@@]23CC[S@@](=O)C3)cc1Cl 2102251507 LTSLMTNPJDPLSQ-IFXJQAMLSA-N 298.839 2.290 10 10 CECE C[C@@H](N)c1cnc(Sc2nnnn2C2CCCC2)s1 2103569823 YUMSXIRBOFFONU-SSDOTTSWSA-N 296.425 2.416 10 10 CECE COc1cc(CNCc2c(O)cccc2OC)sn1 2104441814 BVCLSHWGPVXGNS-UHFFFAOYSA-N 280.349 2.156 10 10 CECE CC[C@H](C)N(C)CCNCc1c(O)cccc1OC 2104437373 FKUHNJFFTIGSDA-LBPRGKRZSA-N 266.385 2.221 10 10 CECE COc1cccc(O)c1CN1CC[C@H]2COCC[C@H]21 2104431889 KANSTDIBGFVACI-WCQYABFASA-N 263.337 2.012 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2F)C[C@]1(C)C(=O)O 2104513577 XDNCLIREBIMBSB-XPTSAGLGSA-N 267.300 2.074 10 10 CECE NCc1ccc(N2CCc3ncccc3C2)c(F)c1 2104955264 VSHPLHOFNZOHSL-UHFFFAOYSA-N 257.312 2.242 10 10 CECE Nc1ccc(CCNc2cccc(C(=O)O)n2)cc1 2105956327 WJRSWEFIOTULFF-UHFFFAOYSA-N 257.293 2.017 10 10 CECE C[C@@H]1CCCN(c2ccc3c(c2)OCCO3)[C@@H]1CN 2106318854 HCGGPTSNBHCNDY-DGCLKSJQSA-N 262.353 2.021 10 10 CECE CC[C@@H]1CN(c2ccc(OC)c(OC)c2)CC[C@H]1N 2106332680 WWXLRTDQSXBMBU-DGCLKSJQSA-N 264.369 2.267 10 10 CECE CC[C@H](C)[C@H](N)[C@@H](O)c1ccc2c(c1)CCN2CC 2106791149 PJJWQGGEUQKGAG-UVBJJODRSA-N 262.397 2.476 10 10 CECE CN[C@H](CCOCCOC)c1ccc(N(C)C)cc1 2106794235 VGKIHRYRFWBKGL-OAHLLOKOSA-N 266.385 2.066 10 10 CECE CCN1CCc2cc([C@@H](NN)[C@@H]3[C@@H](C)[C@H]3C)ccc21 2106860342 BEHKGDCKPYCTBT-LZJQFABFSA-N 259.397 2.475 10 10 CECE C[C@@H](C1CC1)N(C)[C@H](CN)c1ccc(N(C)C)cc1 2087041345 FTOIXRUGAJBFLC-BLLLJJGKSA-N 261.413 2.483 10 10 CECE Oc1ccc(CNC[C@@H]2CCCC[C@@H](O)C2)c(O)c1 2107483783 JUJBNLSACDLLPG-DGCLKSJQSA-N 265.353 2.129 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H]2CC[C@H]3O)cc1C 2088645063 WBUBQAJCKVANAW-FVQBIDKESA-N 260.381 2.064 10 10 CECE O=C(CN1CC[C@H]1C1CCC1)c1ccc(O)c(O)c1 2088639232 SSHJUUGPVFPNSL-LBPRGKRZSA-N 261.321 2.155 10 10 CECE CC1(C)CC(=O)N[C@@H]1Cn1ccc2cc(N)ccc21 2089686759 ZINYSSWBOQNSED-CYBMUJFWSA-N 257.337 2.138 10 10 CECE CN(C[C@H](O)C1CCCC1)c1ccc(CN)c(F)c1 2111296532 ICZSJVCAQXTASN-HNNXBMFYSA-N 266.360 2.272 10 10 CECE COc1nn(C)cc1Cn1ccc2cc(N)ccc21 2111597170 KTCVEDQJDQINIZ-UHFFFAOYSA-N 256.309 2.014 10 10 CECE N[C@@H](c1ccccc1O)[C@@H](O)c1cccc(F)c1F 2091867617 NIULMXPFPXVFRD-KBPBESRZSA-N 265.259 2.404 10 10 CECE NC(=O)Nc1cccc(NCc2ccc(N)cc2)c1 2092532304 ROWSPNDWSLMZTD-UHFFFAOYSA-N 256.309 2.372 10 10 CECE CO[C@@H]1CCN(CCOc2ccc(N)cc2)C[C@H]1C 2092891457 TUACFGOAMPJGGL-IUODEOHRSA-N 264.369 2.004 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H]3[C@@H](CO)[C@@H]3C2)cc1Cl 2093148457 LPQBFDRMIDIYNG-GJQVQUKXSA-N 281.783 2.458 10 10 CECE CC(C)C1CC(=O)N(Cc2ccc(N)cc2)C(=O)C1 2095685088 WDKKOZHBYFIHPR-UHFFFAOYSA-N 260.337 2.190 10 10 CECE CCCNC[C@@H]1CCN1c1ccc2c(c1)COCC2 2096493560 QNGBTCOVFQXJTB-INIZCTEOSA-N 260.381 2.338 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(CCCO[C@H]2CCOC2)CC1 2099333708 PRVXPAXJXMQDPN-STQMWFEESA-N 268.361 2.347 10 10 CECE COc1ccc(Br)c(CN[C@H]2C[C@@H]2F)c1O 2211304853 SPAAYBHJMISFQJ-IUCAKERBSA-N 290.132 2.363 10 10 CECE COc1cc(C)cc(C(=O)Cc2ccc(N)cc2)n1 2112501160 OMKIIHXWWHJKJE-UHFFFAOYSA-N 256.305 2.406 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@H]3C[C@H]2[C@@H]3CO)cc1 2203130292 GBJIRTUUWAEOKK-BMFZPTHFSA-N 274.408 2.392 10 10 CECE CCO[C@@H](CNC(=O)Nc1ccc(N)cc1)C(F)(F)F 2203842509 IJGPCDXCEKGYBB-JTQLQIEISA-N 291.273 2.358 10 10 CECE CCNCc1ccc(N2CC[C@@H](O)C2(C)C)cc1OC 2204547563 GTMAHPBPQKQNMQ-OAHLLOKOSA-N 278.396 2.154 10 10 CECE CNCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)cc1OC 2204551162 ZTABHHRBCVPYGY-IMRBUKKESA-N 282.334 2.362 10 10 CECE COc1cc(N(C)Cc2cccc(C)n2)ccc1CN 2204550357 RACJFXVQJHPQQP-UHFFFAOYSA-N 271.364 2.494 10 10 CECE COc1cc(N(C[C@@H]2CCOC2)C2CC2)ccc1CO 2204543379 MRXLUGYWPJHGOR-LBPRGKRZSA-N 277.364 2.193 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)CCC[C@@H]3N)C[C@@H]1CO 2205811709 ZVADVZJEXKJKDU-QEORTHHSSA-N 274.408 2.477 10 10 CECE CNCc1ccc(N2C[C@@H](C)C[C@H](OC)C2)cc1OC 2205855222 BWBBMJPCIQAJJL-WFASDCNBSA-N 278.396 2.276 10 10 CECE CO[C@@H]1C[C@H](C)CN(Cc2cc(C(C)=O)ccc2O)C1 2205968524 MBBZQRXSFRBBNV-XHDPSFHLSA-N 277.364 2.452 10 10 CECE Cc1cc(CN(C)c2ccc3c(c2)CC[C@@H]3O)ncn1 2206513249 ASGKUFQLZKHXKN-INIZCTEOSA-N 269.348 2.401 10 10 CECE CSc1ncc(CNC2CCN(C)CC2)s1 2208425872 RYBGRXKOVMEBHV-UHFFFAOYSA-N 257.428 2.049 10 10 CECE CC[C@]1(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])CCCO1 2218746341 PULXQUCIXXCZGH-JFGNBEQYSA-N 252.318 2.293 10 10 CECE COc1ccc(N(C)C[C@@H](O)C(C)C)c(OC)c1 2219647081 KMESNRAAUMUUBU-CYBMUJFWSA-N 253.342 2.157 10 10 CECE COc1ccc(N2CCCNC(C)(C)C2)c(F)c1 2220312016 FLNOOMXLQREARE-UHFFFAOYSA-N 252.333 2.413 10 10 CECE COc1ccc(N2CC[C@](C)(F)C2)c(CCN)c1 2220420716 HPAJDWSNGOSTRP-AWEZNQCLSA-N 252.333 2.135 10 10 CECE CP(C)(=O)[C@H](O)CN1CCCC[C@@H](CN=[N+]=[N-])C1 2221496139 DECQTHFQHBTJOF-QWRGUYRKSA-N 274.305 2.340 10 10 CECE COC12CCC(NCc3ccc(O)c(O)c3)(CC1)C2 2231801728 MOPAXFQVURTRLE-UHFFFAOYSA-N 263.337 2.289 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@@H](CO)C[C@@H](C)C1 2232094561 UKXUXIYDMAGVJA-BNOWGMLFSA-N 262.397 2.469 10 10 CECE CN(CC1(Cl)CC1)C(=O)CCc1ccc(N)cc1 2222124453 LWODVNMDROVJNZ-UHFFFAOYSA-N 266.772 2.431 10 10 CECE Nc1ccc(CNC(=O)[C@@H]2CC[C@H]2C(F)(F)F)cc1 2224360837 JKLUFVYGNBPVFP-GHMZBOCLSA-N 272.270 2.474 10 10 CECE Cc1cnc(N(C)[C@@H](C)c2ccccc2O)[nH]c1=N 2225131492 COAROCXBHGGAGX-JTQLQIEISA-N 258.325 2.101 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)[C@H]1CC12CCOCC2 2225792683 PFZFSIRPTCJWJZ-GMTAPVOTSA-N 264.329 2.151 10 10 CECE CC[C@@H](CN(C)c1ccc(OC)cc1C[C@H](C)N)OC 2235972550 BEWREXYVSLGLSK-JSGCOSHPSA-N 280.412 2.446 10 10 CECE COc1ccc(N2C[C@H](C)OCC[C@@H]2C)c(CCN)c1 2235973161 FNVPHKZQTGITSU-STQMWFEESA-N 278.396 2.200 10 10 CECE CNCc1cc(OC)ccc1N(C)C[C@H]1CC[C@H]1OC 2236140027 LUDKMRBIHQGJKG-MLGOLLRUSA-N 278.396 2.276 10 10 CECE C[C@@H]1CC[C@H]1Cn1cc(COc2ccc(N)cc2)nn1 2236228108 UNZXSEQQUWKQEL-NEPJUHHUSA-N 272.352 2.485 10 10 CECE C[C@@H]1CC[C@H](CO)N(c2ccc3c(c2)COCC3)C1 2226715108 GXTSRASIGZZUNF-MLGOLLRUSA-N 261.365 2.357 10 10 CECE COc1ccc(N(C)CC2CSC2)c(C[C@H](C)N)c1 2227685264 DNRZOGBOXFEXPZ-NSHDSACASA-N 280.437 2.384 10 10 CECE COC[C@@H]1CCCN(c2ccc(OC)cc2CO)C1 2227709548 VNIOEYFBKRAJFV-GFCCVEGCSA-N 265.353 2.050 10 10 CECE C[C@@H](CO)CC1CN(c2c(F)cc([C@@H](C)O)cc2F)C1 2238727868 YYNHEQWYIQJEOC-NXEZZACHSA-N 285.334 2.473 10 10 CECE Oc1cccc(CNC[C@@H]2OCC[C@H]2C(F)(F)F)c1O 2240520904 ROEKMHZTGMIZPJ-KOLCDFICSA-N 291.269 2.155 10 10 CECE C[C@H](CF)N(C)[C@H](CN)c1ccc(N(C)C)cc1 2257912174 KABWPOPKCXDTPL-BXUZGUMPSA-N 253.365 2.042 10 10 CECE CSc1ncc(CNCC2CCC(N)CC2)s1 2248739035 CKOCQRBINIFRHP-UHFFFAOYSA-N 271.455 2.472 10 10 CECE CC[C@@H]1[C@H](O)CCN1c1ccc([C@H](C)N)cc1F 2260390983 LBEVQIDJVJZFCP-MRCXROJRSA-N 252.333 2.195 10 10 CECE CN1CCc2cc([C@]3(O)CCC[C@]3(C)CN)ccc21 2271268310 BRJHGOKGTQPNET-HZPDHXFCSA-N 260.381 2.015 10 10 CECE Cc1ccc([C@H](C)N[C@@H](CC(C)C)C(N)=O)c(O)c1 2264461497 UXONCZNKCDSWJI-AAEUAGOBSA-N 264.369 2.251 10 10 CECE CC(C)[C@@H]1[C@H](C(=O)O)CCN1Cc1ccc(N)cc1 2264800059 TWLFYJUSLXJWJS-ZIAGYGMSSA-N 262.353 2.200 10 10 CECE CN[C@H]1CCCc2cc(N(C)CC3COC3)ccc21 2269767190 LRYWUBSLWYUQIR-INIZCTEOSA-N 260.381 2.366 10 10 CECE C[C@H]1CN(c2ccc(OC(F)F)cc2)C[C@@H](CCO)O1 2295854300 DMKQHMYCEGPKIP-GXFFZTMASA-N 287.306 2.264 10 10 CECE CCC1(C)CN(C(=O)NCCc2ccc(O)c(O)c2)C1 2282896629 KPYJJYHARRXMPF-UHFFFAOYSA-N 278.352 2.082 10 10 CECE COc1cc(C)c(N2CC[C@]3(C[C@H](O)CO3)C2)c(C)c1 2285071504 BNKXBHGEXOFNPB-BBRMVZONSA-N 277.364 2.042 10 10 CECE Cc1cc(N2CCC(F)(F)[C@@H](CO)C2)ccc1[C@@H](C)N 2285124366 OQSFNHXKIPSIFQ-VXGBXAGGSA-N 284.350 2.469 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3C[C@@H]4NCC[C@H]43)ccc21 2286365879 FACNMJUVLWCCKC-IVSAIRAKSA-N 272.392 2.100 10 10 CECE C[C@H]1CN(C(=O)/C=C\c2cnccn2)c2ccccc2O1 491743315 MUDVABJTEDUQQP-DGMVEKRQSA-N 281.315 2.304 10 10 CECE CCOC(=O)[C@H](CC)Oc1ccc(N(C)C)cc1 1227939236 PLCXAFPLOOEHSP-ZDUSSCGKSA-N 251.326 2.473 10 10 CECE CC[C@@H]1CN(C(=O)C=Cc2ccc(O)c(O)c2)C[C@H](C)O1 2308001338 YVIDJNXMBVOHNO-WCQYABFASA-N 291.347 2.137 10 10 CECE C[C@H](N[C@H]1C[C@H](CO)[C@@H]2C[C@H]12)c1cc(F)ccc1O 2329877832 UHIXMLAAMHDXAE-FMHBKDTISA-N 265.328 2.199 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CCC[C@H]3C[C@@H]2CO)cc1 2329630031 ODBZYDCBDGTZNL-JMGFVUJMSA-N 260.381 2.446 10 10 CECE Cc1ccc([C@@H](C)N[C@@H]2C[P@@](C)(=O)C[C@H]2O)c(O)c1 2330867822 DFJSMRKKNNEQSF-ZRXDBEOPSA-N 283.308 2.087 10 10 CECE Oc1cccc2c1[C@H](NC[C@H]1[C@@H]3CCOC[C@@H]31)CC2 2331248021 SLANYALQIJCZEX-XDQVBPFNSA-N 259.349 2.252 10 10 CECE Cc1ccc(O)c(CN[C@H]2C[C@H]3[C@H]4CC[C@@H](O4)[C@@H]23)c1 2331830513 YSOANFAQONESLU-BHQQPIICSA-N 259.349 2.356 10 10 CECE COc1cc(Cl)cc(CN2CCOC[C@H](F)C2)c1O 2336686721 MOJORRKEYSBMDN-LLVKDONJSA-N 289.734 2.225 10 10 CECE CC1(C)CN(c2ccc(CN)c(C3CC3)c2)C[C@@H]1O 2339157233 GUCAHZLFSGTWTO-HNNXBMFYSA-N 260.381 2.230 10 10 CECE C[C@@H]1[C@H](O)CCCN1c1ccc(CN)c(C2CC2)c1 2339157737 MYFGPRYIIBWECI-BDJLRTHQSA-N 260.381 2.372 10 10 CECE CC(C)n1ncnc1[C@H](C)NCc1ccccc1O 2340522591 RSBSFJADHONYJB-NSHDSACASA-N 260.341 2.415 10 10 CECE Cc1c([C@@H](C)N)ccc(N(CCO)CC(F)F)c1C 2340846663 PBCLUKCROPZZEN-LLVKDONJSA-N 272.339 2.387 10 10 CECE 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10 10 CECE CC(=O)C(=O)COc1cc(F)ccc1Br 808025237 FKZXLEXSPLVTGV-UHFFFAOYSA-N 275.073 2.125 10 10 CECE COc1ccc(N2CC[C@@H]3CNC[C@H]3CC2)cc1OC 2162633168 VNTMVUQCORJWJD-CHWSQXEVSA-N 276.380 2.140 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@@]3(COC)C2)c(F)c1 2165466577 CEOUKYKCWIZVBM-BBRMVZONSA-N 278.371 2.408 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCCN3C)C[C@@H](C)[C@@H]1N 2163094866 PBXHJILXYGVYLH-LAQFHYBYSA-N 273.424 2.489 10 10 CECE CN1CCCc2cc([C@@H](O)C34CCC(CC3)N4)ccc21 2163097284 MTIBKHLCYDOGLE-ARWYELJZSA-N 272.392 2.387 10 10 CECE O[C@@H](c1ccc(N2CCCCC2)cc1)[C@@H]1C[C@@H](F)CN1 2163106196 IPAWYWJQWYLIKD-KBMXLJTQSA-N 278.371 2.410 10 10 CECE CCN1CCc2cc([C@@H](N)[C@@](C)(O)C(F)(F)F)ccc21 2163135762 NBLUQBIEHHDNBS-CHWSQXEVSA-N 288.313 2.382 10 10 CECE Fc1cc(OC2C[C@@H]3C[C@H]3C2)ccc1N1CCNCC1 2163936015 YSYUTSGBRMKDNM-RYUDHWBXSA-N 276.355 2.413 10 10 CECE C[C@H](N)CCCNC(=O)/C=C/c1ccc(N(C)C)cc1 721649813 AQJYJXKPOODCAD-YKWSONSWSA-N 275.396 2.009 10 10 CECE Nc1ccc(OCC(=O)NCCC2CC=CC2)cc1 724173693 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2103527268 PVBQHYCDMCIZNM-CBAPKCEASA-N 271.263 2.071 10 10 CECE COc1cc(N(C)C2CC(CF)C2)ccc1CN 2084005905 RSTPDMMJWSBRAX-UHFFFAOYSA-N 252.333 2.338 10 10 CECE COc1cccc(O)c1CN[C@H]1CC[C@@H](OC)CC1 2104449700 XNMBLMNPRAGNIX-TXEJJXNPSA-N 265.353 2.448 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H]2CCN(C)[C@@H]2C1 2104479910 MRUKEZQUSHYEMX-DZGCQCFKSA-N 260.381 2.227 10 10 CECE CN(C)[C@@H]1CCC[C@@H]1CNCc1c(O)cccc1F 2104478973 ZVFKYSYGTGFRAH-BXUZGUMPSA-N 266.360 2.351 10 10 CECE C[C@H](O)c1ccc(N2CCc3nnccc3C2)cc1 2104906586 KCGYRYCMNJDZLQ-NSHDSACASA-N 255.321 2.093 10 10 CECE CC1(C)CC[C@H](CO)N1c1ccc(CN)c(F)c1 2084884668 XEIXENDLOQZJEN-GFCCVEGCSA-N 252.333 2.024 10 10 CECE COc1ccc(N2CCCC[C@@H]2[C@@H](C)N)cc1OC 2106336222 IWVQPGHRWCVQDN-DGCLKSJQSA-N 264.369 2.410 10 10 CECE COc1ccc([C@@H](N)c2ccc(N(C)C)cc2)nc1 2106797464 AZSWTYWMEBYKKE-HNNXBMFYSA-N 257.337 2.204 10 10 CECE CN1CCC[C@@](O)(c2ccc(N3CCCC3)cc2)C1 2106830858 KNSFOLYGTYZJEQ-INIZCTEOSA-N 260.381 2.200 10 10 CECE 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259.397 2.042 10 10 CECE COc1ccc(CN[C@H](C)C23CC(CO2)C3)c(O)c1 2096902392 BAASASXMXNAMLR-RWWNRMGGSA-N 263.337 2.058 10 10 CECE C[C@H](NCc1cc(Cl)n(C)n1)c1cc(O)ccc1O 2097527061 SBQLBIOTBSAILI-QMMMGPOBSA-N 281.743 2.336 10 10 CECE COc1ncsc1[C@H](O)c1ccc2c(c1)CCN2C 2097767113 IADANUYQCFXXPK-GFCCVEGCSA-N 276.361 2.226 10 10 CECE CN(c1ccc2c(c1)COCC2)[C@H]1CCCCNC1 2112843559 UPZPPEMIFJEAGD-INIZCTEOSA-N 260.381 2.338 10 10 CECE Cc1ccc(O)c(CNC2CN(C3CCCC3)C2)c1 2112961515 FUOXCOCYRNGOSA-UHFFFAOYSA-N 260.381 2.417 10 10 CECE COc1ccc(N2CC[C@@H]3OCCC[C@@H]3C2)c(N)c1 2113895838 XIBOLRVCQAXMES-ABAIWWIYSA-N 262.353 2.283 10 10 CECE Cc1cc(N(C)[C@H]2CCN(C)C[C@H]2C)ccc1CO 2114010003 TZASGLPBMLQOOE-CJNGLKHVSA-N 262.397 2.264 10 10 CECE CC[C@@H]1CN(c2ccc(CN)cc2F)C[C@H]1N(C)C 2114130664 KBYDGMCTPMPRSQ-IUODEOHRSA-N 265.376 2.061 10 10 CECE CCN(c1ccc([C@H](C)N)cc1Cl)[C@H]1CCNC1=O 2114768640 ATYXAGCVTJKWJP-ZANVPECISA-N 281.787 2.075 10 10 CECE CO[C@@H]1CCN(c2ccc(CO)cc2Cl)C[C@]1(C)OC 2201530112 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10 CECE CCN[C@@H](C)c1ccc(N2CC([N+](=O)[O-])C2)cc1C 2269660467 LEGAWNNKKJPPDO-NSHDSACASA-N 263.341 2.131 10 10 CECE O[C@@]12CCN(c3ccc(CNC4CCC4)cc3)C[C@H]1C2 2280026448 MWWBFACLGKYAFN-RHSMWYFYSA-N 272.392 2.290 10 10 CECE COC[C@]1(C)C=CCN1c1ccc(OC)cc1C(=O)O 2284545203 XBTYCYYYJDUEOF-HNNXBMFYSA-N 277.320 2.175 10 10 CECE Cc1cc(N2CCO[C@@H](C(C)(C)O)C2)ccc1[C@@H](C)O 2285177489 SHOINTAXDWQUKM-IUODEOHRSA-N 279.380 2.024 10 10 CECE CCCNCc1ccc(N(C)CC2COC2)cc1OC 2285293760 RONCFNFZWFXJRD-UHFFFAOYSA-N 278.396 2.277 10 10 CECE COc1cc(NCc2cccc(C)c2O)nc(C)n1 1160768955 FVLAFVDIKSQWDS-UHFFFAOYSA-N 259.309 2.420 10 10 CECE COc1cc(Cl)c(N(C)[C@@H](C)CO)c(OC)c1 2303044977 IGOHLBGATDIKFR-QMMMGPOBSA-N 259.733 2.174 10 10 CECE CN(C)c1ccc([C@@]2(C)NCC(F)(F)CO2)cc1 2314849537 SKERLCUJBJCJMJ-LBPRGKRZSA-N 256.296 2.180 10 10 CECE C[C@]12C[C@H]1C(=O)N(c1c(Cl)cc(N)cc1Cl)C2=O 2317918485 VIGMGGCMIAOEFS-QTTZVWFDSA-N 285.130 2.475 10 10 CECE Cc1cc(N2CCc3cc(O)c(O)cc3C2)sn1 2318674386 BJNSRDGQPZSLDU-UHFFFAOYSA-N 262.334 2.425 10 10 CECE O=C(O)[C@H]1C[C@@H]2CN(Cc3ccc(Cl)cc3O)C[C@@H]21 2330521204 KYLOSFHGIJXWKW-USWWRNFRSA-N 281.739 2.198 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](F)[C@H](CO)C2)cc1Cl 2330777358 FKSKSLYVFGSMSX-PKFCDNJMSA-N 286.778 2.387 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@@H]3C[C@H]2[C@@H]3C(=O)O)c1 2333052454 SJGITPRLNZLGNZ-JYYRZZBQSA-N 261.321 2.167 10 10 CECE C[C@H](NC[C@@H]1C[C@@H]1CC(=O)O)c1cc(F)ccc1O 2335889471 XVJZITSBLVQDHE-AEJSXWLSSA-N 267.300 2.293 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H]2C[C@H]2CC(=O)O)c1 2335894170 JCVNGAMYOHGMJY-SDDRHHMPSA-N 263.337 2.462 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC=CC[C@H]2CO)c1C 2340845574 BWTJNEGHOQFLCH-KBPBESRZSA-N 261.365 2.484 10 10 CECE Cc1c([C@H](C)O)ccc(N(C)Cc2ncon2)c1C 2340853393 PMOULVCXDCVPCV-NSHDSACASA-N 261.325 2.376 10 10 CECE CN(CCCCN=[N+]=[N-])C[C@@H]1CC[C@H]2COC[C@@H]2O1 2351598648 IYSYCCBDYULHCP-AVGNSLFASA-N 268.361 2.203 10 10 CECE CNCc1ccc(N(C)C[C@H]2O[C@H]3CC[C@H]2C3)cc1 2352621200 ZLSCVCXWWAVVTC-CWRNSKLLSA-N 260.381 2.410 10 10 CECE CN1C[C@H]2CCC[C@H](N(C)Cc3ccc(N)cc3)[C@H]2C1 2354095338 GZFUUBCCGSQHSJ-PVAVHDDUSA-N 273.424 2.431 10 10 CECE Nc1ccc(O)c(CNC(=O)C[C@H]2CCC[C@@H]3C[C@H]23)c1 2355642280 KHRWQYDLCXZMSP-GYSYKLTISA-N 274.364 2.417 10 10 CECE CN1C(=O)/C(=C\c2cccc3nccnc23)SC1=S 102735439 ABCMGTZQNSGRPR-JXMROGBWSA-N 287.369 2.461 10 10 CECE CO[C@@H](C)CN(Cc1ccccc1O)C[C@H]1CCCO1 248416639 IYWJLRSLMXSZHH-DZGCQCFKSA-N 279.380 2.408 10 10 CECE COc1ccc(Cl)cc1NC(=O)c1cc(O)nc(O)c1 170223036 QZIULSMXBRMMAV-UHFFFAOYSA-N 294.694 2.407 10 10 CECE c1cncc(CNCCSc2nccs2)c1 53646955 QEUJYCSTOVKEGM-UHFFFAOYSA-N 251.380 2.420 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)C(=O)NCCC(F)(F)F 170030898 HYACTNFZBDIEEH-QMMMGPOBSA-N 291.269 2.345 10 10 CECE CSC[C@H](C)N(C)C(=O)Cc1ccc(N)cc1 123222933 ZMJFESXGKFYVMX-JTQLQIEISA-N 252.383 2.021 10 10 CECE CN(Cc1ccccc1O)C(=O)C[C@H](N)c1ccccc1 37823762 QLHNOTUDAQBQKH-HNNXBMFYSA-N 284.359 2.441 10 10 CECE Cc1cnc(NC(=O)c2ccn(-c3ccc(N)cc3)n2)s1 35427827 VDPLNVWTYMDATE-UHFFFAOYSA-N 299.359 2.472 10 10 CECE CN1CCc2cc(CNC[C@](C)(O)c3ccco3)ccc21 123692830 RSQCYDJBJQGREY-KRWDZBQOSA-N 286.375 2.269 10 10 CECE CN1CCc2cc(CN[C@@H]3C[C@@H]4CC[C@@H]3O4)ccc21 132079154 QAEAFMIULPHJGS-LZWOXQAQSA-N 258.365 2.088 10 10 CECE NCc1c(O)cc(Br)cc1Br 44249911 ACGFVKMFYXMNDY-UHFFFAOYSA-N 280.947 2.376 10 10 CECE CCCCCNC(=O)[C@H](C)OC(=O)Cc1ccc(N)cc1 41098618 QSGKRLXGAZLHMH-LBPRGKRZSA-N 292.379 2.049 10 10 CECE CC(C)N[C@@](C)(CSc1nccs1)C(=O)O 45595991 DCBAKVGHEJNNBC-JTQLQIEISA-N 260.384 2.077 10 10 CECE Nc1ccc(CCC(=O)NC[C@@H]2CCCC[C@H]2CO)cc1 89502637 CKVOMFPYVHJQNH-GJZGRUSLSA-N 290.407 2.116 10 10 CECE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)C)C1 336403883 QEBVAOFCFKZSJL-UHFFFAOYSA-N 299.418 2.496 10 10 CECE CN[C@@H](C)c1ccc(N(CCO)CC(F)F)cc1 231322496 QPRYGWOSDOKONG-JTQLQIEISA-N 258.312 2.031 10 10 CECE CN(C[C@H]1C[C@@H](O)C1)c1ccc2c(c1)OC(F)(F)O2 2226706856 OPTYDVMRERUZIJ-WAAGHKOSSA-N 271.263 2.215 10 10 CECE C[C@@H]1CCC[C@](O)(CNCc2cc3c(cc2O)OCO3)C1 96480091 FFZVJRNCOSQXKY-BDJLRTHQSA-N 293.363 2.152 10 10 CECE Cc1cc(Br)cc([C@H]2COCCN2)c1O 95719163 JZMYQAHVLMOQBO-SNVBAGLBSA-N 272.142 2.124 10 10 CECE CC[C@@H](C)NC(=O)CN1CCCc2cc([C@H](C)N)ccc21 252917303 BUOURITYDXFVKI-OLZOCXBDSA-N 289.423 2.374 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](C)[C@H]2CO)c(F)c1 299990094 ZCTLLTDNCNNRRO-UEKVPHQBSA-N 266.360 2.313 10 10 CECE Nc1ccc(CCCN2C[C@@H]3CCC[C@H](C2)C3O)cc1 2167788692 YWYFRHVGBIQFOU-FKEKPDDDSA-N 274.408 2.294 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3CC[C@H](C2)C3O)cc1 2167793238 VZWQJVKKZXSIMJ-FKEKPDDDSA-N 274.408 2.392 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)/C=C\c1cccnc1 701305483 GXHBOVOCUYFUHV-FJOGCWAESA-N 257.297 2.396 10 10 CECE NCc1ccc(N2CCC[C@@H]3CC[C@H](O)C[C@@H]32)c(F)c1 2167008649 DYBYTRMUBKBAMO-WWGRRREGSA-N 278.371 2.414 10 10 CECE COc1ccc(N(C)CCN2C[C@H](C)O[C@@H](C)C2)cc1 2165172760 WAJJJOFEDGITNP-KBPBESRZSA-N 278.396 2.241 10 10 CECE CN[C@@H]1CCC[C@](O)(c2ccc3c(c2)CCN3C)CC1 2163073808 MNQQLAHAFLGDRH-NVXWUHKLSA-N 274.408 2.419 10 10 CECE CCCN1CC[C@](O)(c2ccc3c(c2)CCN3CC)C1 2163080280 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C[C@@H](N)c1ccc(N2C[C@H]3CCN(C)C[C@@H]3C2)c(F)c1 380450882 NMNGPBUMZINHKS-MRVWCRGKSA-N 277.387 2.233 10 10 CECE CCc1cccc(CN2CC[C@H](N(C)C)[C@@H]2C)c1O 692129385 LARPFSCJDSTKLM-WFASDCNBSA-N 262.397 2.479 10 10 CECE CNCc1ccc(OC)c(CN2CCC(C)(C)C2=O)c1 380966864 SCCJVEXVCYNJTP-UHFFFAOYSA-N 276.380 2.173 10 10 CECE CS[C@@H]1CCN([C@@H](CN)c2ccc3c(c2)CCN3C)C1 382933094 KXAUQOAAGTXRIN-ZBFHGGJFSA-N 291.464 2.116 10 10 CECE CC[C@@H]1[C@@H](C)CCN1CC(=O)c1ccc(O)c(O)c1 384282988 ISEXGNLQDXBMGF-CMPLNLGQSA-N 263.337 2.401 10 10 CECE C[C@@H](CCCO)CN[C@@H](C)c1cc(O)ccc1O 384738753 QLFVATNFRVVNDP-QWRGUYRKSA-N 253.342 2.157 10 10 CECE COc1ccc(O)c([C@@H](C)N2CCNC[C@@H](C)C2)c1 385227334 NLFBWHXBUSLSCH-VXGBXAGGSA-N 264.369 2.003 10 10 CECE Cc1cc(N(C)[C@@H]2C[C@H]3CCCN(C3)C2)ccc1CO 717421207 ZZEGNTVDZQDUPX-RHSMWYFYSA-N 274.408 2.408 10 10 CECE C[C@H](c1cc(F)ccc1O)N1C[C@H]2COC[C@@H]2C1 718149323 XRDHDAPFFNIMFU-VWYCJHECSA-N 251.301 2.171 10 10 CECE CC(C)N(CCn1ccnc1)Cc1ccc(N)cc1 386512477 CCXVJZKWGABIOC-UHFFFAOYSA-N 258.369 2.376 10 10 CECE COc1ccc(N(C)CCNCCSC)cc1 696953479 XCFCRPMMFRQQLG-UHFFFAOYSA-N 254.399 2.084 10 10 CECE COc1cccc(CNC2(CCO)CCSCC2)c1O 719673657 FFNSJCJRXWIFJU-UHFFFAOYSA-N 297.420 2.139 10 10 CECE CN1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(F)c1O 720464275 GJRQHPPPNWAGQQ-UONOGXRCSA-N 264.344 2.200 10 10 CECE C[C@@H](CN[C@@H]1CCc2cccc(O)c21)N1CCCC1 389237085 ASEUZACOTJHUNP-GXTWGEPZSA-N 260.381 2.453 10 10 CECE CCN[C@@H](C)c1ccc(N(OC)[C@@H]2CCOC2)cc1O 2164736913 HEOXPYWEODFKES-WCQYABFASA-N 280.368 2.219 10 10 CECE Nc1ccc(CCC(=O)OC[C@@H]2CCCC[C@H]2O)cc1 393271713 ZUPYXZDKLNVNMX-DZGCQCFKSA-N 277.364 2.296 10 10 CECE C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1CCN 723905687 MFSWTBRZGNLDIC-WDEREUQCSA-N 268.788 2.462 10 10 CECE CN(C)c1ccc(N)c(OCCC(=O)NC(C)(C)C)c1 2173504678 KLXGZBWBCXXOBU-UHFFFAOYSA-N 279.384 2.018 10 10 CECE CNCc1ccc(N2CCC(N3CCCC3)CC2)cc1 395216733 KRBPQHHUEZNSBZ-UHFFFAOYSA-N 273.424 2.471 10 10 CECE C[C@H](CCO)CCN[C@@H](C)c1cc(O)ccc1O 397792035 SWMYBUMENHQWFB-QWRGUYRKSA-N 253.342 2.157 10 10 CECE CC(C)(NC(=O)COc1ccc(N)cc1)C1CCC1 398079459 QISFEHZFXFASFN-UHFFFAOYSA-N 262.353 2.343 10 10 CECE CN[C@H](C)c1ccc(N(C)CC[S@](C)=O)cc1Cl 399029395 POKZDQJYHQTJQG-MGNBDDOMSA-N 288.844 2.435 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3C[C@@H]3[C@@H]3C[C@H]3N)ccc21 2174195447 GJZBBGGWAXUNTN-YCCFLXJFSA-N 272.392 2.086 10 10 CECE Cc1ccc(O)c([C@H](C)N(C)C[C@@]2(C)COCCO2)c1 2174265088 WYSGFNOBPFKAJV-BBRMVZONSA-N 279.380 2.499 10 10 CECE CCCOc1cc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)ccc1N 2174306181 DFMAUCHYQJUAJN-OBJOEFQTSA-N 276.380 2.122 10 10 CECE CCc1cccc(CN2CCN(CC(F)F)CC2)c1O 848883499 OVXMSDYXYBUCIX-UHFFFAOYSA-N 284.350 2.337 10 10 CECE Cc1cc(N(C)C[C@@H]2C[C@H]3C[C@@H]3CO2)ccc1CCN 2179463110 WRGUGLGJYBEXEP-INMHGKMJSA-N 274.408 2.357 10 10 CECE CC(C)CNCc1ccc(N2CC3(CC[C@@H]3O)C2)cc1 2179702652 FAEYIRPRRIYKEY-INIZCTEOSA-N 274.408 2.393 10 10 CECE CC(C)[C@H]1CN(C)CCN1CCCc1ccc(N)cc1 2170560726 RMQCJJILEWXOFT-QGZVFWFLSA-N 275.440 2.473 10 10 CECE C[C@@H](N)c1ccc(N2CCC(n3ccnn3)CC2)cc1 2170663805 CIHPINOEPPRUEJ-GFCCVEGCSA-N 271.368 2.139 10 10 CECE CN1CCc2cc([C@H](O)C[C@H]3N[C@@H]4CC[C@H]3C4)ccc21 2177014925 NHAHCJQLVSUTEZ-LDXOSZSPSA-N 272.392 2.243 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CCC12CC(CF)C2 2182219323 JSGWIIGBUVTRJX-UHFFFAOYSA-N 280.299 2.416 10 10 CECE C[C@@H](N[C@H]1C[C@@H](n2ccnc2)C1)c1cc(O)ccc1O 2184164214 DCWCDBOCUBNOGO-UTUOFQBUSA-N 273.336 2.349 10 10 CECE CC1(C)CCCN(c2ccc3c(c2)OCCO3)[C@@H]1CN 2184377448 CXKSNEOOCJVOLM-OAHLLOKOSA-N 276.380 2.412 10 10 CECE CC1=CCN(c2ccc(C=CC(=O)O)c([N+](=O)[O-])c2)C1 2197728321 PWOJGYUSYCHYDA-UHFFFAOYSA-N 274.276 2.459 10 10 CECE O[C@H]1CCCc2cc(N3CC[C@@H]3c3ncon3)ccc21 2184688930 JKMFSOFRLVHZCT-KGLIPLIRSA-N 271.320 2.391 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](C)C[C@H](CO)C3)ccc21 2184727661 WYWPUVPOZTXQOZ-GDZNZVCISA-N 274.408 2.348 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](C)[C@](C)(CO)C3)ccc21 2184711783 WLACTFCMAKBMNN-JLZZUVOBSA-N 274.408 2.348 10 10 CECE CN[C@@H]1CCc2cc(N(C)Cc3ncccn3)ccc21 2184723496 NKOASODNBLSFFQ-OAHLLOKOSA-N 268.364 2.320 10 10 CECE CN[C@@H]1CCc2cc(N3[C@H]4CC[C@H]3CC(O)C4)ccc21 2184711572 TZGRQRNVDRZFSU-GRDNDAEWSA-N 272.392 2.385 10 10 CECE CN(C[C@H]1C[C@]12CCOC2)c1ccc2c(c1)CC[C@@H]2N 2184735799 LBBIIVCDODGUHX-COXVUDFISA-N 272.392 2.495 10 10 CECE Oc1cccc(CNCC2CC(n3ccnc3)C2)c1O 2184867581 SAWBGPFZLPAQKS-UHFFFAOYSA-N 273.336 2.035 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)C(F)(F)[C@H]2CCOC2)CC1 2185230591 MEHPGFGPTDEACA-VHSXEESVSA-N 288.298 2.350 10 10 CECE CN1CCCc2cc([C@@]3(O)CCCNC34CC4)ccc21 2190737590 XNRCOFOZIKEYFC-KRWDZBQOSA-N 272.392 2.173 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)Cc2nccn2C)c(F)c1 2194515452 RZMYNBWQEIESIV-SECBINFHSA-N 281.306 2.388 10 10 CECE CN(c1ccc(N)cc1)[C@H]1CCCC(F)(F)[C@H]1O 2042038723 MVGWQRGPBOFVBH-RYUDHWBXSA-N 256.296 2.254 10 10 CECE Cc1nc(CNCc2c(O)cccc2F)c(C)o1 2042599032 IBLBEQNLVNOBOS-UHFFFAOYSA-N 250.273 2.426 10 10 CECE COc1ccc(N2CCCC[C@@H](N)C2)c(OC)c1 2044305099 OFQXVAVDSXYQGZ-LLVKDONJSA-N 250.342 2.021 10 10 CECE CCO[C@@H]1C=CCN(c2ccc(CN)c(F)c2)C1 2046464243 HWVYYTBZVGLZIP-CYBMUJFWSA-N 250.317 2.066 10 10 CECE CNCc1ccc(N(C)C[C@@H](O)C(C)C)c(C)c1 2048672076 ZDYVPGBWNNJSDL-OAHLLOKOSA-N 250.386 2.168 10 10 CECE CC(C)(Cn1ccc2cc(N)ccc21)S(C)(=O)=O 2048926030 XQOHMKLDMNPFQK-UHFFFAOYSA-N 266.366 2.047 10 10 CECE CO[C@]1(CN(C)c2ccc([C@@H](C)O)cc2F)CCOC1 2186194757 IZSZDKVCQVCTFM-ABAIWWIYSA-N 283.343 2.121 10 10 CECE C[C@@H](CNC(=O)c1ccc(O)c(O)c1)C(C)(F)F 2051842718 KKWHZUGLDYNWGE-ZETCQYMHSA-N 259.252 2.119 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H]2CCOC[C@@H]2F)cc1O 2186747819 ILNQDJADLODBJZ-DDTOSNHZSA-N 282.359 2.236 10 10 CECE CCOCCOC(=O)OCCc1ccc(N)cc1 2056302185 ZEWDSPGETXFMOF-UHFFFAOYSA-N 253.298 2.001 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]2[C@@H](C)O)c(F)c1 2061817640 KOQMOXHIGOTDKC-GIPNMCIBSA-N 252.333 2.066 10 10 CECE CC[C@H](O)c1ccc(N2CC(c3ccn(C)n3)C2)cc1 2195367952 ZIZSXILYFOLHDP-INIZCTEOSA-N 271.364 2.467 10 10 CECE CN(c1ccc(CO)cc1Cl)[C@H]1CO[C@H]2C[C@@H]1C2 2063075812 YZLRINSJXZJABW-WDMOLILDSA-N 267.756 2.446 10 10 CECE C[C@H]1CCCN[C@@H]1CC(=O)N(C)Cc1ccccc1O 2192569649 IGAUCFXZGQDGBA-GXTWGEPZSA-N 276.380 2.129 10 10 CECE COc1ccc(N(C)[C@H](CN)[C@@H]2CCCS2)cc1 2071425283 XZYQKDQGIVFLOH-KGLIPLIRSA-N 266.410 2.354 10 10 CECE CCCOc1cc(N(C)C[C@@H](N)CC)ccc1N 2071576373 NSJRBFDOFZCETJ-NSHDSACASA-N 251.374 2.231 10 10 CECE CN1C[C@H](N(C)c2ccc(CN)c(Cl)c2)CCCC1=O 2188488462 XONRHLUJHCTANX-CYBMUJFWSA-N 295.814 2.246 10 10 CECE Oc1ccc(CNC[C@H]2C[C@@H]2C2CCOCC2)cc1O 2200078162 ZKBSVVCLDKKOFU-ZIAGYGMSSA-N 277.364 2.250 10 10 CECE Cc1ccc(O)c([C@@H](C)N(CC2CC2)C2CNC2)c1 2103943665 GOQJLBJIFPHCDM-GFCCVEGCSA-N 260.381 2.445 10 10 CECE COc1cccc(O)c1CNCC[C@H]1OCC[C@H]1C 2104434103 QHBOLGQVAKIAHZ-BXUZGUMPSA-N 265.353 2.306 10 10 CECE COc1cccc(O)c1CN1CCOC(C)(C)[C@@H]1C 2104442547 NAUBCKOPBIQJAB-NSHDSACASA-N 265.353 2.400 10 10 CECE CCN[C@](CSc1nccs1)(CC(C)C)C(N)=O 2086598109 AVHGFPDJTGAPST-LBPRGKRZSA-N 287.454 2.115 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@H](OC)C1CC1 2106799694 ZPACSIKCZQGTRB-HOTGVXAUSA-N 260.381 2.364 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)c1cnco1 2106827775 GTLJXYRNIMSWBM-HNNXBMFYSA-N 257.337 2.366 10 10 CECE C[C@@H]1COCC[C@H]1[C@@H](O)c1ccc2c(c1)CCN2C 2106800117 DTDWUBJASZKQQA-XFJVYGCCSA-N 261.365 2.385 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3NCC[C@@H]3C)ccc21 2106804530 CGCDNXDJPWNCJQ-XZJROXQQSA-N 260.381 2.100 10 10 CECE C[C@@H]1C[C@]2([C@H](NN)c3ccc4c(c3)CCN4C)C[C@@H]12 2106864725 XMLYTKHWLSGONZ-SUZRMVIJSA-N 257.381 2.229 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@@H]2C=C[C@H](N)C2)cc1 2106820731 NNSSFWNGEPDLEN-YCPHGPKFSA-N 260.381 2.470 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N1C[C@H]2C(N)[C@@H]2C1 2107819834 HUXJPQWQUWVGOK-KKOKHZNYSA-N 258.365 2.138 10 10 CECE CCCO[C@H]1C=CCN(CCc2ccc(N)cc2)C1 2108772096 DAXGCTCLAAZIBG-INIZCTEOSA-N 260.381 2.478 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2CCCOCC2)cc1O 2089226190 SJHDOMTZQMOIEH-RYUDHWBXSA-N 265.353 2.451 10 10 CECE C[C@H]1N(c2ccc3c(c2)NC(=O)[C@H]3N)CCC1(C)C 2090513566 ZSZZKKMMKNULJL-RNCFNFMXSA-N 259.353 2.263 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@H](O)C1CCCC1 2111352129 XIEWRGOKFIWKOO-INIZCTEOSA-N 263.381 2.475 10 10 CECE C[C@@H](O)c1ccc(N2CCC3(CC2)C[C@@H]3CO)cc1 2092483408 DJBJIZIOWPKUDZ-TZMCWYRMSA-N 261.365 2.339 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CC=CCC23CNC3)c1 2093506516 WTDBJXLOWZMLSY-CYBMUJFWSA-N 258.365 2.366 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](O)C(F)(F)CC2)cc1 2093611612 VILKZBGZKVUQFM-GWCFXTLKSA-N 270.323 2.303 10 10 CECE CC[C@@]1(O)CCN(c2ccc([C@@H](C)NC)c(O)c2)C1 2094381227 XUFHEKWNQBUKGS-IAQYHMDHSA-N 264.369 2.024 10 10 CECE NCc1ccc(N2CC3(CCC3)C[C@@H]2CO)cc1F 2095172825 IRNAJHOTKGIZRO-CYBMUJFWSA-N 264.344 2.026 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2ccnnc2)c1 2095523972 GQODYZWNMQZJDI-SNVBAGLBSA-N 259.309 2.042 10 10 CECE C[C@@]1(CO)CCN1c1ccc(CO)cc1C(F)(F)F 2097248354 YMNNSKPOGCUKJX-LBPRGKRZSA-N 275.270 2.159 10 10 CECE CCCSC1CN(C(=O)COc2ccc(N)cc2)C1 2097637185 COZHEBIMIJQZLD-UHFFFAOYSA-N 280.393 2.002 10 10 CECE Cc1cc(CO)ccc1N(C[C@H]1CCOC1)C1CC1 2113724015 SRTZWVQREIBHKX-CQSZACIVSA-N 261.365 2.493 10 10 CECE CN(C[C@]12CO[C@](CF)(C1)C2)c1ccc(CN)cc1F 2202871668 UMJLNUWDGWUEIA-GASCZTMLSA-N 282.334 2.239 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@@H]1NS(=O)(=O)c1ccsc1 2213591509 GZBLTMHDJDVLCH-IUCAKERBSA-N 272.355 2.258 10 10 CECE COC[C@]12CN(c3ccc(CN)c(OC)c3)C[C@]1(C)C2 2204544093 WRVILIRZOCTUBY-HOTGVXAUSA-N 276.380 2.017 10 10 CECE CNCc1ccc(N(C)[C@@H]2C[C@@H](C)O[C@H]2C)cc1OC 2204554036 KGSZBXXOJHSRGY-TYNCELHUSA-N 278.396 2.417 10 10 CECE COc1ccc(N2CC[C@@H]3C[C@@]3(O)C2)cc1Cl 2214335466 VFKAJVYRWFMBKY-NOZJJQNGSA-N 253.729 2.310 10 10 CECE Cc1ccc(CN[C@H]2CCCC[C@H]2S(C)(=O)=O)c(O)c1 2204635973 VPGVQGSYXOOOPX-DZGCQCFKSA-N 297.420 2.146 10 10 CECE C[C@@H]1C[C@]1(F)CN(C)c1cc2c(cc1Cl)[C@H](N)C(=O)N2 2206339836 AQQKPCKZYVKMTM-UEXBWHTRSA-N 297.761 2.476 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](O)C[C@@H](F)C2)c(Cl)c1 2219158714 JABPXVHYLNLYFN-IEBDPFPHSA-N 273.735 2.302 10 10 CECE CCCN(CCO)c1ccc2c(c1)OCCCO2 2219647444 NWCHFSQGAGKZEM-UHFFFAOYSA-N 251.326 2.057 10 10 CECE COc1ccc(N2CC(C(C)(C)O)C2)c(F)c1F 2219762498 PQXIAUHJFFJOIT-UHFFFAOYSA-N 257.280 2.181 10 10 CECE C[C@H](NCc1ncccc1O)c1ccc(O)cc1O 2230925940 QDYJKPGIEANUBK-VIFPVBQESA-N 260.293 2.049 10 10 CECE CCN(CC1CN(C)C1)c1ccc([C@H](C)N)cc1C 2232098401 NQGDCGGYBAWXTQ-ZDUSSCGKSA-N 261.413 2.403 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)C[C@@H](O)C(C)C 2223985371 RWCWYAVEGKRXKQ-IUODEOHRSA-N 250.386 2.468 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)Cc1cccc(O)c1 2225797875 HHQVRLZCZYSSKW-NEPJUHHUSA-N 260.297 2.282 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2CC[C@@H]2OC)cc1 2236165798 QNUSBRIGVLANTM-PMPSAXMXSA-N 277.412 2.462 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@H](C2)C3O)c(F)c1 2226772933 ACNVDVYOTKJQGL-YWXMQNBFSA-N 265.328 2.432 10 10 CECE COc1ccc(N2CCC[C@@H]2CCCO)c(OC)c1 2226810952 LIYBDSVELNFXLR-GFCCVEGCSA-N 265.353 2.445 10 10 CECE COCC1CCN(c2ccc(OC)cc2CN)CC1 2227673454 OURRSLHRSNGLCO-UHFFFAOYSA-N 264.369 2.017 10 10 CECE COC[C@@H](C)N(C)c1ccc(OC)cc1C[C@H](C)N 2227679923 PMZLXHDSOIIMCO-NWDGAFQWSA-N 266.385 2.056 10 10 CECE COc1ccc(N(C)CCn2cccc2)c(C=O)c1 2227708636 KQIQQRLDDRLOIC-UHFFFAOYSA-N 258.321 2.446 10 10 CECE C[C@@H](NCC12COCC(C1)C2)c1c(O)cccc1O 2228114933 GPVBOPOMGBKKGC-RWWNRMGGSA-N 263.337 2.175 10 10 CECE CN1CCc2cc(CNC[C@H](F)[C@@H]3CCOC3)ccc21 2238312969 XLEIWQGMEYKZGB-CABCVRRESA-N 278.371 2.143 10 10 CECE C[C@@H](CO)CC1CN(c2c(F)cc([C@@H](C)N)cc2F)C1 2238726729 MDRPFTACSORKHO-NXEZZACHSA-N 284.350 2.439 10 10 CECE CN1CCCc2cc([C@H](O)[C@@]3(C)C=CCN3)ccc21 2228772732 VZLXYBNXPVJUBN-JKSUJKDBSA-N 258.365 2.021 10 10 CECE CC1=CC[C@H](NC(=O)c2cc(O)c(O)c(O)c2)CC1 2229084485 XYDDFPFMHZLZSL-JTQLQIEISA-N 263.293 2.032 10 10 CECE CC[C@H](C)NCc1ccc(N2CC[C@H](O)[C@@H](F)C2)cc1 2240077294 WJTZWAYVJGJXNV-RCBQFDQVSA-N 280.387 2.484 10 10 CECE Nc1ccc(O)c(CN2[C@H](CO)C[C@@H]3CCCC[C@@H]32)c1 2240673503 UNYALIGMLMSXSY-CQDKDKBSSA-N 276.380 2.100 10 10 CECE CN[C@@H](C)c1ccc(N2CCC3(CN(C)C3)C2)c(C)c1 2240831099 VNEDFGPDHCQQEB-AWEZNQCLSA-N 273.424 2.417 10 10 CECE Cc1cc(N2CC(c3cnn(C)c3)C2)ccc1[C@H](C)O 2285172762 LAWPQDWLJUIMJD-LBPRGKRZSA-N 271.364 2.386 10 10 CECE CO[C@@H](C[S@@](=O)CCc1ccc(N)cc1)C(C)C 2256653226 CPKIPGKFXHLVAE-KSSFIOAISA-N 269.410 2.231 10 10 CECE CSc1ncc(CNC[C@H]2CC[C@H](C(=O)O)C2)s1 2256971100 YJAFHGUOHAINTP-IUCAKERBSA-N 286.422 2.456 10 10 CECE CCOc1cccc(CN[C@H]2C[C@H]3CO[C@H]2C3)c1O 2270762849 RMUPXKQRCXUICA-OSMZGAPFSA-N 263.337 2.058 10 10 CECE C[C@@H]1CCN[C@H]1CSCC(=O)c1ccc(O)c(O)c1 2273086877 RFHRTNHWXJXVKU-KOLCDFICSA-N 281.377 2.012 10 10 CECE COc1cc(Cl)cc(CN[C@]23COC[C@H](C2)C3)c1O 2273170410 NRSQPMZQKVALPF-KMHCFJFGSA-N 283.755 2.323 10 10 CECE CN(CC1CCNCC1)c1ccc(OCF)cc1 2263921225 OTEMIQDKDDZGQO-UHFFFAOYSA-N 252.333 2.428 10 10 CECE C[C@H](N[C@@H]1CC[C@H]2C[C@H]1CO2)c1ccc(O)cc1O 2265668033 DKPZBPREACNWHY-JYYRZZBQSA-N 263.337 2.316 10 10 CECE COc1ccc(N2CCN[C@@H](C)[C@@H]2C)c(OC)c1C 2278035269 VEBCSINOZJXGSF-RYUDHWBXSA-N 264.369 2.199 10 10 CECE Cc1cc(N2CC[C@@H](C)[C@H](CO)C2)ccc1[C@@H](C)N 2269651120 HMZAJVNMKGTYBI-BNOWGMLFSA-N 262.397 2.469 10 10 CECE Cc1cc(N2CC[C@H](O)C3(CC3)C2)ccc1[C@H](C)N 2269652711 YKSXWIRIILASHR-WFASDCNBSA-N 260.381 2.366 10 10 CECE Cc1cc(N2CCN3CCC[C@@H]3C2)ccc1[C@@H](C)O 2269696221 QWHWGWZTDOKNLH-UKRRQHHQSA-N 260.381 2.333 10 10 CECE Cc1cc(N2CC[C@@]3(O)C[C@H]3C2)ccc1CNC(C)C 2280020761 LUTCJWVAUKKPAS-DOTOQJQBSA-N 274.408 2.454 10 10 CECE CN1CCc2cc([C@H](N)c3cncn3C(F)F)ccc21 2284801289 FMEXBHUZLOWUGF-ZDUSSCGKSA-N 278.306 2.319 10 10 CECE CN[C@@H](C)c1ccc(N(CCOC)C2COC2)cc1C 2285135064 SLOJZFHBMCDQLL-ZDUSSCGKSA-N 278.396 2.127 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H]2CC(N)=O)c(Cl)c1 2285582714 VNGFRSQYYUBWRG-PWSUYJOCSA-N 295.814 2.465 10 10 CECE C[C@]1(CO)COCCN(c2ccc(OC(F)F)cc2)C1 2295989573 SBGCXHGMHJQBCO-AWEZNQCLSA-N 287.306 2.123 10 10 CECE C[C@@H](O)c1ccc(N(C)CC[C@H]2CCO2)c([N+](=O)[O-])c1 2296009340 UWCLTPFIGSFUSW-PWSUYJOCSA-N 280.324 2.263 10 10 CECE COCCN(C[C@@H](C)O)c1ccc(OC(F)(F)F)cc1 2287952863 QHSLBMZNBANMIZ-SNVBAGLBSA-N 293.285 2.419 10 10 CECE COCC1(C)CC(N(C)c2ccc(OC)cc2CO)C1 2289712793 NVUVPKRRWRKVIZ-UHFFFAOYSA-N 279.380 2.439 10 10 CECE O=C(C=Cc1cccc(O)c1)NCc1ccc(O)c(O)c1 2310548244 QZPXKNXNBZBSNP-UHFFFAOYSA-N 285.299 2.133 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C1C[C@@H]2CC[C@H](C1)O2 2315986744 HWQIQNYPNGTPLM-FGWVZKOKSA-N 252.318 2.103 10 10 CECE COc1cc(Cl)c(N(C)C[C@H]2CCN2)c(OC)c1 2319643114 MJTJPRQZBWJPFI-SECBINFHSA-N 270.760 2.155 10 10 CECE CN(c1ccc(OC(F)F)cc1)[C@H]1CNC[C@H]1F 2320538449 AMSUWEAGURZJNK-MNOVXSKESA-N 260.259 2.034 10 10 CECE C[C@@H](NC[C@H]1C[C@@H]2C[C@@H]2CO1)c1c(O)cccc1O 2331052902 KIQDACFFMBGJHL-WRWGMCAJSA-N 263.337 2.173 10 10 CECE C[C@@H](NC[C@@H]1CCC[C@H](O)C1)c1ccc(O)cc1O 2331469763 XLKSVJJNAHNXSW-UTUOFQBUSA-N 265.353 2.300 10 10 CECE CCc1nnsc1CNCc1ccc2c(c1)CCO2 2336013530 SKYQOYFTWSXMLK-UHFFFAOYSA-N 275.377 2.325 10 10 CECE Cc1cnnc([C@@H](N)c2ccc(N(C)C)cc2)c1C 2336854409 MJDATNHCDPZFHN-AWEZNQCLSA-N 256.353 2.208 10 10 CECE CN(C(=O)[C@H]1COC2(C)CC1C2)c1ccc(N)cc1 2337680077 NUIGAKSCCQXDMQ-IQYSWEBNSA-N 260.337 2.047 10 10 CECE C[C@H](N[C@@H]1CO[C@]2(C)C[C@H]1C2)c1cc(O)ccc1O 2337752416 BXHQYUCEXWBEMR-UOJCWERNSA-N 263.337 2.316 10 10 CECE Cc1c([C@@H](C)O)ccc(N2CC[C@]3(O)C[C@@H]3C2)c1C 2340851238 PQULZJIGDHTMNZ-IOASZLSFSA-N 261.365 2.318 10 10 CECE Cc1c([C@@H](C)O)ccc(N(C)Cc2ncon2)c1C 2340856371 PMOULVCXDCVPCV-LLVKDONJSA-N 261.325 2.376 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC3(CN(C)C3)C2)c1C 2340857870 YPNVUIKXBXLBLM-ZDUSSCGKSA-N 260.381 2.109 10 10 CECE CO[C@@H]1COCCN(c2ccc([C@@H](C)O)cc2Cl)C1 2351646207 BJNVTDJKEUSVEU-PWSUYJOCSA-N 285.771 2.245 10 10 CECE CN(C)c1ccc2c(c1)CCN2CCc1ncc[nH]1 2353447142 SLYGINUBYSEODF-UHFFFAOYSA-N 256.353 2.081 10 10 CECE CSc1cc(N2C[C@@H]3C[C@H](C2)[C@@]3(C)O)ccc1CN 2353854744 YUSZCGZMXFCQKM-JJLQDPRZSA-N 278.421 2.074 10 10 CECE CN(C)c1ccc(CN2[C@@H]3CC[C@@H]2CC(N)C3)cc1 104010263 FSNIFKCQDOASOR-HZPDHXFCSA-N 259.397 2.207 10 10 CECE CN(C)C(=O)C1CCN(Cc2ccc(N(C)C)cc2)CC1 179684713 MVAMUYYXTLKMQF-UHFFFAOYSA-N 289.423 2.053 10 10 CECE CN1CCC[C@H](N(C)c2ccc(CN)cc2Cl)C1 62793158 OTORZTYQXBEILS-LBPRGKRZSA-N 267.804 2.329 10 10 CECE C[C@H](NCC(C)(C)N(C)C)c1ccc(O)cc1O 20125795 XZKKWKNDHKBRJN-JTQLQIEISA-N 252.358 2.089 10 10 CECE N[C@H](CF)c1cc(F)cc(Br)c1O 307176167 XRWCCNKCEZHXLS-SSDOTTSWSA-N 252.058 2.263 10 10 CECE Nc1ccc(CCCN[C@H]2C[C@H]3[C@H]4CC[C@@H](O4)[C@@H]23)cc1 2356929319 PQXILNFGHVIQSS-FIDHJVLJSA-N 272.392 2.357 10 10 CECE CC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(CN)cc1)C1CC1 34655529 DGHARCXOIGXAIC-OLZOCXBDSA-N 289.423 2.417 10 10 CECE CC(C)NCc1ccc(N2CCC(C(N)=O)CC2)c(F)c1 34823728 JWCPCVOSBGETDP-UHFFFAOYSA-N 293.386 2.025 10 10 CECE COc1cc(O)c(CN2[C@@H](C)COC[C@H]2C)cc1OC 180397253 QMLHSJPFFCVNMB-PHIMTYICSA-N 281.352 2.019 10 10 CECE [N-]=[N+]=NCCCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 42013020 DHXIOBLDXUYXJE-QPJJXVBHSA-N 275.268 2.425 10 10 CECE Nc1ccc(CCC(=O)N(C[C@H]2CCOC2)C2CC2)cc1 40332811 FFJTZXHTJLCWOB-CQSZACIVSA-N 288.391 2.229 10 10 CECE CCC[C@H](N[C@@H](C)c1ccc(F)cc1O)C(=O)O 86734096 OUHAHBHOVXHUFL-KWQFWETISA-N 255.289 2.435 10 10 CECE COc1ccc([C@@H](C)N(C)CC(=O)NCC(C)C)c(O)c1 228302471 OSALLVKXQULBKL-GFCCVEGCSA-N 294.395 2.166 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N1CCO[C@@H](C(=O)O)C1 226452392 RYTJVPMXYQZVFP-NQBHXWOUSA-N 291.347 2.034 10 10 CECE CCC[C@H]1C[C@@](NCCCN=[N+]=[N-])(C(=O)O)CCO1 90258693 JICIYWKGZLEKBX-CMPLNLGQSA-N 270.333 2.079 10 10 CECE CONCc1c(C)cc(Br)c(C)c1O 96885210 ZYIPKADMXUEYMP-UHFFFAOYSA-N 260.131 2.423 10 10 CECE CC[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2O)C[C@@H](C)O1 247516817 KHJZGRLCJMLYNV-ZWNOBZJWSA-N 280.324 2.300 10 10 CECE CC(=O)N(C(=O)COc1ccccc1)c1ccc(N)cc1 242781599 DXEKZJNKOYAONN-UHFFFAOYSA-N 284.315 2.227 10 10 CECE C[C@@H](c1ccccc1O)N1CCSC[C@H]1CC(=O)O 251557390 RQNKUTIHZQZNFS-WDEREUQCSA-N 281.377 2.345 10 10 CECE N[C@H](Cn1ccnc1Br)c1ccccc1O 259410295 OAMJIJXZSBOVEL-SECBINFHSA-N 282.141 2.051 10 10 CECE CC[C@H](N[C@@H]1CC(=O)N([C@@H]2C[C@H]2C)C1)c1ccccc1O 364354475 OXZZLEKXNAPWTO-RJZRQDKASA-N 288.391 2.442 10 10 CECE CCNCc1ccc(N2CCN3CCC[C@@H]3C2)cc1C 94462779 JUTQDITZLOCXRA-QGZVFWFLSA-N 273.424 2.389 10 10 CECE CCCS[C@@H]1CCN(C(=O)c2cccc(O)c2O)C1 382912405 XOOQNVXHXFDKIA-SNVBAGLBSA-N 281.377 2.456 10 10 CECE CCc1nnc(C[C@@H](N)c2ccc(N(C)C)cc2)s1 702726003 FWGHHRDCNLWNJR-GFCCVEGCSA-N 276.409 2.409 10 10 CECE N[C@H]1C[C@@H]2CC[C@H](C1)N2c1ccc2c(c1)OCCCO2 2162656727 DQJRKTRJXHEIHG-XYYAHUGASA-N 274.364 2.306 10 10 CECE CN1CCc2cc([C@@]3(N)C[C@@H]4CC[C@H](C3)N4C)ccc21 2163071315 NONHHXJCKAEPAZ-QLPKVWCKSA-N 271.408 2.090 10 10 CECE C[C@](O)(c1ccc(N2CCCC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 2163108929 ZPTSIZSZHFELEF-ZFVVBOAOSA-N 272.392 2.102 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@]1(O)CC[C@H]2C[C@@H]21 2163229956 PIGQKDMRXGVXAR-LLLHUVSDSA-N 272.392 2.448 10 10 CECE Nc1ccc(CS(=O)(=O)N2CC=CCC23CCC3)cc1 2169184893 FQTOTWJIPFZCPR-UHFFFAOYSA-N 292.404 2.283 10 10 CECE CO[C@H]1C[C@H](N(C)c2ccc(CN)c(C)c2)C[C@H]1OC 2166100864 BGFYUGQNOQDYPH-PHZGNYQRSA-N 278.396 2.082 10 10 CECE COCCNCc1ccc(N2CC3CC(C3)C2)c(F)c1 2163727689 NHHCRRYDFBVXTE-UHFFFAOYSA-N 278.371 2.408 10 10 CECE CN(C)c1ccc([C@@H](O)C(=O)c2ncc(Cl)n2C)cc1 2166191269 RHTPGWRHVIGGJZ-GFCCVEGCSA-N 293.754 2.056 10 10 CECE CN1CCc2cc(N3CCC4(CC(O)C4)C3)ccc21 2226799342 NESIZDSTLRJAIQ-UHFFFAOYSA-N 258.365 2.030 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3C[C@H](N)[C@@H]4C[C@@H]43)ccc21 2166247092 WXFPVKMQOSBWOI-CLBVLKOUSA-N 272.392 2.086 10 10 CECE CCOc1ccc(CN2CCO[C@H](C(F)F)C2)c(O)c1 802652949 HWAXZMSQQZWBMF-ZDUSSCGKSA-N 287.306 2.257 10 10 CECE CCc1nnc([C@H](NC)c2ccc3c(c2)CCN3C)s1 2164126327 FLBVVJOFMKPEIV-CQSZACIVSA-N 288.420 2.402 10 10 CECE CCNCc1ccc(N2C[C@H]3COC[C@@H]3C2)c(C)c1 718236174 SGHBOCSBNPUGEY-GJZGRUSLSA-N 260.381 2.187 10 10 CECE CC[C@H](NC1COCCOC1)c1ccc(C)cc1O 813880801 PXNNIIQSIFGKOT-AWEZNQCLSA-N 265.353 2.157 10 10 CECE COc1cccc(CN2CCCC[C@@H]2CCCN)c1O 710473147 BSCLKKDIWCSWNL-CQSZACIVSA-N 278.396 2.494 10 10 CECE O=C1N[C@@H](c2ccc(O)c(O)c2)[C@@H](C2CCCC2)O1 575282236 GPZUUTOSNSMQJJ-QWHCGFSZSA-N 263.293 2.438 10 10 CECE COC(=O)[C@@H]1[C@@H](CN2CCc3cc(OC)ccc32)C1(F)F 813334603 RFVAIOFUWPAXIT-YPMHNXCESA-N 297.301 2.112 10 10 CECE CO[C@@]12CCC[C@@]1(CNCc1ccccc1O)CCO2 723179606 IFGXDWXYJYEWOH-JKSUJKDBSA-N 277.364 2.415 10 10 CECE CNCc1ccc(N2CCN3CCC2CC3)c(Cl)c1 722771659 UHNARGXXJKBHJZ-UHFFFAOYSA-N 279.815 2.344 10 10 CECE O=Cc1ccc(O)c(CN(CCO)Cc2ccccc2)c1 821295912 WVGRCBNYXAAVDP-UHFFFAOYSA-N 285.343 2.199 10 10 CECE CC[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)CCO1 823752443 FPDVCDSRYAKRGE-YPMHNXCESA-N 280.324 2.348 10 10 CECE CC[C@H](N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21)C(=O)NC 834912411 LXKUVTIJLJMFHF-INTQDDNPSA-N 280.343 2.194 10 10 CECE CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@H]1N 903984505 DUTJVONJMFKFGP-LLVKDONJSA-N 299.758 2.123 10 10 CECE CN(C[C@@H]1CCC(C)(C)O1)C(=O)c1ccc(O)c(O)c1 691894839 UWORKPYGTTYXTH-NSHDSACASA-N 279.336 2.127 10 10 CECE CN(C)c1ccc(/C=C\CNC[C@@H](O)C(F)(F)F)cc1 835036485 QJHOJVNPQJCEDI-DHCBQETCSA-N 288.313 2.279 10 10 CECE CCc1cccc(CN2CCCC[C@H]2CC(N)=O)c1O 848883113 JOYRCIPJVWKDEJ-AWEZNQCLSA-N 276.380 2.185 10 10 CECE Cc1cccc(CN2CCO[C@@]3(CCSC3)C2)c1O 843418676 WLQDBLVYZOJBCN-HNNXBMFYSA-N 279.405 2.409 10 10 CECE CC[C@H](C)C[C@@H](NCc1cc(OC)ccc1O)C(=O)OC 843416474 SMXQKOFHPMVOKM-SMDDNHRTSA-N 295.379 2.468 10 10 CECE Cc1cn(C)nc1NCc1ccc(N2CCOCC2)cc1 850420694 PLDYRLWTXIRMRA-UHFFFAOYSA-N 286.379 2.177 10 10 CECE CO[C@@]1(C(=O)O)CCCN(Cc2c(O)cccc2Cl)C1 697311712 TUIKWAMTYRLUBH-AWEZNQCLSA-N 299.754 2.111 10 10 CECE CC[C@@H]1NCC[C@H]1NCc1cc(Br)ccc1O 863483859 QJZGMYPCDHKJAR-NWDGAFQWSA-N 299.212 2.385 10 10 CECE COc1ccc(N2CC[C@@H](NCc3cnc(C)o3)C2)cc1 862407790 NGXASRBAGCQCLF-CYBMUJFWSA-N 287.363 2.360 10 10 CECE COc1cc(O)c(CN[C@H]2CO[C@H](C3CC3)C2)cc1OC 862529182 HNHKMTZGACDCAR-OCCSQVGLSA-N 293.363 2.067 10 10 CECE NN[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]1CF 1875730014 TZDQFPOOWHEXTG-NWANDNLSSA-N 263.360 2.397 10 10 CECE CN(C[C@@H]1C[C@H]1CF)C(=O)CCc1ccc(N)cc1 1875736895 VMKIRZIEGZGPTG-STQMWFEESA-N 264.344 2.265 10 10 CECE C[C@@H]1CN(Cc2c(O)cccc2Cl)CC[C@H]1O 779199544 DZALXAZLAWQBBJ-BXKDBHETSA-N 255.745 2.248 10 10 CECE C[C@@H]1CO[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 896691723 MDRWVFVOMARPGN-MEDUHNTESA-N 289.375 2.312 10 10 CECE C[C@@H]1OC2(CN[C@H](C)c3cc(O)ccc3O)CC1C2 1878453421 DJEGRIPLBWSGAJ-HXBIFKHQSA-N 263.337 2.316 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3COCC[C@@H]32)cc1 1878807096 PLJWUOBKOPQSSW-ZBFHGGJFSA-N 260.381 2.410 10 10 CECE COc1cc(C)cc(CNCCO[C@H]2CC2(F)F)c1O 895256431 HBOOCCSCSNRUTA-LBPRGKRZSA-N 287.306 2.223 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@]23CCCOC3)cc1 1896325717 RDGDUKDVOPXWIG-HOTGVXAUSA-N 260.381 2.411 10 10 CECE OCC[C@@H]1CCCN(c2ccc3c(c2)OCCCO3)C1 1149233385 QFDCUSVFNAWWCT-ZDUSSCGKSA-N 277.364 2.447 10 10 CECE COc1cccc(O)c1CN[C@H](CCO)C1CCCC1 897885896 RWWXZZLKIXHUPL-CQSZACIVSA-N 279.380 2.432 10 10 CECE CCc1c(NCc2cc3c(cc2O)OCO3)cnn1C 1963191062 RTLNCGRRAPAMCH-UHFFFAOYSA-N 275.308 2.029 10 10 CECE CC(C)(N)c1nc2cc(N)ccc2n1Cc1ccc(N)cc1 76014853 ZYKMZMLKNCFVBB-UHFFFAOYSA-N 295.390 2.443 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cc(Br)co1 1963808632 CCMWKIRQTXQUIJ-UHFFFAOYSA-N 259.063 2.082 10 10 CECE CCc1cc(N2CCNCC2)ccc1OCCCF 1890650108 HDQQOJAELPBIPN-UHFFFAOYSA-N 266.360 2.397 10 10 CECE CC1(C)OC[C@H](Cn2ccnc2Cc2ccc(N)cc2)O1 82734785 KKHBGODRGMTSRW-AWEZNQCLSA-N 287.363 2.208 10 10 CECE N[C@@H](c1nnc(-c2ccoc2)o1)c1cc(F)ccc1O 83542578 SIVGQVBNVNLWQP-LLVKDONJSA-N 275.239 2.222 10 10 CECE Nc1cc(F)cc2c1CCN[C@@H]2c1ccccc1O 83628014 AILAJBQIPKFMDO-OAHLLOKOSA-N 258.296 2.349 10 10 CECE O=C(O)[C@@H]1CCCN(Cc2ccc(F)cc2O)CC1 1964727799 LUSQAXLJEWIQEV-SNVBAGLBSA-N 267.300 2.218 10 10 CECE O=[N+]([O-])c1ccc(N2CCCC3(CC3)C2)cc1CO 702633005 OVOWBCACJIKNTH-UHFFFAOYSA-N 262.309 2.468 10 10 CECE C[C@]1(O)C[C@@H](NCc2ccc(N3CCCC3)cc2)C1 1325366169 JRQYYYNZHHQOED-FZNQNYSPSA-N 260.381 2.290 10 10 CECE C[C@H]1C[C@@H](O)CCN1c1ccc(CO)cc1Cl 705186738 UQYGKTMQBLBOIF-ONGXEEELSA-N 255.745 2.182 10 10 CECE C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2c1ccc(CN)cc1F 686177749 ZCVUNVHKCVTNDD-ZTYOMDHBSA-N 264.344 2.023 10 10 CECE C[C@@H](O)c1ccc(N(C)Cc2ncnn2C)c(Cl)c1 707652587 WVWBUYDAGXFKCC-SECBINFHSA-N 280.759 2.158 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CC[C@@H]2CCC[C@@H]21 707739315 QDLIKPCSKAQYJB-NHCYSSNCSA-N 252.318 2.008 10 10 CECE CC1(C)[C@@H]2[C@@H](CCCN2Cc2ccc(N)cc2)[C@H]1O 693175099 VIDOOVRPXAMVSE-QLFBSQMISA-N 260.381 2.250 10 10 CECE CCN1CC[C@@H]1CNCc1cc(Cl)cc(OC)c1O 712568784 GIUFUAKTMFTFEQ-GFCCVEGCSA-N 284.787 2.238 10 10 CECE C[C@@H]1CCC[C@@H](CNCc2cc3c(cc2O)OCO3)O1 688879045 NXAXPCRZPZTADO-PWSUYJOCSA-N 279.336 2.168 10 10 CECE CNCc1ccc(N2C[C@@H]3[C@H](C2)C3(F)F)c(F)c1 715474872 AOFASAGJGSADAE-AOOOYVTPSA-N 256.271 2.246 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC(F)CC3)c(Cl)cc21 689410944 HJAPXQWYTJHWMV-GFCCVEGCSA-N 283.734 2.230 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@@H]1CCC[C@@H]1O 689666712 PRVDCGSDASFNKJ-BBRMVZONSA-N 278.396 2.131 10 10 CECE CC[C@@H](C[C@@H](C)O)NCc1ccc(OC)cc1O 716909823 FTRLCPUHPCBQTG-PWSUYJOCSA-N 253.342 2.040 10 10 CECE CO[C@@]1(CN[C@@H](C)c2c(O)cccc2O)CCSC1 719274756 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O=C(Cc1ccc(O)c(O)c1)NC[C@@H]1CCC[C@@H]2C[C@@H]12 1557518273 PHQMKBSASLQYSC-FRRDWIJNSA-N 275.348 2.193 10 10 CECE CC1(C)[C@@H](CNC(=O)Cc2ccc(O)c(O)c2)C1(F)F 1633756620 WUZFXTPZUNVCQF-LLVKDONJSA-N 285.290 2.048 10 10 CECE O=C(NCc1c(O)ccc2ccccc12)c1csnn1 1647789053 ZLINTKDPGJADIV-UHFFFAOYSA-N 285.328 2.327 10 10 CECE CN(CCCN=[N+]=[N-])CC(=O)N1CCCCCC1 1912189737 YEWMXUWUMSCUEN-UHFFFAOYSA-N 253.350 2.021 10 10 CECE Cc1coc(S(=O)(=O)N2CCC[C@H](N=[N+]=[N-])C2)c1 1912195858 HSUSSJHHKRBWPN-VIFPVBQESA-N 270.314 2.051 10 10 CECE CCOC(=O)[C@H](C)N1CCCC[C@H](CN=[N+]=[N-])C1 1912198071 BWAWIYCYRFBADE-WDEREUQCSA-N 254.334 2.350 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])[C@@H]1CCC2(CC2)C1 2126474413 LYGYJUDKOWCGNW-MNOVXSKESA-N 266.345 2.398 10 10 CECE O=C(N[C@@H]1C[C@H]1C1CCCC1)c1cccc(O)c1O 1966131366 NAGGXVIRMPCZIL-NWDGAFQWSA-N 261.321 2.406 10 10 CECE CC(C)CCNC(=O)[C@H](C)N(C)c1ccc(N)cc1 20422554 KIGIKSBTSLLBJF-LBPRGKRZSA-N 263.385 2.256 10 10 CECE C[C@H](O)[C@@H]1CCCCN1c1ccc2c(c1)CC[C@H]2N 2128314496 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Cc1cc(N2C[C@H]3C[C@@H](C2)N(C)C3)ccc1C[C@H](C)N 2160652010 KPLZNOMIBJRIBD-ZQIUZPCESA-N 273.424 2.025 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2[C@H]3CC[C@@H](NC3)[C@H]2C1 2160786442 RHOFSEPMCPWGNX-QCEMKRCNSA-N 272.392 2.130 10 10 CECE Cc1cccc(O)c1CN1CCC(OCCCN)CC1 2160783831 CBDZGCPATFDVCQ-UHFFFAOYSA-N 278.396 2.030 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@H](C4CC4)C3)ccc21 400154346 GJLXDSGHIQWZMO-NHYWBVRUSA-N 271.364 2.136 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)CC[C@@H]2CCOC2)C1 403607803 HCQZMECFERPYSJ-GHMZBOCLSA-N 252.318 2.104 10 10 CECE CP(C)(=O)[C@@H]1CC[C@H](NCc2ccc(O)c(O)c2O)C1 2160828874 LGPKSBIKAQPZET-WDEREUQCSA-N 299.307 2.437 10 10 CECE CCN(c1c(F)cc(CNC)cc1F)[C@@H]1CCOC1 311445907 HWYNPHCZJNIENB-LLVKDONJSA-N 270.323 2.299 10 10 CECE CC[C@@H]1C[C@H](C(=O)O)N([C@@H](C)c2ccc(O)cc2O)C1 2159271841 UCKKACUIHYEPMV-OPQQBVKSSA-N 279.336 2.344 10 10 CECE CNCc1ccc(N2CC[S@@](=O)C(C)(C)CC2)cc1 321678459 JGLSPGOBTNIIKT-LJQANCHMSA-N 280.437 2.143 10 10 CECE CO[C@H]1C[C@@H](N(C)c2ccc(CN)c(Cl)c2)C[C@H]1OC 2172564402 HSOUGECPPKOQFQ-YOWGUQMCSA-N 298.814 2.427 10 10 CECE C[C@@H](Oc1cccc(F)c1)C(=O)NCCCN=[N+]=[N-] 701331860 BXAFVUHUIBRDLW-SECBINFHSA-N 266.276 2.410 10 10 CECE c1cc2c(cc1N1CC[C@H]3CNC[C@@H]3CC1)COCC2 2162632088 PIOQLRLZFAJRAA-GJZGRUSLSA-N 272.392 2.195 10 10 CECE Cc1c(CNc2cn(C)nn2)n(C)c2ccccc12 359496569 SSHKRFXTRZPEKB-UHFFFAOYSA-N 255.325 2.227 10 10 CECE CCN1CCc2cc([C@H](O)[C@H](CN)C3CCC3)ccc21 2163080511 UTOSZRMOYVEPBA-WBVHZDCISA-N 274.408 2.477 10 10 CECE CN1CCc2cc([C@H](N)[C@@]3(O)CCCC34CC4)ccc21 2163134135 VDIZCRPSRDNBSA-RDJZCZTQSA-N 272.392 2.374 10 10 CECE Cc1cc([C@@H](NN)c2ccc3c(c2)CCN3C)c(C)o1 2163142685 HHRDFGQSNSMLDB-INIZCTEOSA-N 271.364 2.441 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCCN3C)C[C@H]1CN 2163103540 VFELSRCKFDCREY-UKRRQHHQSA-N 273.424 2.490 10 10 CECE CN1CCCc2cc([C@@]3(O)CCC[C@@H](CN)C3)ccc21 2163102621 MGJUKIZNALCCQZ-CXAGYDPISA-N 274.408 2.406 10 10 CECE CN1CCCc2cc([C@H](N)C3(O)C[C@@H]4C[C@H]4C3)ccc21 2163229109 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Nc1ccc(NC(=O)CCN2CCCC[C@@H]2CF)cc1 2171877009 JFCKHGJRSHPMKY-CQSZACIVSA-N 279.359 2.421 10 10 CECE CC[C@H](N)Cc1ccc(N2C[C@@H]3CCO[C@H]3C2)cc1C 2172102538 ABEFJUTZVPMSMG-ZOBUZTSGSA-N 274.408 2.500 10 10 CECE Nc1ccc(OCC(=O)NC[C@H]2C[C@@H]3CC[C@@H]3C2)cc1 2189001824 VLLBTZZCOJVYEL-XYYAHUGASA-N 274.364 2.200 10 10 CECE Cc1cc([C@H](NN)c2ccc3c(c2)CCN3C)oc1C 2189208625 GNYTXHDSEVEIAC-MRXNPFEDSA-N 271.364 2.441 10 10 CECE CN(C)c1ccc([C@@H](O)c2ncc3ncsc3n2)cc1 2189216060 CSVUHFTWHFGRDW-GFCCVEGCSA-N 286.360 2.234 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](OC)C[C@H]2CF)cc1O 2190232601 NOPHAHFLVGJJAI-WXHSDQCUSA-N 282.359 2.236 10 10 CECE Nc1ccc(NC(=O)N2CC[C@@H](CO)C23CCC3)cc1 2190355685 VESCFQIOUWFQFE-NSHDSACASA-N 275.352 2.038 10 10 CECE CC1(C)CN(c2ccc3c(c2)CC[C@@H]3N)[C@@H]2COC[C@H]21 2184744021 QLDPSKIBMSPNJZ-OWCLPIDISA-N 272.392 2.494 10 10 CECE CN(C[C@@H]1C[C@]12CCOC2)c1ccc2c(c1)CC[C@@H]2N 2184735800 LBBIIVCDODGUHX-JQFCIGGWSA-N 272.392 2.495 10 10 CECE CN1CC[C@]2(CCN(c3ccc4c(c3)CC[C@@H]4N)C2)C1 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CCN(CC1CN(C)C1)c1ccc([C@@H](C)O)cc1C 2232097707 FHVREAAKHNAUSW-CYBMUJFWSA-N 262.397 2.436 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CCC2(CC2)N1 2233207105 SKBCXPMVBOUTPO-WCQYABFASA-N 274.364 2.196 10 10 CECE OCCO[C@@H]1CCN(c2ccc(OC(F)(F)F)cc2)C1 2234893428 HMAIJRPNRVJFFM-GFCCVEGCSA-N 291.269 2.173 10 10 CECE CN1CCCc2cc(N(CCO)CC(F)(F)F)ccc21 2235044638 ZZBKHOVGRWLZCU-UHFFFAOYSA-N 288.313 2.430 10 10 CECE C[C@H]1CN(c2ccc(OC3CC3)cc2)C[C@@H](CCO)O1 2235107171 BSSBOLFPOFNQGH-BLLLJJGKSA-N 277.364 2.204 10 10 CECE OC[C@@]1(F)CCCN(c2ccc3c(c2)OCCCO3)C1 2235126520 IFMJWKJEWZXQFS-OAHLLOKOSA-N 281.327 2.149 10 10 CECE COc1ccc(N2CC[C@]3(CCC[C@H]3O)C2)c(OC)c1 2235130931 FCEWPSOFBJDPDX-HZPDHXFCSA-N 277.364 2.445 10 10 CECE COc1ccc(N(C)C[C@]2(O)CCOC2)cc1C(C)C 2235142691 HCYWOEJRWRFSPV-MRXNPFEDSA-N 279.380 2.406 10 10 CECE COc1ccc(N2CCOC[C@@H]2CC(C)C)c(CN)c1 2235960003 SSWJXZJNXWAEOV-AWEZNQCLSA-N 278.396 2.405 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2O)[C@@H](CO)CC1CC1 2226160062 LGWOCQAHZNMRSN-ZBFHGGJFSA-N 261.365 2.263 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H](CO)CC2CC2)cc1O 2226152672 PKCVMBVKFBDVKB-GWCFXTLKSA-N 265.353 2.043 10 10 CECE O=C(C[S@](=O)CCCC1CC1)c1ccc(O)c(O)c1 2227189298 PBZSKSOQIULVFM-LJQANCHMSA-N 282.361 2.219 10 10 CECE CN(C)c1ccc(O[C@]2(C(=O)O)[C@@H]3C[C@H]3[C@H]3C[C@H]32)cc1 2237691724 MLOHUUQILHRWHV-SGPHBRAGSA-N 273.332 2.241 10 10 CECE CN[C@H]1[C@H](Oc2ccc(N(C)C)cc2)COCC1(C)C 2237683967 CPPBONHCXBEULB-CABCVRRESA-N 278.396 2.144 10 10 CECE C[C@@H]1C[C@](Oc2ccc(N(C)C)cc2)(C(=O)O)CCO1 2237704889 PKMJOQYWBSSBEO-ABAIWWIYSA-N 279.336 2.154 10 10 CECE CNCc1ccc(N2C[C@@H]3CC[C@]3(OC)C2)cc1OC 2239094467 WEFLCAXIJXELGE-BBRMVZONSA-N 276.380 2.030 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@]1(F)CCOC1 2229970786 AEZPIHIILAIQLQ-OAHLLOKOSA-N 264.344 2.027 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCS(=O)(=O)[C@@H](C)[C@@H]1C 2240745000 PVLGNHKQXZZGCC-AGIUHOORSA-N 296.436 2.027 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1Cc2ncnc(O)c2C1 2240842990 ZCQZXILRAAJCAE-SNVBAGLBSA-N 271.320 2.064 10 10 CECE 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269.344 2.446 10 10 CECE CN[C@H](Cn1cccn1)c1ccc(N2CCCC2)cc1 2163095117 AWNKRVKVHHAQRD-MRXNPFEDSA-N 270.380 2.444 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@H]1CCCN1C 2163105524 FHZVCGZBRGEWIB-DLBZAZTESA-N 273.424 2.424 10 10 CECE COCc1ccc([C@H](N)c2ccc3c(c2)CCN3C)o1 2163137707 FUJNYHUCTGTDIT-MRXNPFEDSA-N 272.348 2.466 10 10 CECE CC/C(=C\C(=O)OCC(=O)C(C)=O)c1ccc(C)cc1 808519645 FAJOIMOAXIRNOB-UKTHLTGXSA-N 274.316 2.490 10 10 CECE C[C@H](NCc1nccc(O)n1)c1ccc(N(C)C)cc1 2163207982 OMHRGHMBQGFGKQ-NSHDSACASA-N 272.352 2.099 10 10 CECE COc1nscc1C[C@H](O)CCc1ccc(N)cc1 711977470 OGOOIBMFKRGAAQ-CYBMUJFWSA-N 278.377 2.270 10 10 CECE C[C@@H](c1ccc(N2CCCC2)cc1)N1CCNCC1 575266522 FNNHBSPFEKZWOA-AWEZNQCLSA-N 259.397 2.253 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H]2CCCCNC2)c1 817984127 NQIRRRJKZGPKPT-NWDGAFQWSA-N 264.369 2.194 10 10 CECE CCOCc1cc(CN[C@@H]2CCOC2)ccc1OC 818236223 MECXZLFOCYDQSV-CQSZACIVSA-N 265.353 2.110 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@H]2CCN(C)C2=O)cc1Cl 723199318 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CCNCc1ccc(N2C[C@@H]3CCCN3C[C@@H]2C)cc1 94462712 GHDCSYSKCKPUFJ-YOEHRIQHSA-N 273.424 2.469 10 10 CECE O=C(/C=C/c1cncc(O)c1)N1CCOc2ccccc21 179423448 NVDVQPOBHROJKD-AATRIKPKSA-N 282.299 2.226 10 10 CECE CCN(CC)c1ccc([C@H](O)c2c[nH]c(=N)o2)cc1 2116237949 IPVARTJIZSDTIK-ZDUSSCGKSA-N 261.325 2.015 10 10 CECE C[C@H](N)Cc1cc(F)cc(N(C)c2ccnn2C)c1 2116343063 FFNYTRIXSVBKMZ-JTQLQIEISA-N 262.332 2.217 10 10 CECE CC=C(C)[C@H](NC)[C@@H](O)c1ccc2c(c1)CCN2C 2120359298 CITRLIBUDPDPCU-HOTGVXAUSA-N 260.381 2.267 10 10 CECE CCOC(=O)CCN(C)/N=N/c1ccc(O)cc1 1860480382 JNDGQTIMNLMSPG-BUHFOSPRSA-N 251.286 2.276 10 10 CECE COC(=O)[C@](C)(C[C@@H](C)C(F)F)NCCCN=[N+]=[N-] 2121391147 BOMBWQLQZKTYAR-KCJUWKMLSA-N 278.303 2.499 10 10 CECE Nc1ccc(NC(=O)/C=C/[C@H]2CN3CCC2CC3)cc1 212575071 OGDHWWOXAPAOKN-VXYHDWQYSA-N 271.364 2.105 10 10 CECE COc1cccc(CNC(=O)c2c(C)cccc2O)c1O 1636061809 XTNJCSZNLHBYBP-UHFFFAOYSA-N 287.315 2.345 10 10 CECE C[C@@H](NC(=O)CN1CC[C@H](N=[N+]=[N-])C1)c1ccccc1 1912184119 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2.312 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CCC[C@H](O)[C@H]3C2)c(F)c1 2150904370 FRVLCDUJLCUWIW-SDPXSBNPSA-N 278.371 2.443 10 10 CECE CN(CC(F)(F)CO)c1ccc(CO)c(C(F)(F)F)c1 2150982761 UOZOKYPYBXXVKQ-UHFFFAOYSA-N 299.239 2.262 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CCCC[C@H](F)C3)ccc21 2152296081 OYBGLAFERNITNO-IINYFYTJSA-N 277.343 2.228 10 10 CECE Cc1cc(N2C[C@H]3C(CO)[C@@H]3C2)ccc1CNC(C)C 2146875577 WAWBXMOQVNQVNS-HZPDHXFCSA-N 274.408 2.168 10 10 CECE C[C@@H](CNCc1c(O)cccc1Cl)N1CCC1 1997056728 IHJSVYOMMZOYCX-JTQLQIEISA-N 254.761 2.229 10 10 CECE Nc1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 39073148 RXTYUAFWRWLDSK-UHFFFAOYSA-N 252.277 2.397 10 10 CECE CC[C@@H]1CCOC[C@@H]1N(C)C(=O)Cc1ccc(N)cc1 2152569095 DVIIIUQRPKPDDO-HIFRSBDPSA-N 276.380 2.085 10 10 CECE COCCNCc1ccc(N2CC[C@@]2(C)CO)cc1Cl 2153562003 GKWWMKOTAACXBM-HNNXBMFYSA-N 298.814 2.037 10 10 CECE CC(C)CN(CCO)c1ccc([C@H](C)O)cc1[N+](=O)[O-] 2154248814 ULCHYVYNLDRNID-NSHDSACASA-N 282.340 2.103 10 10 CECE CN1CCc2cc([C@@H](N)c3c(F)cncc3F)ccc21 2154661984 GOCLLEHTAXQVGC-OAHLLOKOSA-N 275.302 2.400 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)c2ccc3nccn3c2)CC1 2159794141 BXBUPBYDUPNPEV-UHFFFAOYSA-N 270.296 2.249 10 10 CECE OCc1ccc(N2CCC=C[C@@H]2CO)cc1Br 2011251051 LAJXUGLFBPMITP-GFCCVEGCSA-N 298.180 2.069 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CN)cc1Cl 2018108069 OTQIAGGKKQUYKY-SKDRFNHKSA-N 254.761 2.148 10 10 CECE CC[C@@H](CN[C@@H](C)c1ccc(O)cc1O)COC 2027331446 KEYXAAHQOJACMO-QWRGUYRKSA-N 253.342 2.421 10 10 CECE C[C@H](CNCc1cc(Cl)ccc1O)c1ncon1 2027382906 WJYDBSAUSPUHSF-MRVPVSSYSA-N 267.716 2.322 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)C1CCOCC1 61670980 SCFDGNKZTNXRIO-UHFFFAOYSA-N 262.353 2.044 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CCCCC1(F)F 2035273169 BRTAGKNFFVXCJM-NEPJUHHUSA-N 257.280 2.332 10 10 CECE CC[C@H]1COCCN(c2ccc(OC)cc2N)C1 2036793227 JYDBBWWRYPJAIP-LLVKDONJSA-N 250.342 2.140 10 10 CECE CN(c1ccc(CN)c(F)c1F)[C@H]1CCCC[C@H]1O 300460097 PAHWZJCEMSDUBC-CMPLNLGQSA-N 270.323 2.163 10 10 CECE C[C@@H]1CCc2cc(N3CC[C@](C)(C(N)=O)C3)ccc2N1 300528086 GAEIUDJYNSZMCJ-BZNIZROVSA-N 273.380 2.135 10 10 CECE NCc1ccc(N2CCC[C@@](F)(CO)C2)c(Cl)c1 2039797844 ZYKTWZVXOFXLHC-ZDUSSCGKSA-N 272.751 2.100 10 10 CECE C[C@@](CO)(NCc1cccc(Cl)c1O)C1CC1 305811400 JDSUKRGVBUPMJK-ZDUSSCGKSA-N 255.745 2.296 10 10 CECE CNCc1ccc(N2CCCC[C@H]2CN(C)C)c(F)c1 404935560 OEGONBSIPMJJAY-AWEZNQCLSA-N 279.403 2.466 10 10 CECE CC(C)(C)CC[C@@](C)(NCCCN=[N+]=[N-])C(N)=O 311043263 ZXKAPTKJYKSGRX-GFCCVEGCSA-N 255.366 2.347 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N(C)CCC1CC1 311716197 OPZIEJNRGBOYOM-NSHDSACASA-N 261.369 2.328 10 10 CECE CN[C@@H](C)c1ccc(N2CCC(C(N)=O)CC2)cc1Cl 78902451 FVXZACWZXFYIHZ-JTQLQIEISA-N 295.814 2.322 10 10 CECE CC(C)[C@H]1CNCCCN1[C@H](C)c1cc(O)ccc1O 2159168480 OCNBGAOCGBDPOO-IUODEOHRSA-N 278.396 2.479 10 10 CECE CC1(C)CCN(Cc2ccc(N)cc2)CC[S@@]1=O 321581156 CAIZKVXTWRMYRI-SFHVURJKSA-N 266.410 2.002 10 10 CECE CCCNCc1ccc(N2CCC[S@](=O)CC2)c(C)c1 322108418 XBSWUGQALFWWOZ-FQEVSTJZSA-N 294.464 2.453 10 10 CECE CCN[C@H](c1ccccc1O)[C@H](O)[C@@H]1CCO[C@H](C)C1 2161578928 OXRLOLKFDZFYBM-CZPYZCIJSA-N 279.380 2.219 10 10 CECE N[C@@H]1CCN(c2ccc3c(c2)COCC3)CCC1(F)F 2162635708 MCTIKDMJMFZPHW-CQSZACIVSA-N 282.334 2.322 10 10 CECE C[C@@H]1O[C@H](C)[C@H](CN(C)Cc2cc(N)ccc2O)[C@H]1C 701272744 AHNFYKWAIRGXGL-UUIJZJDISA-N 278.396 2.466 10 10 CECE C[C@@]12CC[C@@](C(=O)N3CCC(CN=[N+]=[N-])CC3)(CO1)C2 2178363593 QXQDGSAJIMVGBT-KBPBESRZSA-N 278.356 2.495 10 10 CECE C[C@H]1CCN(c2ccc(CN)c(Cl)c2)C[C@@H]1CO 704047206 OLMPRTADMPPNCZ-CMPLNLGQSA-N 268.788 2.253 10 10 CECE CCCN[C@H](c1ccc2c(c1)CCN2C)[C@H](O)C1CC1 2163147157 YEFDFOSAEKPGOQ-IAGOWNOFSA-N 274.408 2.491 10 10 CECE Oc1c(CN2CCO[C@@H]3CCC[C@@H]32)ccc(F)c1F 703447477 KTUVFTIFKZYLMS-NWDGAFQWSA-N 269.291 2.424 10 10 CECE CO[C@@]1(C)CCN(Cc2cc(F)cc(F)c2O)C1 708421809 IUZMGMNHCUHLEI-ZDUSSCGKSA-N 257.280 2.281 10 10 CECE CC(C)N1CC[C@@H](NCc2cccc(Cl)c2O)C1=O 708724533 GPFWYQUBROZFGF-GFCCVEGCSA-N 282.771 2.145 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CCCCC[C@@H]43)ccc2[C@H]1O 687852810 TVRKESQLJTUIDH-NZVBXONLSA-N 272.348 2.441 10 10 CECE COc1ccc(N(CCCN)C[C@H]2CCCOC2)cc1 690435211 XYJFPHBMYRWUAI-CQSZACIVSA-N 278.396 2.277 10 10 CECE COc1ccc(N2CCSC[C@@H](C)C2)c(N)c1 379516180 WNWMPXMQPXPMML-JTQLQIEISA-N 252.383 2.467 10 10 CECE N[C@H]1CCCN(c2ccc(OCCOC3CC3)cc2)C1 711783824 BCNRMEDLHBKEDK-ZDUSSCGKSA-N 276.380 2.172 10 10 CECE Cc1cc(N2CCN3CC[C@H]2C3)ccc1CNC(C)C 381667605 GRSLWNUSJYCIMD-KRWDZBQOSA-N 273.424 2.387 10 10 CECE CCOc1cccc(CN[C@H]2CCCOCC2)c1O 381920624 UYHRQWJGQJKZTN-ZDUSSCGKSA-N 265.353 2.450 10 10 CECE COC[C@H]1C[C@@H](N[C@H](C)c2cc(O)ccc2O)C1 714463797 FQRCKEHAEFJFBX-MXWKQRLJSA-N 251.326 2.173 10 10 CECE C[C@H]1CCN(c2ccc3c(c2)CCO3)C[C@H](C)CN1 383581825 LHQDEYKEJLNRLK-OLZOCXBDSA-N 260.381 2.446 10 10 CECE CN1CCCc2cc([C@@H](CN)N(C)CCCF)ccc21 716798840 JKSPFSYYVPKLFA-MRXNPFEDSA-N 279.403 2.360 10 10 CECE COc1ccc(CN(C)[C@@H]2C[C@@H](C)O[C@@H]2C)c(O)c1 384867947 FQDHDQLPBDDRJU-JTNHKYCSSA-N 265.353 2.399 10 10 CECE CN(CCCCO)c1c(F)cc(CNC2CC2)cc1F 384984891 KJBGNXCYWSBRGP-UHFFFAOYSA-N 284.350 2.426 10 10 CECE c1cc(N2C[C@H]3COC[C@@H]3C2)ccc1CNC1CC1 718237901 YWWDGADXAVEDIP-KBPBESRZSA-N 258.365 2.021 10 10 CECE COCC(C)(C)CCNCc1cc2c(cc1O)OCO2 718670840 NGDDSOAXOXIVDQ-UHFFFAOYSA-N 281.352 2.273 10 10 CECE CCCC(=O)NCCNCc1c(O)cccc1Cl 393104843 PXDZWQLVOJJFBH-UHFFFAOYSA-N 270.760 2.052 10 10 CECE Cc1cccc(C(=O)[C@H](O)c2ccc(N(C)C)cc2)n1 2174463771 HGRNXTQSZSKCLX-OAHLLOKOSA-N 270.332 2.372 10 10 CECE CCC1(CN[C@@H](C)c2ccc(O)cc2O)COC1 393965769 OMYCXKFFEYZGFR-JTQLQIEISA-N 251.326 2.175 10 10 CECE [N-]=[N+]=NCCCCNC(=O)c1cc([N+](=O)[O-])cs1 395101556 MLEYNZPOKBAALR-UHFFFAOYSA-N 269.286 2.477 10 10 CECE Nc1cc2c(cc1N1CCC3(CC3)C1)CCC(=O)N2 399993254 ABUADNVIZUCFRU-UHFFFAOYSA-N 257.337 2.144 10 10 CECE CCN(C(=O)c1cnn2c(O)cc(C)nc12)C1CCCC1 2065002194 YNPYKISSLBLCIA-UHFFFAOYSA-N 288.351 2.148 10 10 CECE CC1(C)CCC=C[C@@H]1NS(=O)(=O)Cc1ccc(N)cc1 2175704401 OEQKOKXNBSZILJ-AWEZNQCLSA-N 294.420 2.433 10 10 CECE Oc1ccc(F)cc1CNCc1nccn1CC(F)F 2169361531 ZUAZYCPLTOOANH-UHFFFAOYSA-N 285.269 2.283 10 10 CECE CN(C[C@@H](F)C(F)(F)F)c1ccc(CO)cc1[N+](=O)[O-] 2179751950 HMXDAOQBEPVMHS-SNVBAGLBSA-N 296.220 2.424 10 10 CECE CCOC(=O)c1ccnn1[C@@H](C)c1c(O)cccc1OC 2069959283 WUWSJJZIFWRIAL-JTQLQIEISA-N 290.319 2.383 10 10 CECE CCc1nnc2n1CCN(c1ccc(CO)cc1Cl)C2 2170617550 MHIRPJWEFKSXTN-UHFFFAOYSA-N 292.770 2.006 10 10 CECE Cn1ccc2c1CN(c1c(F)cc(CN)cc1F)CC2 2170994053 QTPPRUIYAQGLFS-UHFFFAOYSA-N 277.318 2.325 10 10 CECE C[C@@]1(C(F)F)C[C@@H]1C(=O)NCCOc1ccc(N)cc1 2177327380 GWWAEOMNFXTBNW-BXUZGUMPSA-N 284.306 2.055 10 10 CECE CCNCc1ccc(N2CCN3C[C@@H](C)C[C@H]3C2)cc1 2181273175 XGZDBRNQBIUJRY-YOEHRIQHSA-N 273.424 2.327 10 10 CECE Cc1cccc(Cn2nc(CN)cc2C(F)(F)F)c1O 2079182465 SVOOEDLFSZHGHT-UHFFFAOYSA-N 285.269 2.423 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@H]3CF)c(Cl)cc21 2171802177 IYRCDNRTGFLPEU-SDBXPKJASA-N 297.761 2.491 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC(F)(F)C[C@@H]3C)ccc21 2172040812 HUWYMEPLKCKDOV-UFBFGSQYSA-N 281.306 2.133 10 10 CECE CCNCCN(CC)c1cc(OC)c(OC)c(OC)c1 2181951274 OYVDKMABZHQATJ-UHFFFAOYSA-N 282.384 2.148 10 10 CECE CC[C@@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)CCO1 2182912609 SSUZIHVFSQHPKH-GHMZBOCLSA-N 279.336 2.127 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H]3COC[C@@H]3C2)c(F)c1 2194513814 VHQSPIROLMAEAZ-NHCYSSNCSA-N 283.318 2.491 10 10 CECE Oc1cccc(CNC[C@H]2OCc3ccccc32)c1O 2183701151 GPIQEPWKUWIYRV-OAHLLOKOSA-N 271.316 2.459 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)[C@@H]2CN3CC[C@H]2C3)c(F)c1 2194522109 JJLVTPAWSGZYKC-ISTVAULSSA-N 282.334 2.158 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)Cc2ccncn2)c(F)c1 2194509668 ICBGWBBPZSIRLW-SECBINFHSA-N 279.290 2.445 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CCO[C@H](CF)C2)c(F)c1 2194694156 ICUOUJGPMWZVAK-GXSJLCMTSA-N 288.313 2.420 10 10 CECE Nc1ccc(COc2cc(N)c([N+](=O)[O-])cc2F)cc1 2184552373 ORHMBMONDSUXTG-UHFFFAOYSA-N 277.255 2.477 10 10 CECE CNCc1ccc(N2[C@H]3CC[C@@H]2C[C@@H](CO)C3)c(F)c1 2184669173 JKDPBVXMVSPJJZ-ZSOGYDGISA-N 278.371 2.285 10 10 CECE Oc1ccc(F)cc1CNC1CC(Cn2ccnc2)C1 2184785999 ANJIUCWYBBGITF-UHFFFAOYSA-N 275.327 2.296 10 10 CECE Nc1ccc(OCC(=O)NC[C@H]2C[C@H]2C2CCC2)cc1 2199941103 FZSKKVYGGBFDRD-DOMZBBRYSA-N 274.364 2.200 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)[C@@H]3C[C@@H]3C3CC3)ccc21 2199901875 JOHJEECDGYFMPB-TXCZRRACSA-N 272.392 2.086 10 10 CECE CC1(C)CNCC[C@H](NC(=O)Nc2ccc(N)cc2)C1 2191528061 BLNLHGKHVYBIPM-ZDUSSCGKSA-N 276.384 2.169 10 10 CECE Nc1cc(C(=O)O)c(F)cc1NCc1ccccc1O 2191625484 NCVZDQBJJVUSRX-UHFFFAOYSA-N 276.267 2.424 10 10 CECE CCOc1ccc(N(C)[C@@H](CN)C(F)(F)F)cc1 2044341732 FEALCFJKDKYMSY-NSHDSACASA-N 262.275 2.411 10 10 CECE CC(C)[C@@H]([C@H](O)c1ccc(N(C)C)cc1)[C@@H](C)N 2044702880 OZGFFDDYLSJAKD-KCPJHIHWSA-N 250.386 2.405 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H](N)CC(F)(F)F)cc1 2044718066 IJSBMTSJAYUFLF-GHMZBOCLSA-N 262.275 2.066 10 10 CECE CN(C)c1ccc([C@H](N)[C@](C)(O)C(F)(F)F)cc1 2044755366 WVGIAUJNOPKBLM-QWRGUYRKSA-N 262.275 2.066 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc(CN)c(Cl)c1)C2 2046792384 DCFKSOVTLMAAIV-BXUZGUMPSA-N 266.772 2.271 10 10 CECE CCN1CCC[C@H](N2CCC[C@H](N=[N+]=[N-])CC2)C1=O 2101123868 NFDWFTLZADQCLY-RYUDHWBXSA-N 265.361 2.162 10 10 CECE CCN1CCC[C@@H](N2CCC[C@@H](N=[N+]=[N-])CC2)C1=O 2101123869 NFDWFTLZADQCLY-VXGBXAGGSA-N 265.361 2.162 10 10 CECE CC1(C)CO[C@@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2047505535 HPWUKJKJAQYIOE-NXEZZACHSA-N 252.318 2.103 10 10 CECE CN(C[C@@H]1CCN1C)c1ccc(CN)cc1C(F)(F)F 2186466086 IACPSTKYPPVWBR-NSHDSACASA-N 287.329 2.304 10 10 CECE CCN(CCN)Cc1ccc(C(F)(F)F)cc1O 2050390195 HSMUXZWJKOYMJH-UHFFFAOYSA-N 262.275 2.192 10 10 CECE CCN(c1ccc(CN)cc1)[C@H]1C[C@H](OC)[C@H](OC)C1 2187168779 DAHICFZJNXRGSP-PHZGNYQRSA-N 278.396 2.164 10 10 CECE CO[C@@H]1C=C[C@@H](NCc2ccc(F)c(F)c2O)C1 2055813506 IZKKCJAICROKHW-NXEZZACHSA-N 255.264 2.104 10 10 CECE COC[C@]1(C)CCN1c1ccc(CN)c(F)c1F 2055909298 OOKJUFURPAACNZ-ZDUSSCGKSA-N 256.296 2.039 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)CCC1CNC1 2056823146 MRSFLEVPFQSIOM-JTQLQIEISA-N 252.333 2.134 10 10 CECE CN(C)c1ccc(CN2CC[C@H]3CCC[C@]32CN)cc1 2197339007 HZKHRMYBPUNFIU-WBVHZDCISA-N 273.424 2.456 10 10 CECE C[C@H](NC(=O)C[C@@H](CN)C1CCC1)c1ccccc1O 2192630400 ZTYRWHVEFRCWFK-AAEUAGOBSA-N 276.380 2.335 10 10 CECE CCC1(CC)CC(NCCCN=[N+]=[N-])(C(N)=O)C1 2058832767 DQQCBVBLWSSPQS-UHFFFAOYSA-N 253.350 2.101 10 10 CECE COCC(CC[C@H](N)c1ccc(N(C)C)cc1)COC 2187511776 ZOPHLTNWCMJIFM-INIZCTEOSA-N 280.412 2.442 10 10 CECE Cc1ccnnc1CN(C)CCCc1ccc(N)cc1 2192804679 KYUILGNRSGIJLN-UHFFFAOYSA-N 270.380 2.432 10 10 CECE O[C@@H]1CCc2cc(N3C[C@@H]4[C@H](C3)C4(F)F)ccc21 2065077731 OAKSOJGIOIFETI-FRRDWIJNSA-N 251.276 2.368 10 10 CECE CC[C@H](NC)c1ccc(N(C)CCC(=O)N(C)C)cc1 2188487220 SPNBSQALLUOAPT-HNNXBMFYSA-N 277.412 2.272 10 10 CECE C[C@@]1(CCO)CCN(c2ccc(CO)cc2Cl)C1 2068151524 PINJJLOSKBMAAR-AWEZNQCLSA-N 269.772 2.431 10 10 CECE C[C@H]1C[C@H](N(C)c2ccc(CO)c([N+](=O)[O-])c2)CCO1 2188577838 VRMIOZRATIWYCJ-GXFFZTMASA-N 280.324 2.091 10 10 CECE Nc1ccc(NC(=O)COCc2ccsc2)cc1 2081664254 VNAVRFPSYOTREV-UHFFFAOYSA-N 262.334 2.486 10 10 CECE C[C@H](N)c1ccc(N2CC(F)(F)C[C@@]2(C)CO)cc1 2102791247 OKMQOOGYFVWDJC-GWCFXTLKSA-N 270.323 2.303 10 10 CECE CC(C)CN(C1CNC1)[C@H](C)c1ccc(O)cc1O 2103944704 WMKBVJPPZHYHGQ-LLVKDONJSA-N 264.369 2.089 10 10 CECE C[C@]12CNC[C@]1(C)CN(c1ccc3c(c1)CCO3)C2 2106386769 WZWHCXOQNFXLEQ-HZPDHXFCSA-N 258.365 2.057 10 10 CECE CN(c1ccc2c(c1)OCCO2)[C@@H]1CCC[C@@H]1CN 2106334939 CXLHBAMMOWAXRX-DGCLKSJQSA-N 262.353 2.021 10 10 CECE CN1CCc2cc(N(CCN)CC(F)(F)F)ccc21 2106795879 LPDCHHNLXBHSDR-UHFFFAOYSA-N 273.302 2.006 10 10 CECE C[C@@H]1C[C@@](O)(c2ccc(N(C)C)cc2)CN1C1CC1 2106790052 DUWVZAYLBGLCHO-WBMJQRKESA-N 260.381 2.197 10 10 CECE CN(C)c1ccc([C@H](O)C2(N)CC3(CCC3)C2)cc1 2106790499 IWKLRCJXASOTJP-AWEZNQCLSA-N 260.381 2.448 10 10 CECE CN(C)c1ccc([C@@]2(O)CCN3CCC[C@H]2C3)cc1 2106794996 BYEFELLZFMPFRK-HOCLYGCPSA-N 260.381 2.056 10 10 CECE CN1CCCc2cc([C@](C)(O)[C@H]3CCCN3)ccc21 2106826688 VSTTYEURDIBXOC-CVEARBPZSA-N 260.381 2.029 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@H]1[C@@H]2COC[C@@H]21 2106823870 TYSMIKSLXIXLHJ-FXUDXRNXSA-N 258.365 2.179 10 10 CECE CN1CCc2cc([C@H](O)C[C@@H](N)C3CCC3)ccc21 2106800537 ISZBIFGMMYVSPD-GDBMZVCRSA-N 260.381 2.230 10 10 CECE C[C@@H]1C[C@H]([C@@H](N)c2ccc3c(c2)CCCN3C)CO1 2106828173 KAKAMFCBYODHAG-WPGHFRTFSA-N 260.381 2.494 10 10 CECE CCN[C@@H](C)[C@@H](NCC)c1ccc2c(c1)CCN2C 2107990522 NBBDMEWZRIJKJA-BLLLJJGKSA-N 261.413 2.328 10 10 CECE NCc1ccc(N2CCOC[C@H]2C2CC2)c(F)c1F 2088415874 YQEAAZQEAFVJGH-LBPRGKRZSA-N 268.307 2.039 10 10 CECE CN(Cc1ccc(=N)[nH]c1)Cc1c(O)cccc1Cl 2109350839 GWXBECABESRYFH-UHFFFAOYSA-N 277.755 2.485 10 10 CECE O=C(NCc1ccccc1O)N1C[C@H]2CCC[C@H]2C1 2089427501 CPOVYRJITQCZDD-BETUJISGSA-N 260.337 2.334 10 10 CECE C[C@@]12CC[C@@H](CN1c1ccc3c(c1)NC(=O)[C@H]3N)C2 2089662978 VTGFDEZTBGGTJT-DVJZZOLTSA-N 257.337 2.017 10 10 CECE C[C@H](NCCCc1cnoc1)c1c(O)cccc1O 2090722211 DKXPRXQTNWONJH-JTQLQIEISA-N 262.309 2.369 10 10 CECE C[C@@H]1CCC[C@@H]([C@@](C)(NCCCN=[N+]=[N-])C(N)=O)C1 2112260159 KNPBSCIYLRENGE-NQBHXWOUSA-N 267.377 2.347 10 10 CECE CNCc1ccc(N2CC[C@@H](O)C3(CC3)C2)c(Cl)c1 2093181957 BNSJUIPZFAVINF-CQSZACIVSA-N 280.799 2.411 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H]3[C@H](CO)[C@H]3C2)cc1Cl 2093155496 LPQBFDRMIDIYNG-HBEIAFGSSA-N 281.783 2.458 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC[C@H](C3CNC3)C2)c1 2093483226 PDBCDEUSCKKMIX-STQMWFEESA-N 260.381 2.303 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@H]1[C@H]2COCC[C@@H]21 2093778170 GZRCMYQWXKFQPM-KFWWJZLASA-N 261.365 2.206 10 10 CECE CO[C@@H](COCc1ccc(N)cc1)[C@@H]1CCCOC1 2093893785 SOVRIXUXLCKULA-HIFRSBDPSA-N 265.353 2.227 10 10 CECE C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H](C)[C@H]1N 2095710914 JIIGOAHCNAAMSX-IOASZLSFSA-N 261.413 2.310 10 10 CECE CNCc1ccc(N(C)[C@@H]2COCC[C@H]2C)c(F)c1 2096268910 NHQUIXIOXUWKFW-IAQYHMDHSA-N 266.360 2.406 10 10 CECE CC[C@@H]1CN[C@@H](C)CN1c1ccc2c(c1)COCC2 2096488404 QXBFRNDDHRCTAA-SWLSCSKDSA-N 260.381 2.336 10 10 CECE CC[C@H]1COCCN(c2c(F)cc(CO)cc2F)C1 2098063523 STKXSCHAIRETPB-SNVBAGLBSA-N 271.307 2.320 10 10 CECE C[C@@H](NC[C@]1(C)CCCN1C)c1ccc(O)cc1O 2098720704 FVENKUNNHRPSQS-ABAIWWIYSA-N 264.369 2.233 10 10 CECE CC[C@@H]1CCN(Cc2ccc(O)cc2O)[C@@H](C(=O)O)C1 2201056216 UMDFNKVNLHIFJU-ZWNOBZJWSA-N 279.336 2.173 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@@H]2CNCC[C@H]2C1 2112464427 HTSJXZHEGSCGII-WOPDTQHZSA-N 264.344 2.134 10 10 CECE Nc1ccc(CN2CCOC[C@@H]2c2ccco2)cc1 2115083734 MURKIOHXGCESST-CQSZACIVSA-N 258.321 2.435 10 10 CECE COc1ccc(N2C[C@H]3CNC[C@H]3C2(C)C)c(F)c1F 2201641148 BTHPUANECYTCBO-NXEZZACHSA-N 282.334 2.408 10 10 CECE CNCc1ccc(N2CCC[C@]23CCOC3)cc1OC 2204549844 UNEFWBXKSBFOPM-MRXNPFEDSA-N 276.380 2.174 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H]3CC[C@H]2[C@H](O)C3)c1 2204615809 AYYQSABMYKAYOC-DSPGLSBSSA-N 277.364 2.040 10 10 CECE Cc1ccc(CN[C@H]2C[C@@H](Cn3ccnc3)C2)c(O)c1 2204636929 XBGGBHDLCQYBOO-OTVXOJSOSA-N 271.364 2.466 10 10 CECE C[C@H](N=c1[nH]nc([C@H]2CCOC2)s1)c1ccccc1O 2204766681 SMMIDOLUKKVXSE-UWVGGRQHSA-N 291.376 2.343 10 10 CECE COCC(COC)N(C)c1ccc([C@@H](C)O)c(C)c1 2269696388 TVGBKIMYVCRGFF-GFCCVEGCSA-N 267.369 2.146 10 10 CECE C[C@H](NC[C@@]12CCC[C@@]1(CO)C2)c1c(O)cccc1O 2208163642 CZHINASTMYUBGG-UVBJJODRSA-N 277.364 2.301 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3O)C1(C)C 2271272418 SXRVRKYDVJDJGF-NOZJJQNGSA-N 260.337 2.297 10 10 CECE COCCN(c1ccc(OC)cc1C=O)C(C)C 2220424047 UNJSCONAAKGSQK-UHFFFAOYSA-N 251.326 2.369 10 10 CECE CCNCc1cc(OC)ccc1N1CC=C(F)C1 2220413707 FOBCYUWGDCVXOF-UHFFFAOYSA-N 250.317 2.478 10 10 CECE COc1ccc(N(C)[C@H](C)CCN(C)C)c(C=O)c1 2273133174 SNGIADFGISSEKH-GFCCVEGCSA-N 264.369 2.284 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@@H]2[C@H](CO)C[C@H]2C1 2232094149 ORWBOBMIRPWWBG-MXAVVETBSA-N 260.381 2.079 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCC(F)(CO)CC1 2232095511 GAEGDAOHEZYEGY-GFCCVEGCSA-N 267.344 2.349 10 10 CECE Cc1nn(C)c(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)c1Cl 2232169505 CMCNRRTXNYARRN-QMMMGPOBSA-N 282.735 2.297 10 10 CECE COc1ccc(N2CCCO[C@H](CN)C2)cc1C(C)C 2233166179 BNFLGWRNPHSXBQ-CQSZACIVSA-N 278.396 2.373 10 10 CECE Oc1cccc(CNC[C@@H]2OC[C@H]3CCCC[C@H]32)c1O 2233215978 MSTCDHWXGBVZHX-NFAWXSAZSA-N 277.364 2.393 10 10 CECE Nc1ccc(OCC(=O)NC2CC(CC3CC3)C2)cc1 2233915122 VMLPWIKXEIBFMN-UHFFFAOYSA-N 274.364 2.343 10 10 CECE CC1(C)[C@H](C(=O)N2CC(N=[N+]=[N-])C2)CC[C@@]1(C)C(=O)O 2234178110 YEDPMADNPZLBJV-ZANVPECISA-N 280.328 2.035 10 10 CECE C[C@H](O)[C@@H]1CN(c2ccc(OC(F)(F)F)cc2)CCO1 2234895200 PWGDUEPJWCZYSO-CABZTGNLSA-N 291.269 2.171 10 10 CECE Cc1cc(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])nnc1C 2225792477 NMVSREVEKBKFAR-ZJUUUORDSA-N 260.301 2.055 10 10 CECE COc1ccc(N(C)[C@H](C)c2cn(C)cn2)c(CN)c1 2235961089 XHBFBUKSDWOQKM-LLVKDONJSA-N 274.368 2.085 10 10 CECE COc1ccc(N2CCC[C@@H](C3(O)CC3)C2)c(C=O)c1 2235993053 UIVUFYZHPKJESA-CYBMUJFWSA-N 275.348 2.249 10 10 CECE CCCO[C@H]1CCN(c2ccc(OC)cc2CNC)C1 2235958024 ILNVMGOGYMGCEX-HNNXBMFYSA-N 278.396 2.420 10 10 CECE COc1ccc(N2CCC[C@H]2CCCO)cc1OC 2226806754 OSAIEGKRYDQMIW-LBPRGKRZSA-N 265.353 2.445 10 10 CECE C[C@H]1[C@@H](O)C[C@@H](C)CN1c1c(F)cc(CO)cc1F 2227596919 CKNVRZPHDWRTJB-ZDMBXUJBSA-N 271.307 2.053 10 10 CECE CCCOCC1CN(c2ccc(OC)cc2C=O)C1 2227700251 WJOJTBOPZATQNO-UHFFFAOYSA-N 263.337 2.371 10 10 CECE CO[C@@H]1CC[C@H]1CN(C)c1ccc(CCN)c(C)c1 2227844179 KRTBPPDVXWWQBZ-GOEBONIOSA-N 262.397 2.357 10 10 CECE CN1CCc2cc([C@H](NN)[C@@H](F)C3CCC3)ccc21 2228130877 VSTSHUPNUCDZSG-GJZGRUSLSA-N 263.360 2.322 10 10 CECE CCNCc1cc(F)c(N2CC(CCCO)C2)c(F)c1 2238726631 LBRHQZVOALUVHD-UHFFFAOYSA-N 284.350 2.283 10 10 CECE CC[C@H](C)NCc1ccc(N2C[C@H](O)[C@@H]2C)cc1OC 2240023015 BZTDSUTWTKCPMF-HUBLWGQQSA-N 278.396 2.153 10 10 CECE CN(Cc1ccc(F)cc1O)C[C@H](F)[C@H]1CCOC1 2230034234 ZOFHSZPDOGHWBW-AAEUAGOBSA-N 271.307 2.338 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1Cc2ncnc(O)c2C1 2240743733 LPJVJNACLSCXNX-SNVBAGLBSA-N 270.336 2.031 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CCCC[C@H]1CC(N)=O 2240834445 ZVNKTIQKXOHZSY-OCCSQVGLSA-N 276.380 2.283 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCCC[C@@H]1CC(N)=O 2240832189 ZVNKTIQKXOHZSY-GXTWGEPZSA-N 276.380 2.283 10 10 CECE Cc1cc(N2C[C@H]3CCN(C)C[C@@H]3C2)ccc1[C@@H](C)N 2285145435 DLNVNSSPEQJMRK-RBSFLKMASA-N 273.424 2.403 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1ccc([C@H](C)N)cc1F 2260390979 LBEVQIDJVJZFCP-BHYNMZESSA-N 252.333 2.195 10 10 CECE COc1cc(OC)c(N2CC[C@H]2C(C)(C)O)cc1OC 2289338303 CSMULGLNKTUALN-AWEZNQCLSA-N 281.352 2.062 10 10 CECE CC(C)(C)C1(OC(=O)Cc2ccc(N)cc2)COC1 2272928918 DHNAGRRZDPJIPR-UHFFFAOYSA-N 263.337 2.170 10 10 CECE OC[C@@H]1CC2(CC2)CN1c1ccc(OCF)cc1 2263852264 BXXPKNKDVSIHOB-LBPRGKRZSA-N 251.301 2.344 10 10 CECE COc1ccc(CNCCN2CC[C@H]3C[C@H]32)cc1C 2274568560 ZARYOOFZRCDEGU-LSDHHAIUSA-N 260.381 2.187 10 10 CECE Cc1ccc(O)c(CN2CCC[C@@](F)(C(=O)O)C2)c1 2265827011 SRZLJFGEPWAXKC-AWEZNQCLSA-N 267.300 2.089 10 10 CECE CN(C)c1ccc([C@@H](O)[C@H]2C[C@H]3CCC[C@H]2N3)cc1 2277724812 OOVAXWRASZKTKT-SLBVQIDZSA-N 260.381 2.317 10 10 CECE FC(F)Oc1ccc(N2CCC[C@H]3CNC[C@@H]32)cc1 2278491692 JPYWJLPWICROFW-GWCFXTLKSA-N 268.307 2.476 10 10 CECE COC[C@@]1(C)C[C@@H]1CN(C)CCc1ccc(N)cc1 2269210232 XUKXYNITGDYEAB-GDBMZVCRSA-N 262.397 2.416 10 10 CECE Nc1ccc(O)c(CN2C[C@H](O)C[C@H]3CCCC[C@H]32)c1 2279555992 VPKDLPXXYZRONC-KCPJHIHWSA-N 276.380 2.100 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc([C@H](C)N)c(C)c1 2269664016 WNWDAKSZJYVEOG-AEGPPILISA-N 259.397 2.298 10 10 CECE Cc1cc(N2CCS[C@H](CCO)C2)ccc1[C@@H](C)N 2269668399 ULESSRFDUKPJSE-TZMCWYRMSA-N 280.437 2.319 10 10 CECE CN[C@H](C)c1ccc(N(C)CC2CN(C)C2)cc1C 2269668408 DTDJJIAFMXXVSP-CYBMUJFWSA-N 261.413 2.273 10 10 CECE CN(C)c1ccc([C@H](OCC(=O)O)C2=CCCO2)cc1 2290526817 VXJRPEPVJKIWFZ-HNNXBMFYSA-N 277.320 2.199 10 10 CECE COc1ccc(N2C[C@@H]3CNC[C@@]3(C)C2)c(OC)c1C 2295433285 SBFXMZZRTPJSFW-LRDDRELGSA-N 276.380 2.058 10 10 CECE CN(CCc1ccc(N)cc1)[C@@H](CO)c1ccccc1 2296482525 PUKGDGSCRRDGAO-KRWDZBQOSA-N 270.376 2.477 10 10 CECE COc1ccc(N(C)C(=O)/C=C\c2cncc(C)c2)nc1 492591930 HYJZQCVOBGIZNP-DAXSKMNVSA-N 283.331 2.470 10 10 CECE Nc1ccc(OCCCN(CCF)CCF)cc1 2317660343 YWHGYIVMZVHVMO-UHFFFAOYSA-N 258.312 2.279 10 10 CECE C[C@@H]1CC[C@@H](CC(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])O1 2312333168 ASOHRLKOYZMEPN-YTWAJWBKSA-N 252.318 2.292 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)[C@@H]1CC[C@@H]2[C@H]1C2(F)F 2315986770 IFJSTTLUNMCKPP-HLTSFMKQSA-N 258.272 2.437 10 10 CECE COc1cc(Cl)c(N2CC[C@]2(C)CO)c(OC)c1 2319631900 FLFYNAPXERUAMT-CYBMUJFWSA-N 271.744 2.318 10 10 CECE CS[C@@H]1CC[C@H]1OCC(=O)Nc1ccc(N)cc1 2327334962 ZFMQELZNBOEFCT-VXGBXAGGSA-N 266.366 2.118 10 10 CECE Cc1ccc(O)c([C@@H](C)N2C[C@@H]3CCNC[C@@H]3C2)c1 2330080284 TVSZNGVHNSYPGV-HZSPNIEDSA-N 260.381 2.303 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@H]3C[C@]3(O)C2)c(F)c1 2330189606 YXGTUPFEHJIGEI-NVBFEUDRSA-N 264.344 2.067 10 10 CECE CO[C@H]1C[C@@H]2C[C@](O)(c3ccc(N(C)C)cc3)C[C@H]12 2331957817 IUNDEULXWIRHCA-IPOQPSJVSA-N 261.365 2.385 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)[C@@H]1CC[C@H]2C[C@@H]1CO2 2333612815 APZGCOJTIPGTGG-ROHXPCBUSA-N 264.329 2.149 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H]3CO)c(OC)c1 2333690468 HIAKFCYEHDJWIU-LOWVWBTDSA-N 263.337 2.053 10 10 CECE Cc1cnc([C@@H](O)CCc2ccc(N)cc2)c(C)n1 2336036858 AUYRFABGINNXPZ-AWEZNQCLSA-N 257.337 2.342 10 10 CECE CN[C@H]1CCc2cc(N3CCOC[C@H](F)C3)ccc21 2336671875 SPGZPDKDVCIIAD-DOMZBBRYSA-N 264.344 2.068 10 10 CECE C[C@H]1C[C@@H](C)[C@@H]1N(C)C(=O)COc1ccc(N)cc1 2339030956 KPGSXNSNZSCBDK-HBYGRHMLSA-N 262.353 2.151 10 10 CECE CN(c1ccc(CO)c(C2CC2)c1)C1CC(CO)C1 2339166861 RSCVPWBLAUXHER-UHFFFAOYSA-N 261.365 2.263 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1CN2c1ccc2c(c1)CC[C@@H]2O 2340740273 PDFRLNIVBWAAEL-YOENINGUSA-N 259.349 2.280 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H](C)[C@@H](O)C2)c(C)c1C 2341296817 HKYOHKYPJRBKAZ-HICWGWBUSA-N 262.397 2.401 10 10 CECE CN(C[C@@H]1O[C@H]2CC[C@H]1C2)c1ccc(CO)cc1F 2352643135 LVRYAFPAALEUJS-HUBLWGQQSA-N 265.328 2.322 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)c(F)c1 2355770554 QIJYPKUHRBKGAX-GXCBOPRBSA-N 278.371 2.456 10 10 CECE Cc1cnc(C)c(N2CCN(c3ccc(N)cc3)CC2)n1 57896752 UFYJFOSIPCNALL-UHFFFAOYSA-N 283.379 2.002 10 10 CECE Nc1ccc(Nc2ccc(N[C@H]3CCCO3)nn2)cc1 26444443 XCDWXNJIHJSFIX-CQSZACIVSA-N 271.324 2.351 10 10 CECE CN1CCc2cc([C@@H](Nc3ccccc3)C(N)=O)ccc21 50287550 CVRFWJODRAJBEK-MRXNPFEDSA-N 281.359 2.317 10 10 CECE Cc1cc(N2CCC[C@H]2C(N)=O)ccc1CNC(C)(C)C 50581665 OCAMUTKLEODHLC-HNNXBMFYSA-N 289.423 2.337 10 10 CECE CNCc1ccc(N2CC[C@H](C)[C@H](O)C2)c(Cl)c1 300016419 SFXPVYLEQTXCHU-IINYFYTJSA-N 268.788 2.267 10 10 CECE CN1CCc2cc([C@H](N)[C@@H](O)[C@@H]3C[C@H]3C3CC3)ccc21 2357646327 JOHJEECDGYFMPB-FSDCSDTHSA-N 272.392 2.086 10 10 CECE O=C1CCC[C@H]1[C@H]1CCCN1C(=O)c1cccc(O)c1O 126166653 TWFJDQRLQAKIED-CMPLNLGQSA-N 289.331 2.072 10 10 CECE O=C(N[C@@H](c1nccs1)C1CC1)c1cccc(O)c1O 187134472 SMMAWQNPHICIDE-LLVKDONJSA-N 290.344 2.435 10 10 CECE COc1ccc(O)c(CN[C@H](C)c2nccnc2C)c1 188200940 YJPDJZIKOSFKAP-LLVKDONJSA-N 273.336 2.350 10 10 CECE O=C(O)/C=C\c1ccc(N2CCN(C3CC3)CC2)c(F)c1 217141344 BQXCSRLUEBRINE-KXFIGUGUSA-N 290.338 2.208 10 10 CECE C[C@@H]1CN([C@H](C)c2cc(O)ccc2O)C[C@@]1(C)CN 312006156 QYVLIXUIUOZJKN-UEKVPHQBSA-N 264.369 2.076 10 10 CECE O=C(O)C1CCC(CNCc2ccccc2O)CC1 34595573 LXHQZWPYRPIQFR-UHFFFAOYSA-N 263.337 2.373 10 10 CECE NCc1ccc(N2CCC[C@@H]2CCCO)cc1F 135226801 OYBUWOSAZHZQCI-GFCCVEGCSA-N 252.333 2.026 10 10 CECE COC(=O)NCc1nc(-c2ccc(O)c(O)c2)cs1 49699489 BBILAHMNSGTLNS-UHFFFAOYSA-N 280.305 2.077 10 10 CECE CC(C)CNC(=O)[C@@H](C)NCc1cccc(Cl)c1O 228974640 CLHBBTWPEVBWPD-SNVBAGLBSA-N 284.787 2.296 10 10 CECE CCCOc1ccc(C=C2C(=O)NNC2=O)c2ccccc12 90449056 XSXOOSDELNIETI-UHFFFAOYSA-N 296.326 2.173 10 10 CECE CN[C@@H](C)c1ccc(N(C)CCCN(C)C)cc1O 93671709 CDUAFHSUVYQOHU-LBPRGKRZSA-N 265.401 2.061 10 10 CECE CC[C@H]1OCC[C@@H]1CNCc1cccc(F)c1O 234183564 KRBDAYLYTISDQZ-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1cccc(COC)c1 90257475 PYFYOWDEMFAMST-ZDUSSCGKSA-N 292.339 2.337 10 10 CECE CC[C@H]1CCCC[C@]1(NCCCN=[N+]=[N-])C(N)=O 90260502 YPWORQCZLZJHHN-CMPLNLGQSA-N 253.350 2.101 10 10 CECE C[C@@H](CO)c1c(F)cc(O)c(O)c1Br 258334662 CUYPDBOOKVJIKD-BYPYZUCNSA-N 265.078 2.095 10 10 CECE C[C@H]1CN(c2ccc(CN)cc2Br)CC[C@H]1O 253174371 DEIBXESMESSBMD-TVQRCGJNSA-N 299.212 2.115 10 10 CECE 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2.208 10 10 CECE CCOc1ccc(O)c(CN[C@@H](C)c2noc(C)n2)c1 1261186172 ADHFLAGTCROOFX-VIFPVBQESA-N 277.324 2.333 10 10 CECE CC[C@H](C)OC(=O)CNCc1ccc(N(C)C)cc1 1857871131 CITNQOWIPNJNOR-LBPRGKRZSA-N 264.369 2.184 10 10 CECE Nc1ccc(NC(=O)CCN2CC=CC23CCC3)cc1 1914260155 RARWDQYGXHMORB-UHFFFAOYSA-N 271.364 2.392 10 10 CECE CCOC(=O)c1cnc(SCC(C)(C)O)s1 1900194450 MUZIHBHEPBFKMS-UHFFFAOYSA-N 261.368 2.183 10 10 CECE OCc1ccc(N2[C@H]3CC[C@@H]2[C@H]2CC[C@@H]3O2)c(F)c1 1900613597 AQKWSLPVFZYKRS-NMWPEEMBSA-N 263.312 2.217 10 10 CECE CC[C@@H]1C[C@@H]1[C@@H](O)[C@H](NC)c1ccc(N(C)C)cc1 2135154973 ZJTSUQLKPDQHNB-MSQAHXEGSA-N 262.397 2.420 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3CC[C@@]3(CO)C2)c(F)c1 1903838989 RYOGDKPCWHIPEI-GMXABZIVSA-N 264.344 2.054 10 10 CECE CC(C)[C@H]1CCCN1C[C@@H](O)COc1ccc(N)cc1 226565761 XRCRKPWIFAMSJQ-GDBMZVCRSA-N 278.396 2.129 10 10 CECE C[C@@H](c1ccccc1O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)O 2136403610 YTRIZJXCORAZSQ-RMIALFOJSA-N 261.321 2.391 10 10 CECE Cc1ccccc1-c1noc(-c2nnsc2N)n1 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BAOALHAKDRTICH-YPMHNXCESA-N 282.365 2.417 10 10 CECE CO[C@@H]1C[C@@]2(C(=O)N3CCCC[C@@H](CN=[N+]=[N-])C3)C[C@@H]12 2354278938 BVBJIFYVGDODKP-FMSGJZPZSA-N 278.356 2.350 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H]3C[C@@H]4CC[C@H]3N4)ccc21 2354609271 ZKIFZZQPUNDMHQ-LJIGWXMPSA-N 272.392 2.243 10 10 CECE CC1(C)[C@@H](O)[C@@H]2CCN(c3ccc4c(c3)CC[C@@H]4N)[C@@H]21 2356172891 MSDVCCZNMZPBDA-UGUYLWEFSA-N 272.392 2.228 10 10 CECE Cc1nccn1CCNCc1cccc(Cl)c1O 310630365 MIDGJMJGTPJHQQ-UHFFFAOYSA-N 265.744 2.340 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CC[C@@H]4CC[C@@H]4C3)ccc21 2356882255 QLEOBGXKFWVTAI-FIXISWKDSA-N 271.364 2.136 10 10 CECE CC[C@H]1CN(Cc2cccc(C)c2O)CCN1CCOC 180087084 DWXHFJJNKMIQNY-INIZCTEOSA-N 292.423 2.243 10 10 CECE C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CN1C1CC1 151064079 RYNHFROIQHTANZ-IUODEOHRSA-N 272.392 2.336 10 10 CECE C[C@H]1CSCCN1CCCOc1ccc(N)cc1 70219181 WSWIJODURCTFOI-LBPRGKRZSA-N 266.410 2.475 10 10 CECE COc1ccccc1C(=O)NCCOc1ccc(N)cc1 32133239 FPDQFGZEGVPJMW-UHFFFAOYSA-N 286.331 2.086 10 10 CECE CCNCc1cc(F)c(N2C[C@H](C)[C@@H](N(C)C)C2)c(F)c1 226090152 BOXPOUHRFAGRQC-NHYWBVRUSA-N 297.393 2.461 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)NOCCOC)c1 134028031 YOZWQJMLCZRNLB-NSHDSACASA-N 296.367 2.359 10 10 CECE CCOc1ccc(O)c(CN2CCOC[C@H]2CC)c1 91981828 BYOYLKHIOMBXRE-CYBMUJFWSA-N 265.353 2.402 10 10 CECE Oc1ccc2ccccc2c1CN1CCC2(C1)OCCO2 93013074 STLJVPGXMNRJQK-UHFFFAOYSA-N 285.343 2.494 10 10 CECE CNC[C@@](C)(F)c1cc(O)c(O)cc1Br 257823581 FOPYIASBEWMRGF-SNVBAGLBSA-N 278.121 2.264 10 10 CECE NC1(Cc2c(O)c(O)cc(Br)c2F)CC1 258540955 JLLQOGVKVAIOMA-UHFFFAOYSA-N 276.105 2.033 10 10 CECE C[C@@H]1COCC[C@@H]1NCc1ccc(N2CCOCC2)cc1 277981235 TYYDGQJTNROULE-PBHICJAKSA-N 290.407 2.038 10 10 CECE CN(CC1CCNCC1)c1ccc2c(c1)OC(F)(F)O2 2162626711 WQNAJCYCBOGQLK-UHFFFAOYSA-N 284.306 2.444 10 10 CECE C[C@@H](N[C@H]1CCN(C)C2(CC2)C1)c1ccc(O)cc1O 2167494613 TYXKUELGTOWLAF-NEPJUHHUSA-N 276.380 2.375 10 10 CECE CN1CCc2cc([C@H](O)[C@H](CN)C3CCCC3)ccc21 2163064523 UXAUGPKQQATGCF-WBVHZDCISA-N 274.408 2.477 10 10 CECE COc1cc([C@](C)(N)c2ccc3c(c2)CCN3C)sn1 2163062627 MFBOGHWNHJOWAH-OAHLLOKOSA-N 289.404 2.366 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@H]1COCCO1 2163099442 ITKUBJKALHVQLA-HZPDHXFCSA-N 277.364 2.126 10 10 CECE CN1CCCc2cc([C@H](O)[C@H]3CC=C[C@@H](N)C3)ccc21 2163101133 YDIKPBVSUUXWAD-YSVLISHTSA-N 272.392 2.396 10 10 CECE NN[C@@H](c1ccc(N2CCCC2)cc1)c1cccnc1 2163107842 UVFODINRLNDFML-INIZCTEOSA-N 268.364 2.235 10 10 CECE Cn1cncc1[C@@H](O)c1ccc(N2CCCCC2)cc1 2163107301 NPYNIIFARGDMOR-INIZCTEOSA-N 271.364 2.492 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)[C@](C)(O)CSC 2163228752 HNBYCNRGSJUZPZ-HZPDHXFCSA-N 294.464 2.444 10 10 CECE CN(C[C@H]1C(F)(F)C12CC2)C(=O)Cc1ccc(N)cc1 2165867790 VZKFUYKOHJEFSY-GFCCVEGCSA-N 280.318 2.315 10 10 CECE O=C(O)/C=C\c1ccc(N2CC[C@H](F)C2)c(F)c1 701637857 OMDWSJYMAWJEDC-GQPNGRKGSA-N 253.248 2.472 10 10 CECE Nc1ccc(OCC(=O)OCCOC2CCCC2)cc1 701385841 ZPWRKZJKTRGSSE-UHFFFAOYSA-N 279.336 2.150 10 10 CECE COc1ccc(CNC(=O)NCCC2(F)CCC2)c(O)c1 806043150 DQZRFWMDUHLJJX-UHFFFAOYSA-N 296.342 2.482 10 10 CECE COc1ccc(N2CCN(c3ccncc3C#N)CC2)cc1 399647862 LXMTVUBZKBJMAD-UHFFFAOYSA-N 294.358 2.288 10 10 CECE COC(=O)C1([C@@H](O)c2ccc3c(c2)CCCN3C)CC1 2164728106 OPVHSROHQNVDNY-AWEZNQCLSA-N 275.348 2.056 10 10 CECE CN(C)c1ccc(CNC(=O)/C=C\[C@@H]2CCCO2)cc1F 819196306 QRDSBCIEWWRDHI-WOLRVDTOSA-N 292.354 2.243 10 10 CECE Oc1cc2c(cc1CN1CCC[C@@H](n3ccnn3)C1)CCC2 819896408 GNEXXVGIRHHQLT-MRXNPFEDSA-N 298.390 2.310 10 10 CECE CSc1c([C@@H](O)C(=O)O)ccc2c(O)csc12 725307685 HQKIQLBZMFQLNX-MRVPVSSYSA-N 270.331 2.447 10 10 CECE Cc1cc(Cl)cc(CNC2([C@H](C)O)CC2)c1O 827585806 QOEWUKZOLWUIHT-VIFPVBQESA-N 255.745 2.357 10 10 CECE Cc1cc(O)c(CN2CC[C@@H](O)C(F)(F)C2)cc1C 826958238 OUXUNQHBBBRBIV-CYBMUJFWSA-N 271.307 2.211 10 10 CECE COC[C@H](C)CN[C@@H]1CCN(c2ccc(OC)cc2)C1 826846446 URKSRRGTWJDQFS-ZIAGYGMSSA-N 278.396 2.146 10 10 CECE CNCc1ccc(N(C)Cc2cccnn2)cc1C 700700942 XIHQRHSNVNEFPU-UHFFFAOYSA-N 256.353 2.141 10 10 CECE COc1ccc(N(C)C[C@@H]2CNC[C@H]2C)cc1F 903439769 OGFWOIVFHFHMGW-MNOVXSKESA-N 252.333 2.126 10 10 CECE CN(C)c1ccc(CNC[C@@H]2CNCCC2(F)F)cc1 903955487 STIANXNHTKXPCP-ZDUSSCGKSA-N 283.366 2.087 10 10 CECE CN(C)c1ccc(/C=C\CNCC(C)(C)OCCO)cc1 835052603 HQSKAQHYKHICSV-WAYWQWQTSA-N 292.423 2.143 10 10 CECE CN(C)c1ccc(/C=C\CNCc2ccn(C)n2)cc1 835040210 BRYYVQNKGMWOFW-PLNGDYQASA-N 270.380 2.289 10 10 CECE Cc1ccc(C(=O)N2CCO[C@H](C3CCC3)C2)c(O)c1O 840492025 QTPMAKLFDLKPQH-ZDUSSCGKSA-N 291.347 2.047 10 10 CECE O=C(c1cc(O)cs1)N1CCC[C@@H]([C@@H]2CCOC2)C1 749296937 IJEIFDSNLQICEB-GHMZBOCLSA-N 281.377 2.342 10 10 CECE Cc1cc(O)c(CN2CCC[C@@H](N)C2)c(Cl)c1 843047710 XJRZFZNPJQBWKE-SNVBAGLBSA-N 254.761 2.277 10 10 CECE CO[C@@](C)(CNC(=O)NCc1c(O)cccc1F)C1CC1 922554003 APOBUXJEJJOQDL-HNNXBMFYSA-N 296.342 2.146 10 10 CECE Cc1ccn([C@H](C)CC(=O)NCCc2ccc(N)cc2)n1 851632744 WEXRIXZAGRWDKZ-CYBMUJFWSA-N 286.379 2.084 10 10 CECE COc1ccc(N2CC[C@H](NCc3conc3C)C2)cc1 850346722 IPGULCQTCHOALN-AWEZNQCLSA-N 287.363 2.360 10 10 CECE CC[C@H](NC[C@@H]1COCCN1C)c1cc(Cl)ccc1O 858522829 IHGAIRJYPPZJLL-OCCSQVGLSA-N 298.814 2.417 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@H](O)CC2(C)C)c(F)c1 1880491067 SZNDZHQSDAJXLM-WCBMZHEXSA-N 271.307 2.368 10 10 CECE C[C@@H]1CC[C@](CO)(NCc2ccc3c(c2)CCO3)C1 1880889774 MQFPNLSLUOONED-WBMJQRKESA-N 261.365 2.262 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)C2CC(O)C2)c(F)c1 1880963148 SABLXDOAEIWMLH-PUSIOWJLSA-N 270.323 2.205 10 10 CECE CN[C@@H](C)c1ccc(N2CCCCC[C@@H]2CO)cc1O 133688424 SVHYYPSVIDEFQL-GXTWGEPZSA-N 278.396 2.414 10 10 CECE COc1cccc(O)c1CNC[C@@H]1CC[C@H](C2CC2)O1 897511723 PCICEUHYYRPTOQ-SWLSCSKDSA-N 277.364 2.448 10 10 CECE Cc1ccc([C@H](C)NCCCOC(=O)N(C)C)c(O)c1 1964505943 ANAZMEDGJXANRV-LBPRGKRZSA-N 280.368 2.440 10 10 CECE CCN1CCc2cc([C@H](N)c3nc(C)ns3)ccc21 1889018956 XUAUATGANIMQGU-ZDUSSCGKSA-N 274.393 2.277 10 10 CECE CC(C)(C)[C@](C)(O)CNCc1cc(F)ccc1O 1964604927 ILLPBGHAAAXHSH-CQSZACIVSA-N 255.333 2.418 10 10 CECE CCCCOC(=O)CN[C@@H](C)c1ccccc1O 879652353 YUKHYUFSMLPART-NSHDSACASA-N 251.326 2.386 10 10 CECE CC(C)(C)[C@]1(C)NC(=O)N(Cc2ccc(N)cc2)C1=O 57848779 OAVFYYBIWMJGAG-OAHLLOKOSA-N 275.352 2.125 10 10 CECE Oc1cc(Cl)ccc1CNCCc1cnccn1 1963623487 BDJWRRLMLHWIDL-UHFFFAOYSA-N 263.728 2.168 10 10 CECE COC(=O)c1cnccc1NCc1ccc(N)cc1 83420168 HWLNUTIHGFBDGF-UHFFFAOYSA-N 257.293 2.063 10 10 CECE CC(C)N[C@H]1CCN(C)c2cc3c(cc21)OCCO3 84143202 UWTMZDWVHHSBSW-LBPRGKRZSA-N 262.353 2.337 10 10 CECE Nc1ccc(CN2CC3(C(=O)O)CCC2CC3)cc1 1891475026 VYBXKVXMBMLOPC-UHFFFAOYSA-N 260.337 2.098 10 10 CECE C[C@@H]1C[C@@H](C)[C@@H](C(=O)O)N(Cc2ccc(N)cc2)C1 1891938629 XSQQGUHBPNNABO-GYSYKLTISA-N 262.353 2.200 10 10 CECE Cc1n[nH]c(C)c1C[C@H](C)C(=O)N1Cc2cccc(O)c2C1 1329667712 QKQNOHYUNDTJOF-JTQLQIEISA-N 299.374 2.453 10 10 CECE CCC[C@@H](C(=O)O)N(C)Cc1ccc(C)cc1O 1964723207 CPWUWRCBRHHMNK-LBPRGKRZSA-N 251.326 2.386 10 10 CECE Oc1ccc(F)cc1CNC[C@H]1C[C@@]12CCCOC2 1894134891 MQJNTPCKESOBEZ-IUODEOHRSA-N 265.328 2.438 10 10 CECE COc1cccc(CNC2CCC(C)(O)CC2)c1O 705812139 GHLTUJJDRQPSCW-UHFFFAOYSA-N 265.353 2.184 10 10 CECE C[C@]12CCCC[C@H]1CN2C(=O)COc1ccc(N)cc1 706462926 MVBFJXARLHENLY-LRDDRELGSA-N 274.364 2.439 10 10 CECE NC[C@H]1CCCN1Cc1c(O)cccc1Br 706851983 DWUHGXSOAVCCQO-SECBINFHSA-N 285.185 2.078 10 10 CECE C[C@H](c1ccco1)N(C)c1ccc2c(c1)NC(=O)[C@H]2N 707164686 BAPYOBCXPPNVKD-OTYXRUKQSA-N 271.320 2.429 10 10 CECE CCN(CCN(C)C)c1ccc([C@@H](C)O)cc1F 688227353 KCLVFKKEUPDWJI-LLVKDONJSA-N 254.349 2.267 10 10 CECE CCN(Cc1ccoc1)S(=O)(=O)Cc1ccc(N)cc1 688488871 OGXMGKWHWKOUPC-UHFFFAOYSA-N 294.376 2.214 10 10 CECE CNC1C[C@@H]2CC[C@H](C1)N2c1ccc(CN(C)C)cc1 689445757 XMJLUOOOOSIICF-ZXFUBFMLSA-N 273.424 2.467 10 10 CECE CN(C[C@@H]1CCC[C@H]1O)c1ccc(CN)c(Cl)c1 689786315 SHPORIGCTQSGGC-SMDDNHRTSA-N 268.788 2.396 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CCCN2CCSC[C@@H]12 720409854 SXOXVZTYGGZXBL-KGLIPLIRSA-N 296.411 2.201 10 10 CECE CO[C@H]1CCC[C@H](OC(=O)COc2ccc(N)cc2)C1 70323035 AICNISWNVJLECJ-KBPBESRZSA-N 279.336 2.148 10 10 CECE CN(C)c1ccc(CN(CC(=O)O)CC(F)(F)F)cc1 92444272 MTKTWZVAURIVDP-UHFFFAOYSA-N 290.285 2.202 10 10 CECE CCN[C@@H](C)c1ccc(N2CCOC[C@@H]2C)cc1O 93670437 QQWOQXULSIWLDN-RYUDHWBXSA-N 264.369 2.288 10 10 CECE CC[C@@H]1CN(Cc2cnc(SC)s2)[C@H](C)CN1 2248694900 VYBVVEFRZZMLOJ-NXEZZACHSA-N 271.455 2.437 10 10 CECE C[C@H]1CN(CCc2ccc(N)cc2)CC[C@@H]1CCO 2115816967 DXPXIJKWZYPHMV-DZGCQCFKSA-N 262.397 2.152 10 10 CECE CN(Cc1cc(Cl)ccc1O)C[C@]1(C)COCCO1 2117637456 CIHGNSDBEQYLBN-CQSZACIVSA-N 285.771 2.283 10 10 CECE CCN(CC)c1ccc(CNC[C@@H]2C[C@@H]2CO)cc1 2117656738 KQNUZQKFRLDUIR-LSDHHAIUSA-N 262.397 2.251 10 10 CECE COC(=O)c1ccc(CN(C)CCCN=[N+]=[N-])cn1 2120206856 BVJPYLLQBHMJJD-UHFFFAOYSA-N 263.301 2.000 10 10 CECE O=C(N[C@@H](CCO)c1ccccc1F)c1cc(O)cs1 1469373739 GGUWMSQXKSARQS-LBPRGKRZSA-N 295.335 2.446 10 10 CECE CC1(CF)CN(c2cc3c(cc2Cl)[C@@H](N)C(=O)N3)C1 2121623542 KXNSIWYVFOXXEY-LLVKDONJSA-N 283.734 2.088 10 10 CECE C[C@]1(O)C[C@H]2C[C@H]1C[C@H]2NCc1cccc(F)c1O 2121704791 CMUBUUBJFWFLOH-OICBVUGWSA-N 265.328 2.170 10 10 CECE Cc1nn(CCCc2ccc(N)cc2)cc1C(=O)O 2123097526 KMPBQXGRYYMPSX-UHFFFAOYSA-N 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2.164 10 10 CECE C[C@@H](C[C@@H](C)C(=O)O)C(=O)N(C)Cc1ccccc1O 2176682081 JZFJUXNINPBPHG-WDEREUQCSA-N 279.336 2.098 10 10 CECE Cc1cc(N(C)C[C@@H]2COC(C)(C)CO2)ccc1CO 2176652349 JISDHGFBPCTLHU-OAHLLOKOSA-N 279.380 2.118 10 10 CECE CN1CCCc2cc([C@]3(O)CCNC34CCC4)ccc21 2177298070 NUDBEWPGGPJJHX-QGZVFWFLSA-N 272.392 2.173 10 10 CECE NCc1cc(F)c(N2CCC[C@@]3(CCOC3)C2)c(F)c1 2171158016 LKHKVTJXRQBKAQ-OAHLLOKOSA-N 282.334 2.430 10 10 CECE COc1ccncc1CN(C)c1ccc(CN)c(C)c1 2177473994 ZQPBMKXRTJNCQZ-UHFFFAOYSA-N 271.364 2.494 10 10 CECE COCc1c(C(=O)OC)oc2cc(OC)c(OC)cc12 2181945026 XZMWRNXPLMTNFW-UHFFFAOYSA-N 280.276 2.383 10 10 CECE Oc1ccccc1CN1CCO[C@@H]([C@@H]2CCCOC2)C1 2171684778 NSIRDAUSNOEALK-GDBMZVCRSA-N 277.364 2.020 10 10 CECE CN(CCC(C)(F)F)CC(=O)N(C)c1ccc(N)cc1 2171900694 KCHRSMPTTXRLLG-UHFFFAOYSA-N 285.338 2.209 10 10 CECE CCCNCc1ccc(N2C[C@@H]3[C@H](CO)[C@@H]3C2)cc1C 2182047525 GRPYXSFGZVOXRT-BJWYYQGGSA-N 274.408 2.169 10 10 CECE CO[C@@H]1C[C@@H]2[C@@H]1CCN2c1ccc(C[C@@H](C)N)c(C)c1 2178287603 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274.408 2.492 10 10 CECE CN1C[C@@H]2CN(c3ccc4c(c3)CC[C@@H]4O)C[C@]2(C)C1 2184734029 OBZULLHRUNIEEH-COXVUDFISA-N 272.392 2.054 10 10 CECE CN[C@@H]1CCc2cc(N3CCC(CCO)CC3)ccc21 2184727377 UWILHRBGLWWAIQ-QGZVFWFLSA-N 274.408 2.492 10 10 CECE Cc1cccc(O)c1CNC[C@H]1C[C@H](n2cncn2)C1 2184868689 ANBYBMXYACNBSM-JOCQHMNTSA-N 272.352 2.033 10 10 CECE CC1(C)C[C@@](C)(CO)CN1c1c(F)cc(CO)cc1F 2199544168 DHFATFYWUGJKNG-OAHLLOKOSA-N 285.334 2.444 10 10 CECE CN(C(=O)CCc1ccc(N)cc1)[C@H]1C2C[C@@H]3C1[C@@H]3C2 2190913708 SENBNTPDCRXUAP-SEDGWBOWSA-N 270.376 2.314 10 10 CECE C[C@@H]1CCc2ccccc2[C@]1(NCCN=[N+]=[N-])C(=O)O 2185415669 ACWYSRGQHTYUGE-YGRLFVJLSA-N 274.324 2.449 10 10 CECE CNCc1ccc(N2C[C@H]3CCC[C@@](CO)(C3)C2)cc1 2199677146 VNGSYAZMTZIEBA-DOTOQJQBSA-N 274.408 2.395 10 10 CECE C[C@@H]1CC[C@@H](CC(=O)N2CCC[C@@H](N=[N+]=[N-])C2)O1 2042883381 LCCDZSUOOAEJKQ-MXWKQRLJSA-N 252.318 2.245 10 10 CECE CN1CCc2cc([C@H](O)C(=O)C[C@H]3C[C@H]3CF)ccc21 2191451845 YESQFQIAIWWIKC-WWGRRREGSA-N 277.339 2.277 10 10 CECE CCOc1ccc(N(C)[C@H](CN)C(F)(F)F)cc1 2044341731 FEALCFJKDKYMSY-LLVKDONJSA-N 262.275 2.411 10 10 CECE CN(c1ccc(CN)cc1)[C@@H](C(=O)O)C(C)(C)C 2044358640 MSEKAQQMYXOWQR-LBPRGKRZSA-N 250.342 2.081 10 10 CECE C[C@@H]1C[C@@H](C)N(C(=O)Nc2ccc(N)cc2)C[C@@H]1CN 2191529070 KRMFROOQGISWHR-UTUOFQBUSA-N 276.384 2.106 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@H](O)C2)c(F)c1 2050101299 RAAVKFMEJZUDRZ-JQWIXIFHSA-N 253.317 2.230 10 10 CECE C[C@@H](O)c1ccc(N2CCCC[C@@H](O)C2)c(F)c1 2050105144 RAAVKFMEJZUDRZ-ZYHUDNBSSA-N 253.317 2.230 10 10 CECE NC[C@@H]1C[C@H]2CC[C@H]1N2Cc1c(O)cccc1Cl 2053972566 NGYMXAIHYAKFTN-OPQQBVKSSA-N 266.772 2.357 10 10 CECE CN(C[C@H]1OCC[C@@H]1F)c1ccc(CN)cc1Cl 2058677366 URXBBFXYGIAAPH-WCQYABFASA-N 272.751 2.362 10 10 CECE COC[C@H](C)CCOC(=O)CCOc1ccc(N)cc1 2187431450 YZOMRMKUNVQQNQ-GFCCVEGCSA-N 281.352 2.254 10 10 CECE CNCc1c(F)cncc1N(C)Cc1ccccc1O 2192594242 OTICBWUYFBUYRD-UHFFFAOYSA-N 275.327 2.282 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@H](C)c2nnc(CO)s2)c1 2192612006 VPXPUJOYSHUVJT-NXEZZACHSA-N 293.392 2.456 10 10 CECE C[C@H](NC(=O)CC[C@H]1CCCCN1)c1ccccc1O 2192621757 GIVANEASWFIXNM-QWHCGFSZSA-N 276.380 2.492 10 10 CECE C[C@H](NC(=O)C[C@@H]1CCCN(C)C1)c1ccccc1O 2192611482 OKOYTWLQGQIFCP-STQMWFEESA-N 276.380 2.301 10 10 CECE C[C@@H](NC(=O)[C@@H]1CC(C)(C)CCN1)c1ccccc1O 2192630986 CSWXUHWHDWYSOE-YPMHNXCESA-N 276.380 2.348 10 10 CECE C[C@H](NC(=O)[C@]1(CN)CC12CCC2)c1ccccc1O 2192629110 QXLWKBSWHNCMCU-MEDUHNTESA-N 274.364 2.089 10 10 CECE [N-]=[N+]=NCCN[C@@H](C(=O)O)C1CCC2(CC1)CC2 2062791850 NAKCUXVZLYDPBJ-SNVBAGLBSA-N 252.318 2.310 10 10 CECE CC(C)[S@](=O)(=NCCCCN=[N+]=[N-])[C@@H]1CCNC1 2063261415 XUYAJTNOCQXYOS-ADLMAVQZSA-N 273.406 2.315 10 10 CECE CC[C@H]1C[C@H]1CN(C)CC(=O)N(C)c1ccc(N)cc1 2200029787 MAQPGJOSJSTATF-STQMWFEESA-N 275.396 2.210 10 10 CECE CC1CC(CO)(CNCc2cc(F)ccc2O)C1 2065462161 PTGHZHFTBCEHTJ-UHFFFAOYSA-N 253.317 2.030 10 10 CECE NCc1ccc(N2CC[C@@H](O)[C@H]2C2CC2)cc1Cl 2067012210 MEIHREDBSRCSMA-ZIAGYGMSSA-N 266.772 2.148 10 10 CECE CN1C[C@H](N(C)CCCCN=[N+]=[N-])CCCC1=O 2068203355 AMDWBWRUOUTRSC-LLVKDONJSA-N 253.350 2.020 10 10 CECE NCc1ccc2c(c1)CCN2CCOC(F)(F)F 2069539983 QTJUSDGMNPZYAV-UHFFFAOYSA-N 260.259 2.044 10 10 CECE C[C@@H](O)c1ccc(N(C)C2(CCO)CC2)c(F)c1 2069687476 BKJMOTWAONZHJP-SNVBAGLBSA-N 253.317 2.230 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CCN(C)C(=O)C2)c(Cl)c1 2188483542 HYZCWFRGGUAHQA-JQWIXIFHSA-N 295.814 2.417 10 10 CECE COC(=O)[C@@H](C)[C@@H](C)N(C)Cc1ccccc1O 2072449946 FJOWNGSKKIQDLC-WDEREUQCSA-N 251.326 2.022 10 10 CECE C[C@H](NC[C@]12C[C@H](CO1)C2)c1cc(F)ccc1O 2073821791 WNCNBIHQOATKBZ-PKFCDNJMSA-N 251.301 2.361 10 10 CECE Cc1nsc(CN2CCCc3cc(CN)ccc32)n1 2102677825 ANDKDCXTFBASPL-UHFFFAOYSA-N 274.393 2.258 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(CC23COC(CF)(C2)C3)C1 2082656380 ZOUBRAQAEUYYKL-VOMCLLRMSA-N 254.309 2.137 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3CCC[C@@]3(CO)C2)cc1 2103170599 DOWCMMUCHCTBDY-NOLJZWGESA-N 260.381 2.305 10 10 CECE Cc1ccc(CNCCc2nnc(C)s2)c(O)c1 2084078822 HQUZKVJDSFGTOS-UHFFFAOYSA-N 263.366 2.193 10 10 CECE COc1cccc(O)c1CNC1CCC(OC)CC1 2104434935 XNMBLMNPRAGNIX-UHFFFAOYSA-N 265.353 2.448 10 10 CECE C[C@@H]1CC[C@H](CCOC(=O)Cc2ccc(N)cc2)O1 2104827440 VCYGWHHUZHFLEN-BXUZGUMPSA-N 263.337 2.312 10 10 CECE CN1CCc2cc([C@@H](N)[C@H](O)CCC3CC3)ccc21 2106854340 BWVHLJTYODIXFN-HZPDHXFCSA-N 260.381 2.230 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)c1cnccn1 2106827698 FXIMMAIXZTXRII-HNNXBMFYSA-N 255.321 2.159 10 10 CECE CN(C)c1ccc([C@H](N)[C@@]23COC[C@@H]2C3(F)F)cc1 2106800357 GUBWWPYHIZJLLC-RWMBFGLXSA-N 268.307 2.034 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@@H]2C[C@@H](F)CN2)cc1 2106833396 JZPLECROEOQTQC-VHDGCEQUSA-N 266.360 2.266 10 10 CECE CCO[C@@H](C)[C@@H](NN)c1ccc(N2CCCC2)cc1 2106825909 NZJYAQUSXHKOPW-SWLSCSKDSA-N 263.385 2.216 10 10 CECE CCN(CC)c1ccc([C@H](O)[C@H]2[C@H]3CN[C@H]2C3)cc1 2106831717 TUDCJXYIIKCJQX-OEAJRASXSA-N 260.381 2.174 10 10 CECE CC[C@H]1CCNC[C@H]1NCc1ccc2c(c1)CCO2 2107384057 WSHAXKPFMZBSPY-DZGCQCFKSA-N 260.381 2.099 10 10 CECE C[C@H]1OCCO[C@@H]1CN(C)Cc1cc(Cl)ccc1O 2087371866 OIRYJVAWLPUQGO-QMTHXVAHSA-N 285.771 2.281 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@H]2C[C@H](N)C[C@H]1C2 2088296304 GZQPDYCQWRDKIV-XRRVDJEJSA-N 264.344 2.404 10 10 CECE COC(=O)C1([C@H](O)c2ccc(N(C)C)cc2)CCC1 2108472132 PELUOZGXLQHOCG-CYBMUJFWSA-N 263.337 2.129 10 10 CECE CC[C@@]1(CNCc2cc(OC)ccc2O)CCCO1 2090719823 GFDAXJRKITZLBR-HNNXBMFYSA-N 265.353 2.450 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]2CO)cc1C(F)(F)F 2092556448 WZCZNTYCMHHFKV-PSASIEDQSA-N 274.286 2.296 10 10 CECE Cc1cc(N2CC=CC[C@]23CCOC3)ccc1CO 2093631495 QIZVZPOOCNKRJI-MRXNPFEDSA-N 259.349 2.413 10 10 CECE CC1(C)CC=CCN1CC(=O)Nc1ccc(N)cc1 2093631482 QCPFMDAKIAIHTA-UHFFFAOYSA-N 259.353 2.248 10 10 CECE C[C@H](N)c1ccc(N2CCCN(C)CCC2)c(F)c1 2096283779 OSRIQWOHHCIOGM-LBPRGKRZSA-N 265.376 2.377 10 10 CECE Cc1c(CN(C)c2ccc([C@H](C)O)cc2)cnn1C 2096581921 NNTZFJDMUOHIJO-LBPRGKRZSA-N 259.353 2.418 10 10 CECE CNCc1ccc(N(C)[C@H]2CCN(C)C[C@@H]2C)cc1 2113999327 OPNOKEOFEOAOBX-BBRMVZONSA-N 261.413 2.182 10 10 CECE N[C@@H]1CC[C@]2(CCO2)C[C@@H]1Sc1nccs1 2211181106 VUZYESQYRHIPIS-YWVKMMECSA-N 256.396 2.274 10 10 CECE Cc1c(F)cccc1CNC(=O)c1cccc(O)c1O 2202897355 HGDZPXMJXKUVIT-UHFFFAOYSA-N 275.279 2.475 10 10 CECE COc1ccc(N2C[C@H](N)C[C@]23CCCOC3)cc1Cl 2203009796 JAAPWXCASBTOMB-ABAIWWIYSA-N 296.798 2.435 10 10 CECE CC[C@H](CO)N(C)c1ccc(CNC(C)C)c(OC)c1 2204556280 ZRMJSHODDSDIKV-CQSZACIVSA-N 280.412 2.400 10 10 CECE CNCc1ccc(N2CCCC[C@@H]2[C@H](C)O)cc1OC 2204545408 OTHQFFFEJKEYQA-SWLSCSKDSA-N 278.396 2.154 10 10 CECE Nc1ccc(CN=c2[nH]nc([C@H]3CCCCO3)s2)cc1 2205038016 LQPXOJZYIPTZKN-GFCCVEGCSA-N 290.392 2.396 10 10 CECE Cc1ccc([C@H](C)N[C@H]2CCC[C@@H]2S(C)(=O)=O)c(O)c1 2205996288 MDUIRRZPJPWYFC-WHOFXGATSA-N 297.420 2.317 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@H]2COC3(CCC3)C2)C1 2269333928 OYBCCPYOAFQHNC-MNOVXSKESA-N 264.329 2.247 10 10 CECE Nc1ccc(NC(=O)N[C@H]2C[C@H]3COC[C@H](C3)C2)cc1 2206785283 JDTYVSXGOYTNLL-GNXNZQSNSA-N 275.352 2.205 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1cc(Cl)ncn1 2218739489 FXPSAWVEYZPJRE-RQJHMYQMSA-N 266.692 2.091 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1scc(C)c1C 2218803746 SZNCEUSOIRUBLD-SECBINFHSA-N 268.342 2.479 10 10 CECE COc1ccc(N(CCO)C2CCC2)c(F)c1F 2219762499 PTHPBAHFSOOPRI-UHFFFAOYSA-N 257.280 2.325 10 10 CECE C[C@@]1(C(=O)O)C=CCCN1Cc1c(O)cccc1F 2230945074 DVQCICCGFUZJOU-AWEZNQCLSA-N 265.284 2.137 10 10 CECE CC[C@@H](C)NCc1ccc(N2CC([N+](=O)[O-])C2)cc1 2231462599 GFAPRNMRNFPNRB-LLVKDONJSA-N 263.341 2.040 10 10 CECE Cc1cc([C@H](C)O)ccc1N1C[C@@H]2CC[C@@]2(CO)C1 2232094594 UPYFLWNMWJYKAH-NOLJZWGESA-N 261.365 2.257 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC[C@@H](CN(C)C)C1 2232021428 CABFCRXIPWMJPQ-KGLIPLIRSA-N 261.413 2.403 10 10 CECE N[C@@H]1CCCc2cc(N3CC[C@@H]4[C@@H](O)C[C@@H]4C3)ccc21 2232886907 GXEIPHSOIOYOIB-ZFVVBOAOSA-N 272.392 2.230 10 10 CECE COc1cc(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])cc(C)n1 2234176679 MODTUSOUKFXADA-MNOVXSKESA-N 275.312 2.360 10 10 CECE COc1ccc(O)c([C@@H](C)NC[C@H]2CO[C@H]3C[C@@H]2C3)c1 2234717245 ZZPLLROMUXKYQK-NMKXLXIOSA-N 277.364 2.476 10 10 CECE OC1([C@H]2CCCCN2c2ccc3c(c2)OCCO3)CC1 2235107878 HBXNNYLKHAZJRA-OAHLLOKOSA-N 275.348 2.342 10 10 CECE COc1ccc(N2CCC(O)(CN(C)C)CC2)cc1Cl 2235232038 YRYZRFWTKCDIKS-UHFFFAOYSA-N 298.814 2.242 10 10 CECE COc1cc(CNCc2ccc(O)c(O)c2)ccc1O 2235309111 VVNICVFZCBKGTG-UHFFFAOYSA-N 275.304 2.102 10 10 CECE COc1ccc(N(C)[C@@H]2CCOC[C@@H]2C)c(CCN)c1 2235976255 CZRZVKMHQFCRBW-SWLSCSKDSA-N 278.396 2.058 10 10 CECE C[C@H](O)[C@@H]1CCCCN1c1ccc2c(c1)COCC2 2226706741 FKFMDRGJCRSKCQ-LRDDRELGSA-N 261.365 2.499 10 10 CECE C[C@@H]1OC[C@](Oc2ccc(N(C)C)cc2)(C(=O)O)[C@@H]1C 2237681390 ZOOSRKXDJVSJDS-JRPNMDOOSA-N 279.336 2.010 10 10 CECE CCN(c1ccc(OC)cc1CCN)[C@@H](C)COC 2227682102 NAUNWPBDQJHDGP-LBPRGKRZSA-N 266.385 2.058 10 10 CECE COc1ccc(N2CCC(F)(F)C2)c(C[C@@H](C)N)c1 2227683161 LWLRSEJHIAFFSO-SNVBAGLBSA-N 270.323 2.430 10 10 CECE COc1ccc(N2C[C@@H](C)C[C@@H](OC)C2)c(CO)c1 2227679973 QCNNFNSJIBSMHB-SMDDNHRTSA-N 265.353 2.049 10 10 CECE COc1ccc(N2C[C@@H](C)C(F)(F)C2)c(CCN)c1 2227683091 KZOJXYSLHKKULW-SNVBAGLBSA-N 270.323 2.288 10 10 CECE CO[C@H]1CC[C@H]1CN(C)c1ccc(CCN)c(C)c1 2227844180 KRTBPPDVXWWQBZ-HOCLYGCPSA-N 262.397 2.357 10 10 CECE COc1cc(N2CCC(OC(F)F)CC2)ccc1CO 2238878880 SOCPVHGGTBCMLO-UHFFFAOYSA-N 287.306 2.396 10 10 CECE CP(C)(=O)[C@H](O)CN(Cc1ccc(N)cc1)C1CC1 2228901144 GHUAGEKMAJYBQV-AWEZNQCLSA-N 282.324 2.174 10 10 CECE Cc1cc(CN)ccc1N(C)C[C@@H](F)[C@H]1CCOC1 2229991511 AZOXYKUENUSNSX-UONOGXRCSA-N 266.360 2.265 10 10 CECE O[C@H]1CCN(c2c(F)cc(CNC3CCC3)cc2F)C1 2240030323 CDTFFVBLPBIUKP-LBPRGKRZSA-N 282.334 2.178 10 10 CECE Cc1cc(CNC2CCC2)ccc1OCCS(C)(=O)=O 2240246404 ZJYNGYOFOMKBGI-UHFFFAOYSA-N 297.420 2.061 10 10 CECE CN[C@H](C)c1ccc(N2CC(F)(F)C[C@@H]2CO)c(C)c1 2240829829 OBGRPTJLVRUHSH-DGCLKSJQSA-N 284.350 2.482 10 10 CECE COCC(COC)CN(C)c1ccc([C@@H](C)O)cc1C 2240834347 YWAWOUJNKQAWLN-CYBMUJFWSA-N 281.396 2.394 10 10 CECE Nc1ccc(O)c(CN2C[C@H](O)CC23CCCCC3)c1 2241043513 CJDLRDAYXKVTFX-CQSZACIVSA-N 276.380 2.244 10 10 CECE CCOC(=O)CCSCCc1ccc(N)cc1 2247589792 YRYSJWANVBTIEE-UHFFFAOYSA-N 253.367 2.498 10 10 CECE CSc1ncc(CNC[C@](C)(N)CC(F)F)s1 2248736654 PCDHCMZYZAFRQW-SNVBAGLBSA-N 281.397 2.327 10 10 CECE CC(C)CN(C[C@H](C)O)c1ccc(CN)c(F)c1F 2272408254 NEYATBCTXNCBIS-JTQLQIEISA-N 272.339 2.267 10 10 CECE C[C@@H](CO)CC1CN(c2ccc(OCF)cc2)C1 2263854138 RLUQJOIUHZQGMB-LLVKDONJSA-N 253.317 2.447 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@@H](CC(C)C)C(N)=O)c1 2264459819 JGANQHUUNXXAOO-YPMHNXCESA-N 264.369 2.251 10 10 CECE COc1ccc(N2CC[C@H](O)C[C@@H]2C)c(OC)c1C 2277993809 LGNDSLHSDVJCGP-JQWIXIFHSA-N 265.353 2.362 10 10 CECE OC[C@@]12CC[C@H]1CN(c1ccc(OC(F)F)cc1)C2 2278522919 CCJDPFPCEXJATM-HZMBPMFUSA-N 269.291 2.497 10 10 CECE Cc1cc(N(C)Cc2ccncn2)ccc1[C@H](C)N 2269652969 ZZVAJOBSKPQXCE-LBPRGKRZSA-N 256.353 2.441 10 10 CECE Cc1cc(N2C[C@@H]3C[C@H](CO)[C@@H]3C2)ccc1[C@@H](C)N 2269663097 PXAPAGDIKDWCLD-OQMKEHIESA-N 260.381 2.079 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@@H](CO)C2)cc1C 2269652322 VFLKEYPJNCFGHU-ZIAGYGMSSA-N 262.397 2.484 10 10 CECE COc1ccc(N2CC[C@@H](N)C(F)(F)C2)c(OC)c1C 2295438171 UBAJNAZTBONWBB-GFCCVEGCSA-N 286.322 2.185 10 10 CECE C[C@@H]1CCN(c2cc3c(cc2N)OCC(=O)N3)C1(C)C 2286907584 LYBPNAPIDDAQAC-SECBINFHSA-N 275.352 2.225 10 10 CECE CN(Cc1cccnc1O)c1c(F)cc(CO)cc1F 2288569816 DEDFMODGUPHZCX-UHFFFAOYSA-N 280.274 2.194 10 10 CECE CCCN(c1ccc(N)cc1)C(=O)[C@]12COC[C@H](C1)C2 2288718365 JAZIFSRMYDFVKH-YGUOUDRMSA-N 274.364 2.438 10 10 CECE CCc1nsc(CN(C)c2ccc(CN)c(OC)c2)n1 2288839386 JYMHSZMDQBKQGW-UHFFFAOYSA-N 292.408 2.204 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CCO[C@H]3C[C@H]32)c1O 368325478 AEISXJSWRRGICH-OLZOCXBDSA-N 281.739 2.221 10 10 CECE CS[C@H]1C[C@H](C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2299298451 JSONHQVUYTWYDN-OPRDCNLKSA-N 254.359 2.429 10 10 CECE COCCNCc1ccc(N2CCSC2)c(F)c1 2320264235 VJOMZNCFQAWGFX-UHFFFAOYSA-N 270.373 2.072 10 10 CECE CSc1cc(N2CC[C@H]3COC[C@@H]32)ccc1CN 2328537115 WIWGQPMNOLKTJD-AAEUAGOBSA-N 264.394 2.092 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@@H]2NCc1cc(F)ccc1O 2329221395 AGFQMUBYINGJOS-FRWLMAKKSA-N 265.328 2.434 10 10 CECE CCN1CCc2cc([C@@H](NN)[C@@H]3C[C@H]3CF)ccc21 2332078035 FMCXWZDRJNHXFK-GZBFAFLISA-N 263.360 2.179 10 10 CECE CC[C@]1(C)[C@@H](O)CCN1c1ccc([C@@H](C)O)c(O)c1 2336867594 DHCPKQDYDZMEBL-WKPIXPDZSA-N 265.353 2.185 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@H]2CC[C@H]1C[C@@H]2O 2337149052 VFHHFNKAUZFEEC-UYHMYPTGSA-N 260.381 2.364 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc(CO)c(C2CC2)c1 2339145775 LWIKDIPBNVNCRO-BZNIZROVSA-N 261.365 2.406 10 10 CECE C[C@H]1CC[C@H](O)CN1c1ccc(CN)c(C2CC2)c1 2339158166 RLIMAVGYVDJWBA-NHYWBVRUSA-N 260.381 2.372 10 10 CECE Nc1ccc(CC(=O)N2CC[C@@H](SC(F)F)C2)cc1 2340180507 NTBLXGGFZPMMLX-LLVKDONJSA-N 286.347 2.368 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@H]4C[C@]3(CN)C4)ccc2O1 2340784340 IXWITDPPAGJNSZ-HSMVNMDESA-N 258.365 2.328 10 10 CECE Cc1c([C@H](C)O)ccc(N2CC[C@@H](O)[C@H](F)C2)c1C 2340857610 RKWBMBTYMXDVKU-NJZAAPMLSA-N 267.344 2.266 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C[C@@H]2C(C)C)cc1 2344614198 MBXKKZIIQXMNLI-JKSUJKDBSA-N 262.397 2.392 10 10 CECE COc1ccc(N(C)[C@H]2CNC[C@H](C(F)F)C2)cc1 2353492567 DKDWMGIJEQDCGS-ZYHUDNBSSA-N 270.323 2.375 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H]3CC[C@@H]2C[C@H]3CO)c(F)c1 2354260571 GVUMKPVIUCFZDQ-DNVSUFBTSA-N 278.371 2.456 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@@H]1C[C@@H]2C[C@H]1[C@H]1C[C@@H]21 2355303186 MVTCTWQAXXATIF-DUIQVVMOSA-N 273.332 2.214 10 10 CECE CN(C)c1ccc([C@H](N)[C@]2(O)C[C@@H]3C[C@H]2[C@H]2C[C@@H]32)cc1 2355314638 QVSAUTKCNBJCRJ-HAIXDDLGSA-N 272.392 2.159 10 10 CECE CC(C)(C)OC(=O)NC[C@@H]1CCN1c1ccc(N)cc1 1954672377 XAVBPKNGOGTVGS-ZDUSSCGKSA-N 277.368 2.372 10 10 CECE CCCC(=O)N[C@@H]1CCCN(Cc2ccccc2O)C1 179565805 OFONAKKJSHJINI-CQSZACIVSA-N 276.380 2.273 10 10 CECE COC[C@@H](O)CN(C)c1ccc(CNC(C)(C)C)cc1C 50562037 VBCFEJSQSHGXES-HNNXBMFYSA-N 294.439 2.327 10 10 CECE CC1(C)[C@H]2CC[C@@]1(C(=O)Oc1ccccc1)C(=O)C2=O 101104472 MRHFPAXGERKXBB-ZBEGNZNMSA-N 272.300 2.166 10 10 CECE C[C@@H](Cn1ccnc1)NCc1ccc2c(c1)CCCN2C 50286645 XKOWLIJJWAWPJT-AWEZNQCLSA-N 284.407 2.444 10 10 CECE C[C@@](N)(CC(=O)O)c1cc(Cl)cc(Cl)c1O 309149170 FCMRCLMMPUUHEF-SNVBAGLBSA-N 264.108 2.348 10 10 CECE CNCc1ccc(N(C)[C@H]2C[C@H]3[C@@H]4CC[C@@H](O4)[C@@H]23)cc1 2356959601 UOJLIQGFDXLHST-SMLCLMEVSA-N 272.392 2.408 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCC[C@H]1CC(=O)O 300443506 WLWIFZUMTKGJPW-UWVGGRQHSA-N 265.309 2.098 10 10 CECE CC(C)N(CCNC(=O)CCc1ccc(N)cc1)C(C)C 37222537 OCFIROJGIAKTER-UHFFFAOYSA-N 291.439 2.436 10 10 CECE COc1cccc(CN[C@H](C)[C@H]2C[C@@H]3CCO[C@@H]32)c1O 2358117731 IROHRBPQWIZCOZ-WNCDQNTKSA-N 277.364 2.304 10 10 CECE CC(=O)c1ccc(O)c(CN(C)CCOC(C)C)c1 211595869 DLAVZSDNPCEJKR-UHFFFAOYSA-N 265.353 2.452 10 10 CECE CN1CCCc2cc(CN3CC[C@@H](CC(=O)O)C3)ccc21 227725135 PKVUFEOCOQGHCB-AWEZNQCLSA-N 288.391 2.366 10 10 CECE CCN(C[C@H]1CCCO1)[C@@H](CN)c1ccc(N(C)C)cc1 48953641 HAJNUNQGILKXPH-SJORKVTESA-N 291.439 2.253 10 10 CECE CC(C)[C@@](C)(O)CN[C@@H](C)c1cc(O)ccc1O 381264322 QBLJSOMDGKEKNU-HZMBPMFUSA-N 253.342 2.155 10 10 CECE Oc1cccc(CNc2cccnc2-n2cccn2)c1O 41117462 BMIYMOYSJCBSSB-UHFFFAOYSA-N 282.303 2.291 10 10 CECE C[C@@H](N)c1ccc(N2CCN(CC3CC3)CC2)cc1 48994180 RHNZRKSEPNSYJM-CYBMUJFWSA-N 259.397 2.238 10 10 CECE COCCOCc1cc(CNC(C)C)ccc1OC 50125779 ZLKFVNQCIGHLIF-UHFFFAOYSA-N 267.369 2.356 10 10 CECE COc1ccc([C@@H](C)N[C@H](C)CCCO)c(O)c1 94942349 ISLNSBQGNUITQR-GHMZBOCLSA-N 253.342 2.212 10 10 CECE CCN(CC)c1ccc(CN2CCC[C@@H]2C(=O)NC)cc1 92100014 RBTAHGIOUGPBHE-MRXNPFEDSA-N 289.423 2.243 10 10 CECE CCN(C[C@H]1CCCO1)[C@H](CN)c1ccc(N(C)C)cc1 249811082 HAJNUNQGILKXPH-IAGOWNOFSA-N 291.439 2.253 10 10 CECE CC[C@](C)(N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21)C(N)=O 383424099 DKJHZMNUUJLFBV-UVWXRNBGSA-N 276.380 2.493 10 10 CECE Cc1cc(N(C)C[C@H]2C[C@@H](O)C2)ccc1CNC1CC1 703821366 MJUGHKISWVGVAS-XFHMXUHZSA-N 274.408 2.454 10 10 CECE N[C@H](c1cc(Br)cc([N+](=O)[O-])c1O)C(F)F 383833385 RRBJKFYDIUKUDN-ZCFIWIBFSA-N 297.055 2.328 10 10 CECE CNC1(C(=O)O)CC(C)(CSc2nccs2)C1 2251464894 UXURUSGDADASDV-UHFFFAOYSA-N 272.395 2.078 10 10 CECE Cc1cc(Br)cc([C@@H]2COCC(=N)N2)c1O 396999393 LCVCRKMLTPUCQK-VIFPVBQESA-N 285.141 2.101 10 10 CECE CC1(C)CC=CCN(CC(=O)Nc2ccc(N)cc2)C1 2165839321 WCZVYDSUDXTPOU-UHFFFAOYSA-N 273.380 2.495 10 10 CECE N[C@@H]1C[C@]2([C@H](O)c3ccc(N4CCCCC4)cc3)C[C@@H]12 2163100136 ODJIWRNYXOFDCT-YLFCFFPRSA-N 272.392 2.448 10 10 CECE C[C@@H](NCCCN)c1cc(Br)c(F)cc1O 817938805 SQNZTSOPWQPCKZ-SSDOTTSWSA-N 291.164 2.293 10 10 CECE Cc1cc(O)c(CN2C[C@H](C)[C@@H](O)[C@H](C)C2)cc1C 827151742 IWGLLSWCQUIKOZ-VIKVFOODSA-N 263.381 2.458 10 10 CECE CCOc1ccc(CNC[C@H]2CCCC[C@@H]2O)c(O)c1 825035062 BFSLHKIXSZELBA-DOMZBBRYSA-N 279.380 2.432 10 10 CECE COC[C@@H](C)CNC[C@@H]1CCN(c2ccc(OC)cc2)C1 822494474 POQWOVLGPGYMBV-GJZGRUSLSA-N 292.423 2.394 10 10 CECE C/C=C\[C@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 900125905 ZKNGMRZVGOWAIZ-AWFCHZOYSA-N 288.391 2.181 10 10 CECE CN(Cc1ccccc1O)C(=O)C(=O)c1ccc(F)cc1 730110428 QBNITKKVXXMXIJ-UHFFFAOYSA-N 287.290 2.373 10 10 CECE CCOCCCCNC(=O)NCc1c(O)cccc1F 914240701 RBAHHOMHUFKWCG-UHFFFAOYSA-N 284.331 2.147 10 10 CECE C[C@@H]1CCN1C(=O)NCc1ccc(N2CC=CC2)cc1 741091879 HQLXNKYBTMSPGF-CYBMUJFWSA-N 271.364 2.367 10 10 CECE CN(C)c1ccc(/C=C/CNCCc2cncn2C)cc1 857783084 SGOREZVYOKJJJQ-SNAWJCMRSA-N 284.407 2.332 10 10 CECE CCCCOC(=O)NCCc1ccc(O)c(O)c1 168691963 KGIJBVLSQZGLNN-UHFFFAOYSA-N 253.298 2.167 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CN(C)C(C)(C)C2)cc1O 694145660 ZGCSGLUMVGOMQC-YPMHNXCESA-N 277.412 2.331 10 10 CECE CCc1ccc(N2CC[C@@H]2CNCCOC)cc1C 696360256 WCCDIHJDRFXTAT-MRXNPFEDSA-N 262.397 2.372 10 10 CECE Cc1cc(C)c(O)c(CN2CCc3nccnc3C2)c1 853605748 HEYDUQZNTYQYAW-UHFFFAOYSA-N 269.348 2.357 10 10 CECE CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc(N)cc1 867966647 TVJGRUREPBSAQH-RISCZKNCSA-N 278.352 2.039 10 10 CECE C[C@@H]1C[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H](C)O1 865051937 ZBGKMSNQZQQKHX-NQBHXWOUSA-N 294.370 2.321 10 10 CECE COC(=O)C1=CC[C@H](NCc2cc(C)ccc2O)C1 862465740 KWAJEJBYFRFFPQ-ZDUSSCGKSA-N 261.321 2.052 10 10 CECE COc1ccc(O)c(CN[C@@H]2CCNCC(C)(C)C2)c1 872251231 IGWIHQMLJWNVMW-CYBMUJFWSA-N 278.396 2.269 10 10 CECE C[C@H](NCc1ccc(F)c(F)c1O)c1ccn(C)n1 877585646 LASIENJIPCWFLP-QMMMGPOBSA-N 267.279 2.255 10 10 CECE CCN=c1cc(N[C@@H](C)c2ccccc2O)cn[nH]1 1877589435 MEZBFCYUYFPBRI-JTQLQIEISA-N 258.325 2.209 10 10 CECE C[C@@H]1C[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 784285537 AUZSKPXQFMDTHY-VWRYTFAISA-N 292.331 2.469 10 10 CECE C[C@@H](c1ccccc1O)N1C(=O)[C@H]2[C@@H](C1=O)C2(C)C 1877587412 ONVDIWKHDLTEKK-KPXOXKRLSA-N 259.305 2.094 10 10 CECE C[C@@H](NC(=O)C(C)(C)CCCN)c1ccccc1O 1877577529 CBWPACBGWHMSIN-LLVKDONJSA-N 264.369 2.335 10 10 CECE C[C@@H](NC(=O)[C@@H]1C2C[C@@H]3C1[C@@H]3C2)c1ccccc1O 1877584493 FLAQOYRPBCUTPF-OZXTWLHRSA-N 257.333 2.471 10 10 CECE CCN(Cc1noc(COC)n1)c1ccc(OC)cc1 780303968 ZPELRXLAGIPIQZ-UHFFFAOYSA-N 277.324 2.251 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCOCC2)c1 787445258 KMWRJAJCEYETCU-RYUDHWBXSA-N 293.363 2.395 10 10 CECE C[C@H](NC(=N)NCc1cc(Cl)ccc1O)C1CC1 899275861 IZYSWTWXNYBBKA-QMMMGPOBSA-N 267.760 2.458 10 10 CECE CN[C@@H]1CCc2cc(N3CCC[C@@H]3[C@H](C)O)ccc21 1879180419 CNRNVLGBLDKIKS-IUIKQTSFSA-N 260.381 2.243 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCN(C)C[C@H]2C)c(F)c1 1880485415 KMZPIOAXUPISQE-NXEZZACHSA-N 270.323 2.158 10 10 CECE CCN1CCN(c2c(F)cc([C@H](C)O)cc2F)CC1 1880486473 OMAMCQBHLBUCDV-JTQLQIEISA-N 270.323 2.160 10 10 CECE CC(C)(C)OC(=O)N1C[C@H]2CCN(CCN=[N+]=[N-])[C@H]2C1 1882913485 ASCSUSUVWGZRMI-MNOVXSKESA-N 281.360 2.238 10 10 CECE CC(C)(C)n1cc(CNCc2c(O)cccc2F)nn1 896637174 KFCVEQVSEMOCNE-UHFFFAOYSA-N 278.331 2.168 10 10 CECE Nc1ccc(CC(=O)NC[C@H]2C[C@@H]3CC[C@@H]3C2)cc1 1885918988 JMZOEOMNXNGGRL-ZSOGYDGISA-N 258.365 2.364 10 10 CECE Cc1ccc(C(=O)NCc2cccc(O)c2O)cc1O 1303193909 UMFLZPREBCHQGZ-UHFFFAOYSA-N 273.288 2.042 10 10 CECE CCOc1ncccc1C(=O)NCc1c(O)cccc1F 1303877529 FCWMJNSYWDSGQZ-UHFFFAOYSA-N 290.294 2.255 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1CCCC[C@@H]1O 83599842 CUFIQJSEGLBEST-AAEUAGOBSA-N 255.745 2.439 10 10 CECE Cc1ccc([C@@H]2NCCc3c(O)cc(O)cc32)c(O)c1 83598349 ZYOUGHANJMUUPC-INIZCTEOSA-N 271.316 2.347 10 10 CECE C[C@H](N[C@@H]([C@H](C)O)C(F)(F)F)c1c(O)cccc1O 1882723187 XYOUESFQDVFGKL-HFJPGXAFSA-N 279.258 2.060 10 10 CECE CC(C)(CNC(=O)OC(C)(C)C)CC(=O)NCCN=[N+]=[N-] 1963818654 XLTAHIYKEFVMJV-UHFFFAOYSA-N 299.375 2.354 10 10 CECE COC(=O)[C@]1(NCCCN=[N+]=[N-])CCC[C@H](C)C1 90259267 FOMKQQARTHFAFG-JQWIXIFHSA-N 254.334 2.398 10 10 CECE C[C@H](NCC[C@@H](C)CCO)c1c(O)cccc1O 397797778 VIJCBYNGLKEFBZ-MNOVXSKESA-N 253.342 2.157 10 10 CECE CC(C)(F)[C@](C)(F)C(=O)NCCc1ccc(O)c(O)c1 1964864904 XTMFZBXHDCDZJJ-CQSZACIVSA-N 287.306 2.233 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H](O)[C@H](CC)C2)cc1O 399962826 FQDNOMAEXFJHIK-XHBSWPGZSA-N 278.396 2.270 10 10 CECE OC[C@@H](NCc1ccc(F)c(F)c1O)c1ccccc1 703257410 PELZMMKOQKPWFA-CYBMUJFWSA-N 279.286 2.494 10 10 CECE C[C@@H]1N(c2c(F)cc(CO)cc2F)CCOC1(C)C 687922736 ONVSAJJFONQWLI-VIFPVBQESA-N 271.307 2.461 10 10 CECE COC[C@@H]1CN(c2ccc([C@@H](C)O)c(Cl)c2)CCO1 705825654 BBCDCJUXYGIVFW-PWSUYJOCSA-N 285.771 2.245 10 10 CECE O=C1Nc2cc(N3CCC[C@@H]3C3CC3)ccc2[C@H]1O 706446191 XBLGZZYNGRWYQT-ZIAGYGMSSA-N 258.321 2.051 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@]3(CCOC3)C2)cc1O 708273923 LSNMOOFTFLLLLM-LRDDRELGSA-N 276.380 2.289 10 10 CECE COc1cc(Cl)cc(CN2CC3(CCCNC3)C2)c1O 709996661 OLWHIMILCXBFTQ-UHFFFAOYSA-N 296.798 2.240 10 10 CECE Nc1ccc(CCC(=O)OC[C@@H]2CC2(F)F)cc1 691596998 PKFPSOPKICJBAR-JTQLQIEISA-N 255.264 2.400 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H]3[C@H](C2)C3(F)F)cc1O 715518112 CYSGMDOQCMCVEI-ONOSFVFSSA-N 255.264 2.147 10 10 CECE Cc1cnc(-c2noc(-c3sccc3O)n2)cn1 694825799 SOAWDOZKPFOXPJ-UHFFFAOYSA-N 260.278 2.269 10 10 CECE C[C@H]1CCN(c2c(F)cc(CO)cc2F)C[C@H](C)O1 694905902 PFRWAZJOWWNJHA-UWVGGRQHSA-N 271.307 2.461 10 10 CECE Cc1cc(CN(Cc2ccc(N)cc2)C2CC2)n(C)n1 89186066 WPELJIATTGBXOU-UHFFFAOYSA-N 270.380 2.475 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC[C@H](O)C2)cc1O 93670829 ZSYCGWALAMDFRJ-AAEUAGOBSA-N 264.369 2.024 10 10 CECE C[C@@H](CNC(=O)COc1ccc(N)cc1)C(C)(F)F 2115258907 LLAXVETVMDLDES-VIFPVBQESA-N 272.295 2.055 10 10 CECE C[C@H](N[C@@H]1CC[C@@]12C[C@H]2C(=O)O)c1ccccc1O 2115869373 BPZIJTMFFXJWJF-GVAXYQGFSA-N 261.321 2.296 10 10 CECE C[C@H]1CCCN(C(=O)[C@H](C)Oc2ccc(N)cc2)C1 1860081918 HRTNCVMTBWOOOA-RYUDHWBXSA-N 262.353 2.295 10 10 CECE CN(C)c1cccc(NC(=O)c2cc(N)ccc2O)c1 1866085405 ZPLZBENGZYYXEE-UHFFFAOYSA-N 271.320 2.293 10 10 CECE C/C(=C/C(=O)N(C)c1ncccc1F)c1cnccn1 1458101809 LXFWRKFPYHCAOY-NTMALXAHSA-N 272.283 2.077 10 10 CECE CCCNCc1ccc(N(C)CC(=O)O)c(OCC)c1 211979492 JDCQEXFAGPEQGA-UHFFFAOYSA-N 280.368 2.106 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@]1(O)C=CCC1 2119180154 SHMPHRFZPCNRLL-HZPDHXFCSA-N 258.365 2.368 10 10 CECE C[C@@H](F)COc1ccc(N2CCC[C@H](N)C2)c(F)c1 2120352632 WZYGCYJCVMESGP-MNOVXSKESA-N 270.323 2.490 10 10 CECE COC(=O)c1ccc(CN2CCC[C@H]2CN=[N+]=[N-])o1 2123016543 YQKVMZOOQAOGTF-VIFPVBQESA-N 264.285 2.341 10 10 CECE CCC[C@H](C)NC(=O)[C@@H](C)N1CCC[C@@H]1CN=[N+]=[N-] 2123021645 WNMNRRNOIUWJJM-QJPTWQEYSA-N 267.377 2.454 10 10 CECE CCNCc1ccc(N2CC3(CC[C@@H]3O)C2)c(Cl)c1 2123105460 GPEAZKKLJSJUKB-AWEZNQCLSA-N 280.799 2.411 10 10 CECE CSc1nccnc1C(=O)N(C)Cc1ccccc1O 1622317520 NVHPNAWDHQTXIU-UHFFFAOYSA-N 289.360 2.176 10 10 CECE CN(C)c1ccc(CNc2cnc(F)cn2)cc1F 1559085776 ZDYSQOIYHZXALD-UHFFFAOYSA-N 264.279 2.433 10 10 CECE Cc1cc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)ccc1N 105707859 YMQZSQYIOXGAPD-RYUDHWBXSA-N 258.321 2.257 10 10 CECE Cn1nc2ccccc2c1C(=O)NCCCN=[N+]=[N-] 1912198018 BHANNSWSDCOQHW-UHFFFAOYSA-N 258.285 2.004 10 10 CECE COc1ccc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)s1 1912195282 OKXHRWRYDVRBCG-ZETCQYMHSA-N 252.299 2.282 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@@H]2OC[C@H]3CCO[C@H]23)C1 1912167001 FGRWCILDOSMTBR-CRWXNKLISA-N 280.372 2.203 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)C1CCC(F)(F)CC1 1912179128 QFHBPECEWARUJS-QMMMGPOBSA-N 262.260 2.165 10 10 CECE Cc1cc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])sn1 1912198966 MNLNFOBOATVNQT-MRVPVSSYSA-N 251.315 2.366 10 10 CECE [N-]=[N+]=NC[C@H]1CCCCN(C(=O)C2CCOCC2)C1 1912181676 QORXNEVGQXVKNS-LLVKDONJSA-N 266.345 2.352 10 10 CECE CN(Cc1ccccc1O)C(=O)C1CC2(CCCO2)C1 1912710960 NVGDYEJMRITRHU-UHFFFAOYSA-N 275.348 2.310 10 10 CECE CN(Cc1ccccc1O)S(=O)(=O)[C@@H]1CC12CCC2 1965751493 GPHCTPZWDYPFEZ-CYBMUJFWSA-N 281.377 2.096 10 10 CECE Cc1[nH]ccc(=NCc2ccccc2O)c1[N+](=O)[O-] 2126953873 QGJJTMOZBYNPIP-UHFFFAOYSA-N 259.265 2.038 10 10 CECE OCC1(NCc2cc(F)ccc2O)CC2(CCC2)C1 1966091287 UENQJHLAHTZVNJ-UHFFFAOYSA-N 265.328 2.316 10 10 CECE Cc1sc(OCCc2ccc(N)cc2)nc1C(=O)O 2128177673 PJUCEKDHJCMYDO-UHFFFAOYSA-N 278.333 2.353 10 10 CECE C[C@@H]1C[C@@H](CO)CCN1c1ccc2c(c1)CC[C@@H]2N 2128320273 CBVGEDKXQMDPPD-WQGACYEGSA-N 260.381 2.230 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](O)C(C)(C)C3)ccc21 2128312170 FAYYGGPZMIRZHP-HUUCEWRRSA-N 260.381 2.100 10 10 CECE Nc1ccc(OCCNC(=O)C2[C@H]3CCCC[C@@H]23)cc1 161549719 VMTBHWWPTQVFHL-YIONKMFJSA-N 274.364 2.200 10 10 CECE CCCOc1ccnc(NCCOc2ccc(N)cc2)n1 169202439 NNZFFHMAHMQASI-UHFFFAOYSA-N 288.351 2.339 10 10 CECE Nc1ccc(CCC(=O)OCc2cncs2)cc1 165351602 MACGAGMWLOMAEO-UHFFFAOYSA-N 262.334 2.401 10 10 CECE O=C(O)CC[C@@H]1CCCN1c1ccc2c(c1)OCO2 259148362 FEBYNFSWIMLKLG-JTQLQIEISA-N 263.293 2.249 10 10 CECE Cc1c(O)ccc2c1CNC[C@H]2c1ccc(O)c(O)c1 31424806 ILRLAKGRRDIUQI-ZDUSSCGKSA-N 271.316 2.347 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](C3(O)CC3)C2)cc1 2130509927 FKFPQBNMZNPEEW-JSGCOSHPSA-N 260.381 2.318 10 10 CECE CCNCc1ccc(N2C[C@@H]3C[C@H]2CN3C)cc1Cl 2131054302 RQCLNRFATHDMNK-KBPBESRZSA-N 279.815 2.342 10 10 CECE Cc1nn(C)c(C)c1CN(C)c1ccc(CO)cc1 2131269163 WAJPDCOGQUHAFS-UHFFFAOYSA-N 259.353 2.166 10 10 CECE Nc1ccc(OCC(=O)OCCC2(F)CCC2)cc1 2140575108 ZELIWXOQFUOMDJ-UHFFFAOYSA-N 267.300 2.473 10 10 CECE COc1ccc(N2CCC(C[C@H](C)N)CC2)c(N)c1 2138728044 KBJUKZJNCWWBTL-NSHDSACASA-N 263.385 2.231 10 10 CECE Oc1cccc(F)c1CN[C@H]1C[C@H]1C1CCOCC1 2135446596 JJGRWEDQKJVXMD-FZMZJTMJSA-N 265.328 2.436 10 10 CECE Oc1c(Cl)cccc1CNCCN1C[C@H]2C[C@H]2C1 1967784173 HWFDZLMVYKDODS-TXEJJXNPSA-N 266.772 2.087 10 10 CECE COC[C@@]1(CNCc2c(C)cccc2O)CCCCO1 1967809805 PJWFOOARKWACOV-INIZCTEOSA-N 279.380 2.376 10 10 CECE CNCc1ccc(N2C[C@@H](C)OC[C@@H]2C)cc1OC 2139697607 XJSXNAADXWNTCJ-NWDGAFQWSA-N 264.369 2.028 10 10 CECE CNCc1ccc(N(C)CCCCOC)cc1OC 2139704753 QDNOQQJKVYHFSN-UHFFFAOYSA-N 266.385 2.277 10 10 CECE O=C(O)[C@@H]1CN(Cc2ccc(Cl)cc2O)CC12CC2 1968213888 KUHDLOKDXKLZQZ-NSHDSACASA-N 281.739 2.342 10 10 CECE COc1cccc(CNCC2C[C@@H]3CC[C@H](C2)O3)c1O 1970037106 JANGZVJJCSLEHJ-QXMXGUDHSA-N 277.364 2.448 10 10 CECE CC[C@]12CO[C@](C(=O)N3CCC[C@@H]3CN=[N+]=[N-])(C1)C2 2140230131 SFQZVCJDXBJRJB-RTXFEEFZSA-N 264.329 2.247 10 10 CECE Oc1ccc(F)cc1CNC[C@]12CO[C@](CF)(C1)C2 2138003487 CZDSRKDIHGGYCS-OKILXGFUSA-N 269.291 2.140 10 10 CECE CC[C@H](C)CS(=O)(=O)CCCOc1ccc(N)cc1 233988456 QUOUQQOJTOMLHA-LBPRGKRZSA-N 285.409 2.499 10 10 CECE CNCc1ccc(N2CC[C@@H]([C@@H](C)O)C2)cc1Cl 234373815 UXSQRJQWDAHOFW-ZYHUDNBSSA-N 268.788 2.267 10 10 CECE O=C(c1cccc(O)c1O)N(Cc1ccco1)C1CC1 126340425 IHYVFMSGWBPFHM-UHFFFAOYSA-N 273.288 2.496 10 10 CECE NN[C@H](c1ccccc1O)C1CC2(CSC2)C1 1942401807 XCVCRKOKWKKLLI-LBPRGKRZSA-N 250.367 2.040 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCN(C)C(C)(C)C1 235520726 UURCPDWPPXXYTF-NSHDSACASA-N 264.369 2.185 10 10 CECE Cn1ncc(Br)c1NCc1cccc(O)c1O 1949994543 AHMBLAPIWVEOHH-UHFFFAOYSA-N 298.140 2.206 10 10 CECE CC(C)(O)[C@@H]1CCCCN1CCOc1ccc(N)cc1 2149515118 MDAJMCAMZFWRRJ-HNNXBMFYSA-N 278.396 2.273 10 10 CECE COc1ccc(CNC[C@@H]2C[C@H]3OCC[C@H]3O2)cc1C 1974127371 IGJYWFQUFYCXOK-NUEKZKHPSA-N 277.364 2.040 10 10 CECE CN1CC[C@H](NCc2cc(F)ccc2O)CC12CC2 1974263607 YSYKGGDUGLOPQC-ZDUSSCGKSA-N 264.344 2.248 10 10 CECE CN(C)Cc1cc(F)cc(C2(CN)CCCC2)c1O 258416267 CCPCZUMFMLXUCP-UHFFFAOYSA-N 266.360 2.363 10 10 CECE Cc1ccc([C@@H](C)NC2CCC(C(N)=O)CC2)c(O)c1 37152060 SKYXESCGZSTQGP-PNESKVBLSA-N 276.380 2.395 10 10 CECE COc1csc(C(=O)NCCc2ccc(N)cc2)c1 161355631 AGCNFJJFEABQDC-UHFFFAOYSA-N 276.361 2.311 10 10 CECE C[C@@H](CNCc1ccc(O)c(O)c1)N1CCCCC1 38028342 DPYBNXVTOHRODI-LBPRGKRZSA-N 264.369 2.062 10 10 CECE C[C@@H]1CCN(Cc2ccc3c(c2)CCN3C)C[C@@H]1CN 163399241 LQHWASKRCNDKOC-CJNGLKHVSA-N 273.424 2.096 10 10 CECE CNCc1ccc(N2CC3(CCC3)C[C@@H]2CO)c(F)c1 2151518710 QDFWQKZMTRYYBS-CYBMUJFWSA-N 278.371 2.286 10 10 CECE COC[C@]1(O)CCCN(c2ccc([C@H](C)O)cc2)CC1 2151762930 LHLQISOUSGJGPQ-BBRMVZONSA-N 279.380 2.108 10 10 CECE Nc1ccc(CCc2nc(Cc3cscn3)no2)cc1 2152529879 ORUDJZMWOLKDSB-UHFFFAOYSA-N 286.360 2.484 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCNCC(F)(F)C1 2152793544 ZCYPJQCUISTNCJ-JTQLQIEISA-N 286.322 2.089 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@@]3(CCO3)C2)cc1O 2153336890 WXYNMJQIZYWNNK-BLLLJJGKSA-N 276.380 2.432 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CCC(CN)CC1 44511589 NBCQSTGAJSKNBO-CYBMUJFWSA-N 261.413 2.484 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H](N)C[C@@]12CCOC2 2154542729 VWBAYADNGKLEFR-JGGQBBKZSA-N 276.380 2.035 10 10 CECE CCn1nc(C)cc1CN(C)c1ccc(CN)cc1F 2155342110 DTAYSJBWCGVLRX-UHFFFAOYSA-N 276.359 2.446 10 10 CECE CN1CCCc2cc(CNC3(CO)CCCC3)ccc21 53045690 BPAFBOOWNNPENL-UHFFFAOYSA-N 274.408 2.464 10 10 CECE CNC[C@@H]1CCN(c2cc(Cl)c(OC)cc2OC)C1 53011383 UXNQIHIQYJRHPU-JTQLQIEISA-N 284.787 2.403 10 10 CECE COCCSCCNCc1c(C)cccc1O 2024833857 DRXWJYGAKRNADE-UHFFFAOYSA-N 255.383 2.170 10 10 CECE CC(C)(C)C[C@H](O)CNCc1ccc(F)cc1O 293638593 NULNUESOBXQBAQ-LBPRGKRZSA-N 255.333 2.418 10 10 CECE OCCC1(NCc2ccc(F)c(F)c2O)CCC1 2029602358 IAFVWNFBPBQYIL-UHFFFAOYSA-N 257.280 2.065 10 10 CECE CO[C@H]1CCN(c2ccc(CN)cc2F)C[C@H]1C 2031977356 KFDHCBMDQUBBBV-YGRLFVJLSA-N 252.333 2.146 10 10 CECE Cc1nscc1C(=O)NCCc1ccc(N)cc1 2032858859 FKNALEYTZBAUNR-UHFFFAOYSA-N 261.350 2.006 10 10 CECE CNCc1cc(F)c(N2[C@H]3CC[C@H]2[C@H](CO)C3)c(F)c1 2157232845 GMSOFSXFJOQUJO-MJVIPROJSA-N 282.334 2.034 10 10 CECE CC(C)CNCc1ccc(N2CCC[C@@H](O)C2)cc1 62737137 FMNZBUKEHZCVJF-MRXNPFEDSA-N 262.397 2.393 10 10 CECE CCOCCCC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2038001382 BAYAOFSWRKPXDG-LLVKDONJSA-N 254.334 2.495 10 10 CECE C[C@@H]1C[C@@H](CNCc2ccc(F)c(F)c2O)CO1 2040308227 YIPFYYQAEFCRHG-BDAKNGLRSA-N 257.280 2.185 10 10 CECE CNCCC1CCN([C@@H](C)c2cc(O)ccc2O)CC1 70189020 CZZYGSCATQHREK-LBPRGKRZSA-N 278.396 2.480 10 10 CECE CNCc1ccc(N2CCC[C@H](CN(C)C)C2)c(F)c1 404910357 IJZYOGZCRCBIRX-CQSZACIVSA-N 279.403 2.323 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)C(C)(C)C2)c(F)c1 311361561 OXORQWGGQNQVFO-QMTHXVAHSA-N 266.360 2.443 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)c2ccc3nccn3c2)C1 2159795437 SYAZECAKNGNLSK-JTQLQIEISA-N 270.296 2.107 10 10 CECE Nc1cc2c(cc1N1CC(F)(F)C(F)(F)C1)OCCO2 313256997 BXTHCKNTSOTECN-UHFFFAOYSA-N 292.232 2.131 10 10 CECE CC(C)(C)[C@@H]1OCCC[C@]1(O)[C@@H](N)c1ccccc1O 2160253893 OFEZBHAFDCJZJD-DZKIICNBSA-N 279.380 2.348 10 10 CECE C[C@H](N)Cc1cccc2c1ccn2Cc1ncccn1 80356079 JVFBMLFGMPPDII-LBPRGKRZSA-N 266.348 2.369 10 10 CECE COc1cccc(O)c1CN[C@@H](CC(C)C)CN(C)C 2160700496 CNQQBISNRRGIDR-ZDUSSCGKSA-N 280.412 2.467 10 10 CECE CN(CCc1ccc(N)cc1)C[C@]12COC[C@H]1C2(F)F 2161868773 DUKKRCPYIUFYSW-KGLIPLIRSA-N 282.334 2.025 10 10 CECE CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@@H]1N(C)C 2170469157 ZCMJDIWJZPUGCQ-OCCSQVGLSA-N 278.396 2.173 10 10 CECE CCN(C)C[C@H]1CCCN(c2ccc(OC)cc2N)C1 2170428224 PKVHKKJIOKFNTE-CYBMUJFWSA-N 277.412 2.446 10 10 CECE COc1cccc(CNC[C@@](C)(O)CC(C)C)c1O 90267618 LTYMVVUZQIANQC-HNNXBMFYSA-N 267.369 2.288 10 10 CECE CC[C@H](O)c1ccc(N(C)[C@@H]2CCCCNC2=O)cc1 2171077491 VSNKKBGIQQDHMH-CABCVRRESA-N 276.380 2.235 10 10 CECE C[C@H](O)c1ccc(N(C)CCN2CCOC2=O)cc1Cl 2171071237 YIXNGPDTFUCIMV-JTQLQIEISA-N 298.770 2.282 10 10 CECE CCCN(c1ccc(CNC)cc1Cl)[C@@H]1CCNC1=O 2171245223 WDPMJMNBFZCRIR-CQSZACIVSA-N 295.814 2.164 10 10 CECE CS(=O)(=O)CCCCn1ccc2cc(N)ccc21 707338437 VAFIPUXPRXRRPD-UHFFFAOYSA-N 266.366 2.048 10 10 CECE CN1C[C@H]2[C@@H]3CC[C@@H](CN3Cc3ccccc3O)[C@H]2C1 708036126 PLGUCPLORFYOQI-XZDPQHSOSA-N 272.392 2.164 10 10 CECE CCO[C@@H]1C[C@H]1C(=O)N(CC)Cc1ccc(N)cc1 689895945 FYAPNXAWSFBARR-ZIAGYGMSSA-N 262.353 2.042 10 10 CECE CN1C(=O)C(=Cc2cccc(O)c2)SC1=S 2053472065 CBGGTDPBXNOALJ-UHFFFAOYSA-N 251.332 2.223 10 10 CECE c1cc2c(cc1N1C[C@H]3[C@H]4CC[C@@H](CN4)[C@H]3C1)CCO2 2162659980 OFJCDJNXXDFHOG-LCGIIJARSA-N 270.376 2.056 10 10 CECE COc1ccc(N2CCSC[C@H](C)C2)c(N)c1 379516181 WNWMPXMQPXPMML-SNVBAGLBSA-N 252.383 2.467 10 10 CECE C[C@@H](c1cc(Cl)ccc1O)N1CC[C@H](CC(N)=O)C1 690719805 AOSSPKIFYYJUNK-VHSXEESVSA-N 282.771 2.304 10 10 CECE C[C@H](O)CN(c1ccc(CN)c(Cl)c1)C1CC1 691424272 KDNQQGPLDLBLKR-VIFPVBQESA-N 254.761 2.148 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@]2(C)CO)c(F)c1 722978335 XJHMGERVKRZCSB-QMTHXVAHSA-N 252.333 2.197 10 10 CECE Cn1nccc1[C@@H]1CCCN1c1ccc(CO)cc1F 2171793557 ZDQCWDUZLZDGGX-HNNXBMFYSA-N 275.327 2.393 10 10 CECE CN1CCc2cc([C@@H](O)[C@H]3CC(F)(F)CCN3)ccc21 2163070108 GINWNWDRLRSWCI-TZMCWYRMSA-N 282.334 2.100 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@H]1CC2(CC2)CN1 2163094493 MCRSYOZNWVFBNV-HZPDHXFCSA-N 272.392 2.462 10 10 CECE CCOC(OCC)[C@@H](NC)c1ccc2c(c1)CCN2C 2163076721 QFJUUGLZFNHBKD-HNNXBMFYSA-N 278.396 2.339 10 10 CECE CC[C@@H]1NCC[C@@H]1[C@H](O)c1ccc2c(c1)CCCN2C 2163112030 YIEBCNBNZJBUHJ-YQQAZPJKSA-N 274.408 2.491 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@H]2OCCO[C@@H]2C)cc1 2163114447 VYGVENDIISMAMT-KCXAZCMYSA-N 278.396 2.337 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@]12CNC[C@H]1C2 2163101144 YEPUETUWHBOJDX-DJIMGWMZSA-N 272.392 2.320 10 10 CECE C[C@H](NC(=O)Cc1ccc(N)cc1)c1ccns1 715909560 MWRNBXINDWSQTD-VIFPVBQESA-N 261.350 2.145 10 10 CECE O=C(O)[C@@H]1CN(Cc2c(O)cccc2Cl)CC12CC2 715988948 LXPRRDZDIARRPV-JTQLQIEISA-N 281.739 2.342 10 10 CECE Nc1ccc(CS(=O)(=O)NCC[C@@H]2CC[C@H]3C[C@H]23)cc1 716952523 FJIJTQYRAIBGCY-KCQAQPDRSA-N 294.420 2.124 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H](O)C[C@@H]2C)c(Br)c1 384986699 KXHFMELDOHVZJN-QXEWZRGKSA-N 299.212 2.428 10 10 CECE COc1ccc(N2CC[C@@H]2CNC(C)C)c(OC)c1 696417829 PUEMMXBDIZUHQH-GFCCVEGCSA-N 264.369 2.281 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3COC[C@@H]3C2)c(Cl)c1 718235349 ORCOVGTZZSLHAM-USWWRNFRSA-N 266.772 2.442 10 10 CECE CCOC(=O)c1csc(OCc2ccc(N)cc2)n1 389148411 VANFJCZNDIZVAH-UHFFFAOYSA-N 278.333 2.481 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H](CCO)C(F)(F)F 2178521096 PSGWMNWHHFCONC-SNVBAGLBSA-N 291.273 2.046 10 10 CECE CN(C(=O)C1=CC[C@@H](N)C1)c1ccc(Br)cc1 723894698 ADUHZLBPXAXOSB-LLVKDONJSA-N 295.180 2.459 10 10 CECE CO[C@H]1CC[C@H]1N(C)c1c(F)cc(CN)cc1F 724146842 MFIDZPXNURADNL-NEPJUHHUSA-N 256.296 2.037 10 10 CECE CCCNCc1ccc(N2CC(=O)N[C@@H](C)C2)c(Cl)c1 395690347 FYEODWHZVLEJPA-NSHDSACASA-N 295.814 2.164 10 10 CECE C[C@@H](N[C@@H]1COC(C)(C)C1)c1c(O)cccc1O 396538763 NJOZFKHNWJENRR-ZJUUUORDSA-N 251.326 2.316 10 10 CECE O=C(O)[C@@]12CCC[C@@]1(F)CN(Cc1ccccc1O)C2 2172128127 OXCJTDJFDFBLET-LSDHHAIUSA-N 279.311 2.171 10 10 CECE CCCNCc1ccc(N2CCOC[C@H](O)C2)c(Cl)c1 399938996 MWZPMOSBQBTEJN-CYBMUJFWSA-N 298.814 2.037 10 10 CECE CC[C@H]1CN(c2ccc(CN)cc2Cl)C[C@@H]1O 399974154 ZPHHWGVVQSDNCQ-GWCFXTLKSA-N 254.761 2.006 10 10 CECE CSC[C@H]1CCCN1Cc1cc(N)ccc1O 400005266 QSWDCHXINPROLO-GFCCVEGCSA-N 252.383 2.302 10 10 CECE CC1(C)C[C@H](CC(=O)NCc2c(O)cccc2O)CCO1 2063630707 PKFLMBUFZNATIX-NSHDSACASA-N 293.363 2.309 10 10 CECE CCc1ncncc1CN[C@@H](C)c1cc(O)ccc1O 2178832285 JNATWKMQIASEAU-JTQLQIEISA-N 273.336 2.301 10 10 CECE CCc1cc(CN)n(Cc2ccc(Cl)cc2O)n1 2070043795 JHJULVCQLFLXAA-UHFFFAOYSA-N 265.744 2.312 10 10 CECE Cc1cccc(O)c1Cn1nc(O)cc1Br 2070311093 CHJPJPYGNZFSHV-UHFFFAOYSA-N 283.125 2.414 10 10 CECE CN(C)C[C@@H](N[C@@H]1CCc2cccc(O)c21)C(F)(F)F 2177719513 OMHIAEZCUYIJRO-ZYHUDNBSSA-N 288.313 2.462 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1CC[C@H](OC)C1 2174922832 YCEJVAJCEYSYGK-ZFWWWQNUSA-N 276.380 2.432 10 10 CECE C[C@H](NC[C@H]1CN(C)C(C)(C)C1)c1c(O)cccc1O 2192245665 QVNLCDYOXPBCHC-RYUDHWBXSA-N 278.396 2.479 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCCN2C[C@H]1COC(=O)C1 2187686352 FPZZJWUCKOBPOS-NEPJUHHUSA-N 274.364 2.022 10 10 CECE CC[C@@H]1C[C@H](NCc2cccc(O)c2O)CCO1 1170180838 CLGSLLDRQPMOGT-VXGBXAGGSA-N 251.326 2.145 10 10 CECE C[C@H](NC(=O)[C@H]1COCCC1(F)F)c1ccccc1O 2192611385 NFAUISWMFJENNV-GXSJLCMTSA-N 285.290 2.241 10 10 CECE Cc1nccn1[C@@H](C)C(=O)N[C@H](C)c1ccccc1O 2192619774 LBSHLSFELDJPOZ-MNOVXSKESA-N 273.336 2.336 10 10 CECE COc1cccc(O)c1CNC[C@@H]1C[C@@H]2CC[C@H](C1)O2 2181507350 PHLOAHHLZKBECK-CLLJXQQHSA-N 277.364 2.448 10 10 CECE CC(C)[C@H]1CCCCN1C(=O)c1cc(O)c(O)c(O)c1 2188867468 AZTKNEJGCPPQIL-LLVKDONJSA-N 279.336 2.454 10 10 CECE CNCc1ccc(N(CC(F)(F)F)C2COC2)cc1C 2196631697 GBMABSXNQMHDMX-UHFFFAOYSA-N 288.313 2.482 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@H]1CCC2CC1C2 2189644085 YUXUUERIGMQDFR-QOZQQMKHSA-N 273.380 2.328 10 10 CECE Oc1ccc(CN[C@@H]2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]23)c(O)c1O 2193771405 NAOABKLXJTWIEB-UVJFLSLWSA-N 275.348 2.328 10 10 CECE COc1cccc(O)c1CN[C@H]1C[C@@H](n2ccnc2)C1 2184163977 ZQHTYDISISOGHW-TXEJJXNPSA-N 273.336 2.091 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1ccc2c(c1)ncn2C 2184165145 QVCIDJGEMJVLHY-UHFFFAOYSA-N 272.312 2.346 10 10 CECE N[C@@]12C[C@H]1CN(c1ccc(OC(F)(F)F)cc1)C2 2044328611 UBIQJPLNSNPWEP-GZMMTYOYSA-N 258.243 2.123 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)c1csnn1 2044732747 DCYLIRLAZMGMNK-ZDUSSCGKSA-N 261.350 2.220 10 10 CECE N[C@@H]1CCCc2cc(N3C[C@H](O)CC4(CC4)C3)ccc21 2184683113 WOVGCFMLUPTAFR-GDBMZVCRSA-N 272.392 2.374 10 10 CECE CCCc1nc([C@H](O)Cc2ccc(N)cc2)ns1 2044953492 ISFQFJVLZFMNRV-LLVKDONJSA-N 263.366 2.349 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H](O)CC4(CC4)C3)ccc21 2184683116 WOVGCFMLUPTAFR-ZBFHGGJFSA-N 272.392 2.374 10 10 CECE Cc1noc(CN(C)c2ccc3c(c2)CCC[C@H]3O)n1 2184685085 TVHCQTJYNNDJHU-CQSZACIVSA-N 273.336 2.384 10 10 CECE Oc1c(Cl)cccc1CNC1CC(Cn2ccnn2)C1 2184776724 FREBTVMOPNVTGJ-UHFFFAOYSA-N 292.770 2.206 10 10 CECE CN[C@H]1CCc2cc(N3CC4(C3)CC(C)(O)C4)ccc21 2184725154 HYTSUGYXJDWFKO-HNNXBMFYSA-N 272.392 2.245 10 10 CECE Oc1ccc(CNCC2CC(n3ccnc3)C2)cc1O 2184868820 ZDKYPZGSICXCEC-UHFFFAOYSA-N 273.336 2.035 10 10 CECE OC[C@@H]1C[C@H](NCc2ccc(Cl)cc2O)[C@H]2C[C@@H]21 2048009970 RIWADNRZHJOKGI-RYDUCSDGSA-N 267.756 2.152 10 10 CECE COc1ccc(N2CC[C@H]3CCC[C@]32CN)c(OC)c1 2197347268 JTSUHLSBTWEPEE-WBMJQRKESA-N 276.380 2.412 10 10 CECE CC[C@H](N)c1ccc(N2CC[S@@](=O)[C@H](C)C2)cc1 2051913483 DBWQRIQHUSGOJR-CDNVCLAFSA-N 266.410 2.054 10 10 CECE O=S(=O)(Nc1ccc(O)c(F)c1)[C@@H]1CCC[C@H]1F 2055309133 PAYOCJUPZGQPBC-LDYMZIIASA-N 277.292 2.164 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@]23CCOC[C@H]2C3)cc1O 2194538813 SXAUHBGAQWQJQW-OZVIIMIRSA-N 277.364 2.308 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@](C)(O)[C@](C)(O)C2)cc1Cl 2194617632 GCFQFSJKTLGMOZ-WKPIXPDZSA-N 298.814 2.072 10 10 CECE C[C@H](N)c1cc(F)c(N2CC[C@H](C3(O)CC3)C2)c(F)c1 2194693786 DUEUNEPDOQDSHY-ONGXEEELSA-N 282.334 2.336 10 10 CECE C[C@@H](N)c1cc(F)c(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)c(F)c1 2194705052 UHLWFZUMBLEFJU-AFCLKFOHSA-N 282.334 2.456 10 10 CECE CN[C@H](C[C@@H]1C[C@H]1CF)[C@H](O)c1ccc(N(C)C)cc1 2191444312 UPOIJYRRMDSWRP-WMHQRMGPSA-N 280.387 2.370 10 10 CECE CCC(CC)(CN)N(C)C(=O)CCc1ccc(N)cc1 2191669154 FIPJBZSHWMSZDL-UHFFFAOYSA-N 277.412 2.177 10 10 CECE Cc1cc(N)cc(NS(=O)(=O)Cc2ccc(N)cc2)c1 2191643418 KGAOQXCOKPDQNO-UHFFFAOYSA-N 291.376 2.101 10 10 CECE CO[C@H]1C[C@H](CF)N(c2ccc(CN)c(Cl)c2)C1 2069981777 QNPSMQWFCHKRIC-NEPJUHHUSA-N 272.751 2.362 10 10 CECE C[C@H](O)[C@@H]1CCCN1c1ccc([C@@H](C)O)cc1F 2073333992 VVZDTQWDZSSVJN-NRUUGDAUSA-N 253.317 2.229 10 10 CECE Nc1ccc(CCNC(=O)[C@@]23CCC[C@H]2CSC3)cc1 2201864645 AFUVSRNDAXPQDO-XJKSGUPXSA-N 290.432 2.461 10 10 CECE Oc1ccc(CNC[C@@H]2C[C@H]2C2CCOCC2)c(O)c1 2200075541 GXJCYJOBZSHHCH-ZFWWWQNUSA-N 277.364 2.250 10 10 CECE COc1cccc(CN[C@H]2C[C@H]2C2CCOCC2)c1O 2200170960 DHSCWGIVEVLVNM-KBPBESRZSA-N 277.364 2.306 10 10 CECE CO[C@@H]1C[C@H]2C[C@H]1C[C@H]2NCc1ccc(O)c(O)c1 2102412416 SDEFCXHYEIZQHQ-NWJSVONSSA-N 263.337 2.001 10 10 CECE Cc1cc(N2C[C@@H]3CCC[C@@]3(CO)C2)ccc1CN 2103166195 VKDRLZNCSZDDSM-HOCLYGCPSA-N 260.381 2.053 10 10 CECE COc1cc(N2CC(SC(F)F)C2)ccc1CN 2084018751 DZDSBPCIQXACLG-UHFFFAOYSA-N 274.336 2.298 10 10 CECE COc1cccc(O)c1CNC[C@H]1COC(C)(C)C1 2104441957 DVRKPLNTSJROOJ-NSHDSACASA-N 265.353 2.306 10 10 CECE Oc1cccc(F)c1CN[C@@H]1COC[C@@H]1CC1CC1 2104483026 ZKRHJNDDLJJOHG-SMDDNHRTSA-N 265.328 2.436 10 10 CECE N[C@@H]1CCC[C@@H]2CN(Cc3c(O)cccc3F)C[C@H]21 2104510996 QBGHKDDWXLZNFN-JTNHKYCSSA-N 264.344 2.091 10 10 CECE C[C@]1(C(F)(F)F)C[C@@H]1NC(=O)c1cccc(O)c1O 2105431182 HUVASFGZVCVSEC-KWQFWETISA-N 275.226 2.169 10 10 CECE COc1ccc(N2CC[C@]3(CCCNC3)C2)cc1F 2106389724 NHLVEAFQFQFPCT-HNNXBMFYSA-N 264.344 2.414 10 10 CECE CC(C)CN(CCN)c1ccc2c(c1)OC(F)(F)O2 2106380300 RSTABJXBVOSCIN-UHFFFAOYSA-N 272.295 2.429 10 10 CECE CCN1CCc2cc([C@]3(N)CCO[C@@H](C)C3)ccc21 2106792943 ISXGRRFWEMFILJ-LRDDRELGSA-N 260.381 2.422 10 10 CECE CC(C)=CC[C@@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2106795179 DVBOUOLOTPXIHR-GDBMZVCRSA-N 260.381 2.396 10 10 CECE N[C@@H](C[C@H](O)c1ccc(N2CCCC2)cc1)C(F)F 2106827366 CEFKSLLRTYGDKR-STQMWFEESA-N 270.323 2.303 10 10 CECE C[C@@H]1CC[C@@H](C[C@@H](NN)c2ccc(N(C)C)cc2)O1 2106821467 VICDYRAPQKFECT-BYCMXARLSA-N 263.385 2.215 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@H]1CC(C)(C)CN1 2107778291 DYGQRZNFJPEIEV-CABCVRRESA-N 261.413 2.401 10 10 CECE C[C@H](N)c1ccc(N2CCOC[C@H]2C2CC2)c(F)c1 2088410019 VYHBIOCAECTMJK-BONVTDFDSA-N 264.344 2.461 10 10 CECE CC(C)CO[C@H](C)C(=O)N(C)Cc1ccc(N)cc1 2109261677 FYXXYKHYZLHUBP-GFCCVEGCSA-N 264.369 2.288 10 10 CECE Cc1cc(N(C)C[C@H]2C[C@@H](C)CO2)ccc1CCN 2109953257 NBXDDMYZVQQLDW-MLGOLLRUSA-N 262.397 2.357 10 10 CECE NC(=O)[C@H]1CCC[C@@H](NCc2ccc(Cl)cc2O)C1 2090123318 BJSWKTMZBADAGD-JOYOIKCWSA-N 282.771 2.179 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC([C@H](F)C(=O)O)C2)c1 2110530660 INNKSNCRSIGPBL-ZANVPECISA-N 267.300 2.116 10 10 CECE CN[C@H](c1ccccc1O)[C@H](O)[C@H]1CCC(F)(F)C1 2091865764 BFHPSBLIVGGRCN-ZWKOPEQDSA-N 271.307 2.449 10 10 CECE CN(C)c1ccc(N)c(OCCS[C@@H]2CCOC2)c1 2092707373 OVCVVAHDAHZJHP-GFCCVEGCSA-N 282.409 2.236 10 10 CECE CO[C@H](COCc1ccc(N)cc1)[C@@H]1CCCOC1 2093893786 SOVRIXUXLCKULA-UKRRQHHQSA-N 265.353 2.227 10 10 CECE Oc1cccc(CNC2CC([C@@H]3CCOC3)C2)c1O 2094829690 XUSWQGUDMRCOFE-PNESKVBLSA-N 263.337 2.003 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC4CC3C4)c(Cl)cc21 2095416669 BIHATWLKWJEOJS-ROKYYSGWSA-N 277.755 2.151 10 10 CECE CC[C@H](COC)CC(=O)N(C)Cc1ccccc1O 2096056420 UPHDOHFRMRUGIS-LBPRGKRZSA-N 265.353 2.413 10 10 CECE COc1ccc(O)c(CN(C)[C@@H]2COCC[C@H]2C)c1 2096268934 NKQVTJNQLJKGAB-BXUZGUMPSA-N 265.353 2.258 10 10 CECE CCC1CC(OC[C@H](O)COc2ccc(N)cc2)C1 2096965635 QIFOKFXGOOPAJQ-GLWUULTISA-N 265.353 2.214 10 10 CECE Cc1[nH]nc(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)c1C 2099332934 MLOLPWPUDMNDSY-JTQLQIEISA-N 262.317 2.332 10 10 CECE C[C@H](c1nccs1)N(C)C(=O)Cc1ccc(N)cc1 2099527808 ZWOOJHMMFYKENQ-SNVBAGLBSA-N 275.377 2.487 10 10 CECE CO[C@H](C)c1noc(CN2CCC[C@H](N=[N+]=[N-])C2)n1 2113336234 LJRUGYJBYIFZKV-BDAKNGLRSA-N 266.305 2.052 10 10 CECE CC(C)N(Cc1cc(N)ccc1O)C[C@@H]1CCOC1 2113740131 XWMBPSYPULVVLG-LBPRGKRZSA-N 264.369 2.221 10 10 CECE COc1cc(N(C)[C@@H]2C[C@@H](OC)C2(C)C)ccc1CN 2204555530 UEUDBCQVWUHHCG-HUUCEWRRSA-N 278.396 2.404 10 10 CECE CCN(c1ccc(CNC(C)C)c(OC)c1)C1COC1 2204540877 DRSFPWJZJXLTJU-UHFFFAOYSA-N 278.396 2.418 10 10 CECE COC[C@@H]1CCCCN(c2ccc(CO)c(OC)c2)C1 2204555138 WGOJCKHKVBXQHO-CYBMUJFWSA-N 279.380 2.440 10 10 CECE Cc1cccc(CNC(=O)[C@H]2CCC(C)(C)NC2)c1O 2204624419 MLNMCHYYMSHPDS-ZDUSSCGKSA-N 276.380 2.095 10 10 CECE CCN(CC)C(=O)OCCNCc1ccc(F)cc1O 2204733613 IYEIBWOSWPQZEE-UHFFFAOYSA-N 284.331 2.099 10 10 CECE Cc1cc(N2CC[C@@H](CO)C23CC3)ccc1[C@@H](C)N 2269652596 YHTSBHAPXVRACF-OLZOCXBDSA-N 260.381 2.366 10 10 CECE Cc1cc(CNC2CCC2)ccc1N1C[C@H](O)[C@H]1C 2231450521 MLKODHNFAOVKMD-WBMJQRKESA-N 260.381 2.207 10 10 CECE CN[C@H](C)c1ccc(N2CCN(C)[C@@H]3C[C@@H]32)c(C)c1 2232097110 YLEKUKHNEGUHBI-WQVCFCJDSA-N 259.397 2.168 10 10 CECE COC(=O)C1(CN2CC[C@@H](N=[N+]=[N-])C2)CCCC1 2223149370 XNWGXSXSRUQVAW-SNVBAGLBSA-N 252.318 2.104 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H](O)C[C@@H](F)C2)c(F)c1 2234669007 KFCGSWPJCALAHY-RAIGVLPGSA-N 284.350 2.405 10 10 CECE C[C@@H](N=c1ccc2ncn(C)c2[nH]1)c1ccccc1O 2234767535 AYTDZPAGUWSRPC-SNVBAGLBSA-N 268.320 2.269 10 10 CECE O[C@@H]1[C@@H]2COC[C@H]1CN(c1ccc3c(c1)CCCC3)C2 2235097716 YFFVUZWVCUIAOO-QLPKVWCKSA-N 273.376 2.009 10 10 CECE CN[C@H]1CCc2cc(N3C[C@@H](O)CCC34CC4)ccc21 2235781490 XFGDCXJASBFPCQ-HOCLYGCPSA-N 272.392 2.387 10 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CECE CN[C@H](C)c1ccc(N2CCCC[C@@]2(C)CO)cc1O 722985239 BKFIHDCOLTZZAQ-WBMJQRKESA-N 278.396 2.414 10 10 CECE CNC(=O)[C@@H]1CCCN1Cc1cc(Cl)c(C)cc1O 824597180 MQUGZBUBHVHEDI-LBPRGKRZSA-N 282.771 2.064 10 10 CECE CC(C)/C=C\C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 588609164 VWKCLWQJNKKFEO-IBHLPDHGSA-N 263.337 2.357 10 10 CECE CN(C)c1ccc(/C=C/CN2CCO[C@@H]3C[C@@H]32)cc1 835052635 IDBSNVDHTBXPSN-MEGKRXCUSA-N 258.365 2.239 10 10 CECE C[C@@H](N[C@H]1CCc2cccc(O)c21)c1ccnn1C 866616152 ZJJNYFVYWWRUFT-PWSUYJOCSA-N 257.337 2.464 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 910956648 MOHODFQBIADDTG-QKGWFMCXSA-N 273.332 2.006 10 10 CECE Cc1cc(O)c(CN2CC[C@](C)(C(N)=O)C2)c(Cl)c1 840940728 DDJONCSKGDXLSI-AWEZNQCLSA-N 282.771 2.051 10 10 CECE CCN1CC[C@H](N(C)c2ccc(/C=C\C(=O)O)cc2)C1 688521889 YPIQLEBHZRBYRX-AJHXJQRKSA-N 274.364 2.315 10 10 CECE CCn1ncc(CNC/C=C/c2ccc(N(C)C)cc2)n1 858207381 WAUVUCPEVGFCLV-AATRIKPKSA-N 285.395 2.167 10 10 CECE C[C@H]1CSC[C@H]1NC(=O)NCc1c(O)cccc1F 922438031 LEQFJWYJKKDTRZ-GZMMTYOYSA-N 284.356 2.082 10 10 CECE C[C@@H](NC[C@@H]1C[C@@H]2COC[C@@H]2O1)c1cc(F)cc(F)c1O 926948530 NHXVDMSARZFFGL-AQWVNGNSSA-N 299.317 2.125 10 10 CECE C[C@@H](CC(=O)NCc1ccc(N)cc1)[C@@H]1CCCO1 850710948 LGDOFFKTTZEPDE-FZMZJTMJSA-N 262.353 2.090 10 10 CECE COC(=O)C1=CC[C@@H](NCc2c(O)cccc2Cl)C1 862465122 DMZWIKIOCISTFM-SNVBAGLBSA-N 281.739 2.397 10 10 CECE Cn1cc(CCSc2ncc(Cl)s2)nn1 863347991 MYAIMFJOPQLBGI-UHFFFAOYSA-N 260.775 2.260 10 10 CECE Cc1ccc(O)c(CNC(=O)Cc2cc(C3CC3)no2)c1 862753847 IZKLIVWZMBAQSI-UHFFFAOYSA-N 286.331 2.425 10 10 CECE CN(C)c1ccc(CNC2CC(n3cccn3)C2)cc1 876906116 QZZJHYYZLRSLPP-UHFFFAOYSA-N 270.380 2.442 10 10 CECE FC[C@@H]1C[C@H]1COc1ccc(N2CCNCC2)cc1 1875913493 HIWJELOIOUDZSG-STQMWFEESA-N 264.344 2.081 10 10 CECE C[C@@]12CCC[C@H]1C(=O)N2C(=O)Nc1ccc(N)cc1 1876153522 UUIMGEARENLOTN-SMDDNHRTSA-N 259.309 2.202 10 10 CECE CNc1nccnc1N(C)[C@@H](C)c1ccccc1O 1877518547 VULBZFYOUUCXAM-JTQLQIEISA-N 258.325 2.421 10 10 CECE C[C@H](N[C@@H]1CCC[C@@H]1S(C)(=O)=O)c1ccccc1O 1877584247 BRKTXUQPGFEPBF-SUHUHFCYSA-N 283.393 2.009 10 10 CECE CN(Cc1ccccc1O)[C@@H]1[C@H]2CCN[C@@H]2C1(C)C 1877544775 HTIHHRXCNSXWQL-AEGPPILISA-N 260.381 2.211 10 10 CECE O=C(NCc1cccc(O)c1O)[C@@]12CCCC[C@@H]1C2 1123978595 VFYWLXSAUYFXOS-IAQYHMDHSA-N 261.321 2.294 10 10 CECE CS[C@H]1C[C@H](CNC(=O)CCOc2ccc(N)cc2)C1 2190620939 ZTEVKIVONXFYRW-YEORSEQZSA-N 294.420 2.296 10 10 CECE Cc1cc(O)c(CN2CC(=O)N(C)[C@H](C)C2)cc1C(C)C 799954140 LJLFBXAFHKRIPK-CYBMUJFWSA-N 290.407 2.487 10 10 CECE CNC[C@@H]1CCN(c2ccc(OCC(F)F)cc2)C1 1879910851 OHTLQUBSZWTBGM-NSHDSACASA-N 270.323 2.376 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H](O)CC[C@H]2C)c(F)c1 1880483633 ZHRWBTIVFPJSOU-YWVKMMECSA-N 271.307 2.368 10 10 CECE Cc1ccc(CN[C@@H]2CCCN3CCSC[C@@H]23)c(O)c1 896427950 IVBMTUWAHOXXFU-CABCVRRESA-N 292.448 2.370 10 10 CECE C[C@H]1OCC[C@H]1CCN(C)Cc1cc(N)ccc1O 1885697972 YGKIAYRXICKXOT-VXGBXAGGSA-N 264.369 2.221 10 10 CECE COCC[C@@H](C)N1CCc2cc(OC)c(OC)cc21 1884120658 XVJOLCBMLJWOPP-LLVKDONJSA-N 265.353 2.491 10 10 CECE O=S(=O)(Nc1ccc(O)cc1)c1ccnc(Cl)c1 38107927 REXBPPSFCAYUSH-UHFFFAOYSA-N 284.724 2.241 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H](OC(=O)NCCN=[N+]=[N-])C1 1885556608 DBTKJIIGQUVOMD-SECBINFHSA-N 299.331 2.032 10 10 CECE COc1ccc(CN[C@H]2CCC[C@@H]2OC)c(O)c1 50372171 MVKIYNIGQBDBJX-JSGCOSHPSA-N 251.326 2.058 10 10 CECE CN(CCN=[N+]=[N-])C(=O)C1(CNC(=O)OC(C)(C)C)CC1 1885560901 JVFBKDXDVUBQTR-UHFFFAOYSA-N 297.359 2.060 10 10 CECE CC(C)[C@H]1[C@H](C(=O)O)CCN1Cc1cc(F)ccc1O 1964731641 ATYDBXMSUZWJPD-OCCSQVGLSA-N 281.327 2.462 10 10 CECE Nc1ccc2c(c1)[C@@H](c1ccc(F)cc1O)NCC2 75750948 GNLJZSSVSZFNRX-OAHLLOKOSA-N 258.296 2.349 10 10 CECE CCN(CC)CCN[C@H](C)c1ccc(OC)cc1O 20089804 FKNVJFNPCJRTLP-GFCCVEGCSA-N 266.385 2.393 10 10 CECE C[C@H](C(=O)O)C1CCN(Cc2ccc(F)cc2O)CC1 1964723435 FVWOLJQYOQONJN-JTQLQIEISA-N 281.327 2.464 10 10 CECE N[C@@H](c1nnc(C2CCCC2)o1)c1cccc(O)c1O 83543745 BUVQCQREOOTBKY-LLVKDONJSA-N 275.308 2.187 10 10 CECE Nc1ccc(OCCCN2CCC[C@@H](F)C2)cc1 701781382 JJSUSXSGRWANEX-GFCCVEGCSA-N 252.333 2.472 10 10 CECE Oc1ccc2c(c1O)[C@H](c1cnccc1Cl)NCC2 83724063 IUXGUNAKLFFFEN-ZDUSSCGKSA-N 276.723 2.381 10 10 CECE Oc1cc2c(cc1O)[C@H]([C@@H](O)c1ccccc1)NCC2 83723737 ABZDYRPTADFXRW-CVEARBPZSA-N 271.316 2.018 10 10 CECE CCCN[C@](C)(C[C@H](C)Sc1nccs1)C(N)=O 84351582 VZCXBVIUKHILKL-JOYOIKCWSA-N 287.454 2.257 10 10 CECE CC(C)O[C@@H]1CCN(c2cc3c(cc2N)OCCO3)C1 701819405 RMVPAYFAPXMNIW-LLVKDONJSA-N 278.352 2.044 10 10 CECE CC[C@@H](N)c1ccc(N2C[C@@H]3CN(C)C[C@@]3(C)C2)cc1 702343950 OGJIEXOKTKQMBV-UAGQMJEPSA-N 273.424 2.484 10 10 CECE CC[C@@H](CCO)CN[C@@H](C)c1ccc(O)cc1O 94949558 LSZDSKOMFOWPHR-QWRGUYRKSA-N 253.342 2.157 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)OCC1CCC(O)CC1 1326210694 APYUPRMEWMESIC-YWEYNIOJSA-N 292.331 2.205 10 10 CECE CO[C@H](C)CN(c1cc2c(cc1N)OCCO2)C(C)C 688096791 SVCUWWYREUZENT-LLVKDONJSA-N 280.368 2.290 10 10 CECE CCN(Cc1cc(F)ccc1O)[C@@H]1CCN(C)C1 710550032 IWPIYFFHBCVSLI-CYBMUJFWSA-N 252.333 2.057 10 10 CECE CC(C)(C)NCc1ccc(N2CCC[C@H]2C(N)=O)cc1 62735003 IAHTUUAGTWFTKT-AWEZNQCLSA-N 275.396 2.029 10 10 CECE COc1ccc(O)c(CNC[C@H]2CCC[C@H](C)O2)c1 688873192 CLKYOQQPDBQBIK-SMDDNHRTSA-N 265.353 2.448 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@]23COC[C@@H]2C3)c(F)c1 689307639 ZUQJEUQOTYEUOI-WBIUFABUSA-N 264.344 2.318 10 10 CECE C[C@H]1[C@H](C)[C@H](N)CCN1c1ccc2c(c1)CN(C)C2 689491100 JOCAAAYBJWAGTF-MQIPJXDCSA-N 259.397 2.194 10 10 CECE CN(C)[C@H]1CCC[C@H](NCc2ccc(O)c(O)c2)C1 715524779 FLZWYXVEZPBSRN-STQMWFEESA-N 264.369 2.060 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)COC1CC1 717716109 IFJSIXOSGKQCIQ-UHFFFAOYSA-N 262.353 2.185 10 10 CECE C[C@H](N)c1ccc(N2C[C@@H]3COC[C@H]3C2)cc1Cl 718236203 SKISRHWTUZCHHB-HBNTYKKESA-N 266.772 2.442 10 10 CECE CC(C)(O)[C@@H]1CCCN(c2ccc(CN)cc2F)C1 719653731 UFTAKDLWJJYKHX-GFCCVEGCSA-N 266.360 2.272 10 10 CECE O=C(O)[C@H](CNCc1cc(F)cc(F)c1O)CC1CC1 1332476364 LKHLFLUVWLRCRR-JTQLQIEISA-N 285.290 2.261 10 10 CECE COc1cc(N)c(N2CCO[C@H]3CCC[C@@H]32)cc1OC 213419966 HALGEJIRGCZXCF-AAEUAGOBSA-N 278.352 2.044 10 10 CECE Nc1ccc(NC(=O)CN2CCCC[C@H]2CF)cc1 2115220287 POPAAJHONPFBRB-ZDUSSCGKSA-N 265.332 2.031 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)c(C)c1 2115468185 SRKQKTRQMQENQS-YCPHGPKFSA-N 260.381 2.064 10 10 CECE CN[C@@H](C)c1ccc(N(C)c2ccnn2C)cc1O 2116349453 OTHOAZNHNGZBGP-JTQLQIEISA-N 260.341 2.174 10 10 CECE C[C@@H]1CCC[C@H](NC(=O)Cc2ccc(O)c(O)c2)C1 1290826968 ILTKNMSTPXOYTJ-PWSUYJOCSA-N 263.337 2.335 10 10 CECE CN[C@@H](C)c1ccc(N2CC=CC[C@@H]2CO)c(F)c1 2119816706 VQXBNXQUJSAEDI-WCQYABFASA-N 264.344 2.233 10 10 CECE COc1ccc(CN(C)C[C@H]2CCO[C@@H]2C)c(O)c1 2121125129 DUEPIKRVBOGZCU-VXGBXAGGSA-N 265.353 2.258 10 10 CECE Nc1ccc(NC(=O)CCC[S@@](=O)CC2CC2)cc1 2121631209 MUHLRUWFRUWNBW-LJQANCHMSA-N 280.393 2.146 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](OC)C[C@H]32)c(F)c1 2121830177 FDWZFKGFCDMQAZ-NILFDRSVSA-N 264.344 2.159 10 10 CECE Nc1ccc(CN(C[C@@H]2OCC[C@@H]2F)C2CC2)cc1 2122522991 AHAIFWBJTQFFOX-GJZGRUSLSA-N 264.344 2.360 10 10 CECE CN(c1ccc(CNC2CC2)cc1F)[C@H]1C[C@H](O)C1 2122885735 CDCHCKUHBHIRII-JOCQHMNTSA-N 264.344 2.037 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1CC[C@H]1CN2CCC1CC2 2123021101 YUJWOQOECCLLFE-UONOGXRCSA-N 263.389 2.493 10 10 CECE CCC[C@H](C)NC(=O)[C@H](C)N1CCC[C@@H]1CN=[N+]=[N-] 2123021646 WNMNRRNOIUWJJM-SDDRHHMPSA-N 267.377 2.454 10 10 CECE O=C(c1cnc2cc[nH]c2c1)N1Cc2cccc(O)c2C1 1558035027 CMTDGQYYCASLIL-UHFFFAOYSA-N 279.299 2.425 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(Cc2nc(C3CC3)no2)C1 1912202573 JHZGPZJESJBRAS-SECBINFHSA-N 262.317 2.469 10 10 CECE CCc1cccnc1C(=O)NCc1c(O)cccc1F 1635360179 CGZWIDLTHWMDKC-UHFFFAOYSA-N 274.295 2.419 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])C1CC(C)(C)C1 1912166680 AKACTMJCDMXKRR-SNVBAGLBSA-N 254.334 2.254 10 10 CECE CN(CCN=[N+]=[N-])C(=O)[C@H]1C[C@@H](OC(C)(C)C)C1 1912157470 XYGRQKINPYLTIS-AOOOYVTPSA-N 254.334 2.349 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2ccc(CO)cc2)C1 1912188639 QALNRFRCKBSXLW-GFCCVEGCSA-N 274.324 2.341 10 10 CECE Oc1ccc(F)cc1CN[C@H]1C[C@@H](c2ncc[nH]2)C1 2125150179 WPGREFPYOXXVPP-WVSHTKLVSA-N 261.300 2.290 10 10 CECE CN1CC[C@H](N(C)c2ccc3c(c2)CCC[C@@H]3N)C1 2128274110 ZSDICPLQDPIRCC-HOCLYGCPSA-N 259.397 2.163 10 10 CECE CN(C[C@H]1OCC[C@@H]1F)c1ccc2c(c1)CC[C@@H]2N 2128325414 SICNFURWXWCVLX-SOUVJXGZSA-N 264.344 2.196 10 10 CECE CC[C@@H]1COCCN(c2ccc3c(c2)CC[C@H]3N)C1 2128310268 FHLSNFUTTOTNOX-BLLLJJGKSA-N 260.381 2.495 10 10 CECE C[C@@H]1COC[C@@H]1N(C)c1ccc2c(c1)CCC[C@@H]2N 2128274009 YJSDHOPBILSHDU-RLCCDNCMSA-N 260.381 2.494 10 10 CECE CN[C@@H]1CCCc2cc(N3C[C@H](C)[C@@H](O)C3)ccc21 2128279134 LTFYCDCQBURODV-XZJROXQQSA-N 260.381 2.100 10 10 CECE NCC(F)(F)[C@@H]1CCCCN1Cc1ccccc1O 2128710584 OJPSSBFBXIBCHM-ZDUSSCGKSA-N 270.323 2.341 10 10 CECE C[C@@H](CN(C)C)NCc1ccc2c(c1)CCCN2C 168707605 VSABHJWNHOLQTA-ZDUSSCGKSA-N 261.413 2.109 10 10 CECE CC[C@H]1CN([C@H](C)C(=O)OC)c2ccc(OC)cc2N1 251634995 FQJADZDELRXFPS-MNOVXSKESA-N 278.352 2.267 10 10 CECE c1cc2c(cc1CNCC[C@@H]1CCCN1)CCCO2 258916522 FRACWIZTNCUBKQ-HNNXBMFYSA-N 260.381 2.243 10 10 CECE NCCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S 31934916 CECIZLZVCDWYMZ-JXMROGBWSA-N 298.820 2.500 10 10 CECE CC(C)C(=O)N[C@@H]1CCCN(Cc2ccc(N)cc2)C1 586064838 LZAMFYCXKKFUTG-OAHLLOKOSA-N 275.396 2.005 10 10 CECE C[C@H](c1ccc(O)cc1O)N(CCN)C1CCCC1 2130093978 GLXXBSPGJKANAR-LLVKDONJSA-N 264.369 2.362 10 10 CECE C[C@H](CCC1CC1)NC(=O)c1cc(O)c(O)c(O)c1 2132351709 ZLUYGGAWLARDES-MRVPVSSYSA-N 265.309 2.112 10 10 CECE Oc1c(F)cc(F)cc1CN1C[C@H]2COC[C@@H](C2)C1 2132488486 GULKNGDWBGFMNH-UWVGGRQHSA-N 269.291 2.139 10 10 CECE COCc1nc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)cs1 2132264549 KJQPJLAMTDLZGR-MRVPVSSYSA-N 281.341 2.204 10 10 CECE CCc1cccc(CN[C@H]2CCC[C@H](C(N)=O)C2)c1O 848897684 SNFGTDKNLAHRDA-JSGCOSHPSA-N 276.380 2.088 10 10 CECE COC[C@@H](CCNCc1ccc2c(c1)CCCO2)OC 922235752 JVHYPHKRWUJSDK-OAHLLOKOSA-N 279.380 2.153 10 10 CECE COc1cccc(O)c1CN1CCO[C@](C)(C(F)F)C1 1118611148 YZQUWHKTRWEVMG-AWEZNQCLSA-N 287.306 2.257 10 10 CECE Cc1ccc(O)c(CNCC(=O)OCCC(C)C)c1 1857873314 WERXEKCQGQVCIV-UHFFFAOYSA-N 265.353 2.380 10 10 CECE CCCNCc1ccc(N2CCN(OC)CC2)c(F)c1 1915779986 HSPUMMGCZOHSGN-UHFFFAOYSA-N 281.375 2.009 10 10 CECE CN(CCCOc1ccc(N)cc1)C[C@@H]1CCCOC1 111154702 LGMLXGXVLQVOJH-AWEZNQCLSA-N 278.396 2.396 10 10 CECE Nc1ccc(N2C(=O)[C@H]3C4CCC(CC4)[C@H]3C2=O)cc1 1916067597 OOOVBEUHPJWMQN-SUBVLCJKSA-N 270.332 2.194 10 10 CECE C[C@H](c1cc(Cl)ccc1O)N(C)C(C)(C)C(N)=O 1915534515 JPVCIZPOVYYDJY-MRVPVSSYSA-N 270.760 2.302 10 10 CECE Cc1ccc(CN(CCC(=O)O)CC2CC2)c(O)c1 2139770476 JPYNQCLQUHMBRB-UHFFFAOYSA-N 263.337 2.387 10 10 CECE Cc1ccc(O)c(CN2[C@H](C(=O)O)[C@H]3CC[C@@H]2C3)c1 2136395531 AHDRDCSYFDATOP-SUHUHFCYSA-N 261.321 2.138 10 10 CECE CN(C)c1ccc(CN[C@@H]2CCC[C@@]23CCNC3)cc1 1918247674 BUEVCUHUBDZEPO-SJORKVTESA-N 273.424 2.374 10 10 CECE C[C@@H](N[C@@H](CCO)C(F)F)c1cc(F)ccc1O 1918529186 NZLGKBBIIGOOHZ-XCBNKYQSSA-N 263.259 2.198 10 10 CECE CC[C@@H](N[C@H](CCO)C(F)F)c1ccccc1O 1918519072 RNMUXKUYXWYQHV-GHMZBOCLSA-N 259.296 2.449 10 10 CECE NC1CCN(c2ccc(O[C@H]3CCCOC3)cc2)CC1 225269179 GHDYVBIHWGCOBH-INIZCTEOSA-N 276.380 2.172 10 10 CECE Oc1cc(F)ccc1CNCC[C@H]1CCCOC1 1967714204 XZJTWAGKPPLOGO-LLVKDONJSA-N 253.317 2.438 10 10 CECE COc1ccc(O)c(CNC2CC3(CCOCC3)C2)c1 1967826793 DAEXRRIOZYHYMI-UHFFFAOYSA-N 277.364 2.450 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H](CCO)C2)cc1O 227407578 KQNZCVKCAWHEQX-NEPJUHHUSA-N 264.369 2.011 10 10 CECE CN1CC[C@H](N[C@@H]2CCc3cccc(O)c32)C1(C)C 1924316660 AQUSQVHPMBSFFQ-OCCSQVGLSA-N 260.381 2.452 10 10 CECE CN(Cc1ccc(Cl)cc1O)[C@H]1C[C@@H](C(=O)O)C1 1968200223 BRDLAEVMNDSADV-JGZJWPJOSA-N 269.728 2.341 10 10 CECE COc1ccc(N(C)C(C)(C)CC(=O)O)c([N+](=O)[O-])c1 1926943958 UIAVNZBLRGVKRB-UHFFFAOYSA-N 282.296 2.293 10 10 CECE COC[C@](C)(CO)CN[C@@H](C)c1ccc(N(C)C)cc1 1926959954 PPPSCEWRSIVWHZ-BBRMVZONSA-N 280.412 2.048 10 10 CECE CCC1C[C@@H]2C(=O)N(c3ccc(N)c(F)c3)C(=O)[C@H]2C1 229873887 UNWAELRGPPZZHY-QWRGUYRKSA-N 276.311 2.334 10 10 CECE COc1cccc(CN[C@H]2C[C@@H]3CCCCN3C2)c1O 1969660730 LDYFKTRRFNUXNF-KBPBESRZSA-N 276.380 2.117 10 10 CECE Cc1ccc(O)c(CNCC23COC(CF)(C2)C3)c1 2137994914 VCDGQSHGAWPGGT-UHFFFAOYSA-N 265.328 2.309 10 10 CECE CCC[C@](C)(NCc1ccc(F)cc1O)C(=O)O 1968783190 DYELUFBQFJMISS-ZDUSSCGKSA-N 255.289 2.264 10 10 CECE COC[C@@H]1CC[C@H]1N[C@H](C)c1ccc(OC)cc1O 2142401236 NRNLRKNLGBDQSJ-UHIISALHSA-N 265.353 2.476 10 10 CECE Cc1cc(NS(=O)(=O)c2c(C)n[nH]c2C)c(C)cc1O 235883788 OOWUVAOQEKYUED-UHFFFAOYSA-N 295.364 2.150 10 10 CECE C[C@@H]1CCN([C@H](CN)c2ccc(N(C)C)cc2)C[C@@H]1F 2152261166 HHGORSWBQFDMQK-UHOFOFEASA-N 279.403 2.432 10 10 CECE Oc1cccc(Br)c1CN1C[C@@H]2CC[C@H](C1)N2 1946739065 NFVACSNRMPHQHS-AOOOYVTPSA-N 297.196 2.091 10 10 CECE C[C@@H]1CCNCCN1Cc1ccc(Br)cc1O 1947789602 LDOSDNZNHVPZBE-SNVBAGLBSA-N 299.212 2.339 10 10 CECE C[C@@H](c1ccccc1O)N(C)CC[C@H]1CCS(=O)(=O)C1 2143418136 KMJVFSBCESFSAB-STQMWFEESA-N 297.420 2.210 10 10 CECE OCc1cc(F)c(N2CC[C@@H](O)C(F)(F)CC2)c(F)c1 2150042491 MQCJWLZHQATUBW-LLVKDONJSA-N 293.260 2.054 10 10 CECE CC(C)(C)OC(=O)CC[C@@H](N)Cc1ccc(O)c(O)c1 1951378367 VUZZRFVGAOHMEJ-LLVKDONJSA-N 281.352 2.090 10 10 CECE CCOC(=O)c1ncoc1COc1ccc(N)cc1 1951523536 GLNWYCNXFDGZAA-UHFFFAOYSA-N 262.265 2.013 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H]3CNC[C@H]3[C@H]2C)c1O 252863621 PLSKSDPTUVTVJU-CDMKHQONSA-N 296.798 2.094 10 10 CECE O=C1CCCN[C@@H]1c1cc(Br)cc(F)c1O 1952537935 MJDPELSLKCLJFX-SNVBAGLBSA-N 288.116 2.287 10 10 CECE C[C@H](O)[C@@H](N)c1c(O)cccc1NC(=O)OC(C)(C)C 1952843008 NEPJXNDLWDGULY-QPUJVOFHSA-N 282.340 2.120 10 10 CECE CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(CCCN=[N+]=[N-])C2 1954207954 FOBVIORIOPYXLF-GWCFXTLKSA-N 281.360 2.286 10 10 CECE O=C(O)c1ccc(NCCc2ccc(O)c(O)c2)cc1 2148007711 LJYQGKFCLBANMK-UHFFFAOYSA-N 273.288 2.451 10 10 CECE Oc1ccc(F)cc1CNCC[C@@H]1CN2CCC1CC2 2151296824 QUBBNCNZVVBGRO-CYBMUJFWSA-N 278.371 2.353 10 10 CECE C[C@H](NC[C@]1(F)C[C@H](CO)C1)c1cc(F)ccc1O 1974378777 AIYSUSVAPROHSR-BHDSKKPTSA-N 271.307 2.293 10 10 CECE CC(C)NCc1ccc(N2CCn3nccc3C2)cc1 2144738618 HBEMKQBNWCABRC-UHFFFAOYSA-N 270.380 2.401 10 10 CECE COC(=O)CC[C@@H](N)c1ccc(SC)cc1O 260069468 FDMVQIAKQMYXLV-SNVBAGLBSA-N 255.339 2.067 10 10 CECE CC1(C)CN(c2ccc(CN)c(C(F)(F)F)c2)[C@H]1CO 2148958292 MJNASHXQROTQMY-LBPRGKRZSA-N 288.313 2.371 10 10 CECE COC(=O)CCCN1CCCc2cc([C@@H](C)N)ccc21 2145822398 VBFGLIOVEULVKL-GFCCVEGCSA-N 276.380 2.412 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)Nc2cnsc2)C1 2004982673 AJPSQXQQXITRQC-ZETCQYMHSA-N 252.303 2.307 10 10 CECE CC(C)NCc1ccc(N2C[C@H]3C[C@]3(CO)C2)c(F)c1 2146320715 LQJRCEKJOBZEEK-CZUORRHYSA-N 278.371 2.142 10 10 CECE C[C@H](O)c1ccc(N2CCO[C@H](CO)C2(C)C)cc1Cl 2159639051 IKXBKECUGFRQMO-IINYFYTJSA-N 299.798 2.369 10 10 CECE O=C1Nc2cc(N3[C@H]4CCC[C@@H]3CC4)c(F)cc2[C@H]1O 2154903845 APXAGIHNSLDWPB-TVLCNXBWSA-N 276.311 2.333 10 10 CECE Oc1cccc(Cl)c1CN1CCOC[C@H]1CF 2011414619 OWCSLRFOQNTQNK-SECBINFHSA-N 259.708 2.216 10 10 CECE COc1ccc(N(C)[C@]2(CN)C[C@@H](OC)C2(C)C)cc1 2156427211 RGIOALOWBXLOBH-ZBFHGGJFSA-N 278.396 2.274 10 10 CECE CN(CCNCc1ccc(F)cc1O)C(=O)OC(C)(C)C 294290818 PJNDQCZZXZULSG-UHFFFAOYSA-N 298.358 2.488 10 10 CECE CNS(=O)(=O)c1ccc(-n2c(C)ccc2C)cc1 2026897574 MISAVYWDIOTZFX-UHFFFAOYSA-N 264.350 2.002 10 10 CECE CC[C@]1(N)CCCN(Cc2cc(F)ccc2O)C1 2027502314 XNZNDTUBIBKLNA-AWEZNQCLSA-N 252.333 2.235 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](O)[C@H](F)C2)cc1Cl 2027971868 HQJICNIKLQALAV-BZHVJNSISA-N 272.751 2.269 10 10 CECE CN(C1CCC1)S(=O)(=O)Nc1ccc(O)cc1Cl 2028770053 YFRUIMLFBFSBBH-UHFFFAOYSA-N 290.772 2.187 10 10 CECE NCc1cc(F)c(N2CCC(C3OCCO3)CC2)c(F)c1 2029133327 ZEVUWRVUFBRGBI-UHFFFAOYSA-N 298.333 2.013 10 10 CECE OCCC1(NCc2cc(F)cc(F)c2O)CCC1 2029617026 CXTSRNUCVLUGQD-UHFFFAOYSA-N 257.280 2.065 10 10 CECE CC[C@]1(CNCc2ccc(O)cc2O)CCCO1 2030262624 ROAUMLXDVLWJOU-CQSZACIVSA-N 251.326 2.147 10 10 CECE Cc1scnc1CNC(=O)Nc1ccc(N)cc1 2035319640 DCRAPXMPTUBULL-UHFFFAOYSA-N 262.338 2.355 10 10 CECE CCc1nc(Sc2ncc(CNC3CC3)s2)n[nH]1 2037789678 JGNVYBXUBHEXDZ-UHFFFAOYSA-N 281.410 2.227 10 10 CECE CC1(C)CC[C@@H](CNCc2cc3c(cc2O)OCO3)O1 189717690 VNMUGNPIVZJVGF-NSHDSACASA-N 279.336 2.168 10 10 CECE Cc1cc(N2CCC(N)CC2)ccc1O[C@H]1CCOC1 70072894 MWSFEJNCUSDEGY-HNNXBMFYSA-N 276.380 2.090 10 10 CECE COC[C@H](C)[C@H](C)NCc1cccc(OC)c1O 311195321 GAOSGLRKBIMCEK-QWRGUYRKSA-N 253.342 2.161 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H]3CCN(C)[C@@H]3C2)cc1 2158546579 JZVLOBRHJPUCJZ-FRFSOERESA-N 273.424 2.497 10 10 CECE CN(C)c1ccc(N)c(OCCn2cc(Cl)cn2)c1 312877048 BQIMFPBEFQTXTA-UHFFFAOYSA-N 280.759 2.264 10 10 CECE O=C(O)[C@H](NCc1c(O)cccc1F)c1ccccc1 2160795507 XIWOTOZFKHDFJD-CQSZACIVSA-N 275.279 2.447 10 10 CECE COc1cccc(O)c1CN[C@H](C)c1cnn(C)c1C 2160735215 FKOLNGKFMCBRHO-SNVBAGLBSA-N 275.352 2.294 10 10 CECE CCCNCc1ccc(N2CCC[S@@](=O)CC2)cc1C 322116160 YMEAAEZFTBMLEY-HXUWFJFHSA-N 294.464 2.453 10 10 CECE CCO[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(O)c1O 2162072055 PBHQNRAHMVCCLS-WCQYABFASA-N 279.336 2.175 10 10 CECE CCCOc1ccc(N2CCC(NCCO)CC2)cc1 2162641592 BQFBSWHITQRKMZ-UHFFFAOYSA-N 278.396 2.026 10 10 CECE CCOC[C@H]1CCCN1c1ccc([C@H](C)N)c(O)c1 702821425 DEMWRNMDQFWKNJ-WCQYABFASA-N 264.369 2.417 10 10 CECE O[C@@H](C[C@H]1CSCCN1)c1ccc(N2CCCC2)cc1 2163094887 PFUVVJOWTQNYLD-HOCLYGCPSA-N 292.448 2.415 10 10 CECE COC[C@H](C)C[C@@H](NN)c1ccc(N2CCCC2)cc1 2163096552 XWNITPMCBCTXQW-CZUORRHYSA-N 277.412 2.464 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3[C@H]4CCCN[C@H]43)ccc21 2163072635 CBNBVNXHRJOTRQ-DZUCGIPZSA-N 272.392 2.100 10 10 CECE CCN[C@H](c1ccc2c(c1)CCCN2C)c1cc[nH]n1 2163108454 XOFMNGOBXIHRFP-MRXNPFEDSA-N 270.380 2.491 10 10 CECE Cc1ncc([C@@H](NN)c2ccc3c(c2)CCCN3C)s1 2163150449 VVMFYSRXSWQCAO-HNNXBMFYSA-N 288.420 2.387 10 10 CECE CCN[C@@H](C)c1ccc(N(C)CCn2cnnc2)cc1 708321287 RIXRNAYSTNCMNJ-ZDUSSCGKSA-N 273.384 2.085 10 10 CECE Cc1cc(CN(Cc2ccc(N)cc2)C2CC2)nn1C 688111942 WAOXLJGTRUAFHU-UHFFFAOYSA-N 270.380 2.475 10 10 CECE C[C@H](CNCc1ccc(O)cc1O)[C@@H]1CCCCO1 711965540 OXQPTMDAOTVGOG-ABAIWWIYSA-N 265.353 2.393 10 10 CECE Cc1nnc(CN[C@@H](C)c2c(O)cccc2O)s1 391797362 AGPNYQPFKIQOFK-ZETCQYMHSA-N 265.338 2.109 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H]3C[C@@]3(C(=O)O)C2)cc1 712950134 KYIWAJLVHBCFTR-WOSRLPQWSA-N 274.364 2.096 10 10 CECE C[C@@H]1CCN([C@H](C)c2ccc(O)cc2O)C[C@H]1C(=O)O 693430508 MGCDSTURGIZKOG-GIPNMCIBSA-N 279.336 2.201 10 10 CECE C[C@H](NC[C@H]1[C@H](C(=O)O)C1(F)F)c1ccc(F)cc1O 715298711 URLHUHQRGVFPNJ-DQBIJJQNSA-N 289.253 2.148 10 10 CECE CCCN[C@H](C)c1ccc(N2CC(O)(CC)C2)cc1O 384130162 LDBOWCRCDWQITI-GFCCVEGCSA-N 278.396 2.414 10 10 CECE C[C@@H]1CNCCN(Cc2ccc3c(c2)CCCN3C)C1 385252876 JPFYUNLDBIFAIC-CQSZACIVSA-N 273.424 2.110 10 10 CECE CC[C@@H](O)[C@H](C)NCc1cc(Cl)cc(OC)c1O 386840270 XOSIPKNWDGALKP-GZMMTYOYSA-N 273.760 2.303 10 10 CECE C[C@H]1CN(c2ccc([C@@H](C)N)c(Cl)c2)C[C@H]1O 388313027 XNONVRMAHOQGLU-IGJMFERPSA-N 254.761 2.177 10 10 CECE COc1ccc([C@H](C)NCc2cnccn2)c(O)c1 698141178 BNYUWNMUMOUCGY-JTQLQIEISA-N 259.309 2.042 10 10 CECE CCC[C@H]1CCCN1c1ccc2c(c1)NC(=O)[C@H]2N 397030108 KXJNOXCLRPKTGK-HZMBPMFUSA-N 259.353 2.407 10 10 CECE COc1ccc(CNC[C@@H]2CC[C@@H](C)O2)c(O)c1 398186021 YYISKLADHMRQCF-MFKMUULPSA-N 251.326 2.058 10 10 CECE C[C@@H]1CO[C@@H](CN(C)CCCOc2ccc(N)cc2)C1 2166250235 RUWRUMQSTCCJBJ-XJKSGUPXSA-N 278.396 2.395 10 10 CECE Nc1ccc(CC(=O)OC[C@H]2C[C@@H]3CC[C@H](C2)O3)cc1 2181467730 YPSKPFLFPWXODP-XMQYKBBCSA-N 275.348 2.312 10 10 CECE CC=C1CN(c2ccc(C=CC(=O)O)cc2[N+](=O)[O-])C1 2179242204 PUORHAJRHAEEPJ-UHFFFAOYSA-N 274.276 2.459 10 10 CECE CNCc1ccc(N2C[C@H](C)O[C@@H](CCO)C2)cc1Cl 2179385503 YLUWIMVWKIZKFR-FZMZJTMJSA-N 298.814 2.036 10 10 CECE Cc1c(CN[C@@H](C)c2cnn[nH]2)n(C)c2ccccc12 2169065357 CHHBSGRUHUITKP-NSHDSACASA-N 269.352 2.456 10 10 CECE OCCC1CC(NCc2cc(Cl)ccc2O)C1 898008283 MIHSWSIMGICCFL-UHFFFAOYSA-N 255.745 2.296 10 10 CECE CN(C[C@H](F)C(F)(F)F)c1ccc2c(c1)NC(=O)[C@@H]2O 2179751574 DJLXRFBHBDTTSJ-VHSXEESVSA-N 292.232 2.009 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCNCC12CCCC2 2179890351 JTWNPYBPFRYUJN-LBPRGKRZSA-N 276.380 2.377 10 10 CECE Nc1ccc(OCCCN2C[C@H]3CCC[C@@H]3C2=O)cc1 2170806869 GHPHBLDUPXZAGU-DOMZBBRYSA-N 274.364 2.296 10 10 CECE CCN(CC)c1ccc([C@]2(O)CCN[C@@H]3CC[C@H]32)cc1 2177706096 UEMOLWJVJUCAKX-BRWVUGGUSA-N 274.408 2.492 10 10 CECE O[C@]1(c2ccc(N3CCCCC3)cc2)CCN[C@@H]2C[C@H]21 2177722865 XXVZMGRXXRECLI-ZACQAIPSSA-N 272.392 2.246 10 10 CECE COCc1nc([C@@H](N)c2ccc3c(c2)CCN3C)cs1 2188773262 LIWKNMMEPKGWKU-HNNXBMFYSA-N 289.404 2.330 10 10 CECE CC[C@@H](COC)[C@H](NN)c1ccc2c(c1)CCN2CC 2193472661 MMOOPMATIPCTAG-LRDDRELGSA-N 277.412 2.246 10 10 CECE C[C@@H]1CCN(C(=O)c2cc(O)c(O)c(O)c2)CC1(C)C 2188921138 AMDVHWWJQPBLBW-SECBINFHSA-N 279.336 2.312 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC[C@@H]3C(C)C)ccc21 2088658370 ZRHCPEYRUOZZMH-KGLIPLIRSA-N 259.353 2.134 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@H]1C[C@@H]1C1CC1 2199907206 UCBHZLCMJRMDHK-YYIAUSFCSA-N 274.408 2.420 10 10 CECE C[C@H](CN(C)C(=O)[C@@H]1CNc2ccccc2N1)C(F)F 2183952240 ZULFRUGKOOTDTD-SKDRFNHKSA-N 283.322 2.252 10 10 CECE O[C@@H]1CCCc2cc(N3CC[C@H](N4CCC4)C3)ccc21 2184691909 UVPQCTGCQOQFRD-DOTOQJQBSA-N 272.392 2.341 10 10 CECE CN[C@@H]1CCCc2cc(N3CC[S@@](=O)C[C@H]3C)ccc21 2184682566 PXWULXRUJBHWQU-CBLJQSSYSA-N 292.448 2.241 10 10 CECE N[C@H]1CCCc2cc(N3CC[C@@H](N4CCC4)C3)ccc21 2184686504 IEKQNXUZZUOCMS-WBVHZDCISA-N 271.408 2.307 10 10 CECE CN1CCN(c2ccc3c(c2)CCC[C@@H]3N)[C@H]2CC[C@H]21 2184690679 GDJIHLLHDMCFLP-BBWFWOEESA-N 271.408 2.306 10 10 CECE CN[C@H]1CCc2cc(N3C[C@H]4C[C@@H](O)C[C@H]3C4)ccc21 2184726227 IXKVMEIRHYUXAZ-CYHLAULCSA-N 272.392 2.243 10 10 CECE CN[C@H]1CCc2cc(N3CC4(CC=CCO4)C3)ccc21 2184721881 RJZPYOSPCYSDAW-INIZCTEOSA-N 270.376 2.429 10 10 CECE CN(c1ccc(CN)c(F)c1)[C@H]1CO[C@@H](C(F)(F)F)C1 2185536047 DUOBCBQCBLGILZ-ZYHUDNBSSA-N 292.276 2.440 10 10 CECE CN(Cc1ccc(N)cc1)C(=O)c1nnc(Cl)s1 2044408398 INCVBLNJZXZFQT-UHFFFAOYSA-N 282.756 2.046 10 10 CECE CNCCCNCc1ccc(C(F)(F)F)cc1O 2050389757 DVCGQWGXVSLSMA-UHFFFAOYSA-N 262.275 2.110 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C[C@@H]2COCCC2(F)F)C1 2050900597 QDFUTQNCEORDNU-ZJUUUORDSA-N 260.288 2.433 10 10 CECE [N-]=[N+]=NCCCN1CCC[C@H](CN2CCCC2)C1 2050950490 UKPQCLYCFVYHSC-CYBMUJFWSA-N 251.378 2.495 10 10 CECE C[C@@H]1C[C@H](CCOC(=O)Cc2ccc(N)cc2)CO1 2103060986 SUXRBLNMXSWZLE-YPMHNXCESA-N 263.337 2.170 10 10 CECE CC(C)(C)[C@@H]1COCCN1CCOc1ccc(N)cc1 2191951959 NMNUXHLCCWIHGU-HNNXBMFYSA-N 278.396 2.395 10 10 CECE CCNCc1ccc(N2CC=C[C@H]2CO)c(Cl)c1 2056283327 VLZAXAJLHKAVRK-LBPRGKRZSA-N 266.772 2.187 10 10 CECE CNCc1ccc(N2CCC=C[C@H]2CO)cc1Cl 2061987381 NOSZMJLDUWLHDW-ZDUSSCGKSA-N 266.772 2.187 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cnc(C(=O)O)cn1 2192591877 MKCUBFUITUDABU-SECBINFHSA-N 273.292 2.078 10 10 CECE [N-]=[N+]=NCCCN1CC(N2CCC(F)(F)CC2)C1 2063887620 GLNAHRFPMPAFDD-UHFFFAOYSA-N 259.304 2.102 10 10 CECE CC(C)N1C[C@@H]2C[C@H]1CN2c1ccc2c(c1)CC[C@@H]2O 2187610774 LCKFLRJBVWJQQE-ZOBUZTSGSA-N 272.392 2.338 10 10 CECE C[C@@H](NS(=O)(=O)c1cccc(O)c1)c1ccccc1O 2192626780 KBAPVMHFKXYVOZ-SNVBAGLBSA-N 293.344 2.137 10 10 CECE Cc1nscc1[C@H](N)[C@@H](O)c1ccc2c(c1)CCN2C 2192652579 UJTNTIZLKOHFOZ-GJZGRUSLSA-N 289.404 2.177 10 10 CECE Nc1ccc(CNCC23CC(C2)[C@H](C(F)(F)F)O3)cc1 2193108010 WJKDHFPAUFVJSP-YXMLORGKSA-N 286.297 2.468 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C[C@@H]2CC23CCOCC3)C1 2077708627 NHABDHOKOIFDNU-RYUDHWBXSA-N 250.346 2.435 10 10 CECE CO[C@H]1C[C@@H](N(C)Cc2cc(N)ccc2O)C1(C)C 2100156142 KSMRWJGNKYFPRK-KGLIPLIRSA-N 264.369 2.220 10 10 CECE CNCc1ccc(N2CCC[C@](F)(CO)C2)c(Cl)c1 2101289185 RIGTYDKVOQWZJK-CQSZACIVSA-N 286.778 2.360 10 10 CECE Oc1c(F)cccc1CN[C@@H]1COC[C@@H]1CC1CC1 2101891923 YMINCLLIVQZHOQ-GXTWGEPZSA-N 265.328 2.436 10 10 CECE CC1CCC([C@@](C)(NCCCN=[N+]=[N-])C(N)=O)CC1 2102239134 OKERZNZAIGMYIO-GCZXYKMCSA-N 267.377 2.347 10 10 CECE CCN(Cc1nc(C)no1)c1ccc(CNC)cc1 2104121191 CLDKGQYLNFMYSG-UHFFFAOYSA-N 260.341 2.124 10 10 CECE CN=c1cc(NCc2ccc(N(C)C)cc2)cc[nH]1 2104187957 VTROTYMOJMEEMW-UHFFFAOYSA-N 256.353 2.223 10 10 CECE Cc1ccc(CN(C)C[C@@H]2OCC[C@H]2F)c(O)c1 2084088322 QVLXUXFGGACQTI-OCCSQVGLSA-N 253.317 2.259 10 10 CECE CN(Cc1ccc(F)cc1O)[C@H]1CCC[C@H](N)C1 2084072457 USDPMZHXXZVONZ-STQMWFEESA-N 252.333 2.233 10 10 CECE Oc1ccc(Cl)cc1CN[C@H]1CC2(CCC2)[C@H]1O 2084791486 SVJZAVLKETVDOO-AAEUAGOBSA-N 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CECE CCOC(=O)c1ccc(N=NN2CCN(CC)CC2)cc1 2330149761 SHIZOWNFWJAJII-UHFFFAOYSA-N 290.367 2.500 10 10 CECE CCOC(=O)[C@](N)(CSc1nccs1)[C@@H]1C[C@H]1C 2327831645 GAQVQXKRSCCIIB-LNLATYFQSA-N 286.422 2.152 10 10 CECE COC[C@@H]1CCN(c2ccc(CN)c(SC)c2)C1 2328549433 XNHUZODMGCAKFU-LLVKDONJSA-N 266.410 2.340 10 10 CECE CO[C@@H]1C[C@@]2(C(=O)N3CCC[C@H](N=[N+]=[N-])CC3)C[C@@H]12 2329091072 DRRWPJLPUKKHNQ-KQXIARHKSA-N 264.329 2.103 10 10 CECE CCOc1ccc(N2C[C@@H]3C[C@H]2[C@@H]3N)cc1OCC 2329481725 UJMQCAUPKBQXEQ-ITDIGPHOSA-N 262.353 2.020 10 10 CECE C[C@H](CN)N(C)Cc1cc(OC(F)(F)F)ccc1O 2335917973 SBMNTCJFENSEOZ-MRVPVSSYSA-N 278.274 2.070 10 10 CECE C[C@H](NC[C@H]1COCC1(C)C)c1c(O)cccc1O 2336158104 CKWDNGRCCRXHJN-QWRGUYRKSA-N 265.353 2.421 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)c1ccncc1COC 2337777790 WJUSMWZXFWMKRP-UHFFFAOYSA-N 263.301 2.000 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@H]3C[C@H]2C[C@H]3O)c1C 2340850933 MNVKDFCWXUHCFR-RSUWNVLCSA-N 260.381 2.283 10 10 CECE CC(=O)c1cc(Cl)cc(CN(C)C[C@@H]2CCO2)c1O 2341211466 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2.398 10 10 CECE Nc1ccc(OC[C@H](O)COc2cccc(F)c2F)cc1 62611809 DVIFRVXDNNAHPL-NSHDSACASA-N 295.285 2.366 10 10 CECE CC[C@@H]1C[C@H]1[C@H](O)[C@H](NC)c1ccc2c(c1)CCN2C 2357643898 MQFIPAZEZQPWLE-PREXVCJDSA-N 274.408 2.346 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@](C)(COC)OC 1895246773 MKUGPBZLCANNRZ-HUUCEWRRSA-N 266.385 2.065 10 10 CECE Oc1ccccc1CN1CCN(c2cc(C3CC3)n[nH]2)CC1 189898251 KWEWDGXJQBUCTL-UHFFFAOYSA-N 298.390 2.315 10 10 CECE C[C@H](NCc1cncs1)c1cc(O)ccc1O 127975294 WLFLVCJXMQIWTR-QMMMGPOBSA-N 250.323 2.405 10 10 CECE CCN(CC(=O)N1CCCCCC1)c1ccc(CN)cc1 34654568 MUSLEMNEUSHJTP-UHFFFAOYSA-N 289.423 2.374 10 10 CECE N[C@H](C(=O)O)c1cc(OCc2ccccc2)ccc1O 72196889 LAEBUUFLUFRXCN-AWEZNQCLSA-N 273.288 2.056 10 10 CECE Cc1ccccc1CNC(=O)Nc1cc(O)c(O)c(O)c1 217278976 JVGHEDAQZAWEAS-UHFFFAOYSA-N 288.303 2.434 10 10 CECE C[C@H](NC(=O)COc1ccc(N)cc1)C(C)(C)C 122290753 SRIMEKCQPOREMM-JTQLQIEISA-N 250.342 2.198 10 10 CECE CN(C)c1ccc([C@H]2C[C@H](CN)CN2C2CC2)cc1 212925346 DRYWWTGXZHVQTA-MLGOLLRUSA-N 259.397 2.237 10 10 CECE CNC(=O)c1ccc(Sc2nccs2)c(N)c1 213383248 ZRQQZKFVCXQJJR-UHFFFAOYSA-N 265.363 2.236 10 10 CECE Cc1ccc([C@H](C)NCc2cc(C(N)=O)co2)c(O)c1 187734142 OKIOYCWVVRIHIR-JTQLQIEISA-N 274.320 2.243 10 10 CECE C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)[C@H](C)CO1 75582773 LGGKGXBKIOVXKG-VXGBXAGGSA-N 261.365 2.490 10 10 CECE CCCNCc1ccc(N2C[C@H](C(N)=O)CC[C@@H]2C)cc1 42438223 YMAYZTHXQWUTMK-DZGCQCFKSA-N 289.423 2.276 10 10 CECE COc1cc(OC)c2c(c1)C(=O)[C@@H]1C=C(C)N=C[C@H]1C2=O 199028113 AVFNYSXEZDEYNP-ZYHUDNBSSA-N 285.299 2.303 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC[C@H](C(F)(F)F)C3)ccc21 228310048 ANQGGSMUXXYNTO-UFBFGSQYSA-N 299.296 2.417 10 10 CECE CC(=O)Nc1cccc(NC(=O)c2ccc(O)c(O)c2)c1 227012152 JNHZHGNOMQIHRI-UHFFFAOYSA-N 286.287 2.309 10 10 CECE C[C@H]1CO[C@H](C)CN1c1ccc(/C=C/C(=O)O)cc1 223237389 DLVGZCWTHMQQGO-JZUADKBYSA-N 261.321 2.398 10 10 CECE CC[C@@H]1CCN(c2ccc3c(c2)OCCCO3)CCN1 49660952 SYXPCMYJSLIFIX-CYBMUJFWSA-N 276.380 2.426 10 10 CECE C[C@@H](NCC[C@@H]1CCCO1)c1c(O)cccc1O 235194691 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CCN[C@@H](C)c1ccc(N(C)C[C@H]2C[C@@H](O)C2)cc1O 703865544 KLQOVCUDKMMASF-SGMGOOAPSA-N 278.396 2.270 10 10 CECE CCCOc1cc(N2C[C@@H]3CC[C@H](C2)C3O)ccc1N 2167787529 OWMQRIBEPUNSEX-HBBFGDNQSA-N 276.380 2.265 10 10 CECE COc1ccc([C@H](C)N[C@@H]2CCN(C)[C@H]2C)c(O)c1 719598600 ILSBSCUWNNYDHS-COPLHBTASA-N 264.369 2.144 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)NC1C[C@@H]2C[C@@H]2C1 819799855 XXMCAEWQSUBFKI-GSVMSFKSSA-N 259.305 2.026 10 10 CECE CN(C)c1ccc([C@@H](NN)[C@]2(C)CCCOC2)cc1 2133610972 ZKLNGLGSBFYMCW-HUUCEWRRSA-N 263.385 2.074 10 10 CECE CO[C@@H]1C[C@@H](CF)N([C@@H]2CCc3cccc(O)c32)C1 2133722664 KPVFETDFRLIWGL-YNEHKIRRSA-N 265.328 2.438 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](CO)C23CC3)c(F)c1 2133812537 WYXXYGXFTBGTBY-ZYHUDNBSSA-N 265.328 2.230 10 10 CECE COc1ccc(O)c(CNC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)c1 830543926 ITVFCURIAQMLRV-HONMWMINSA-N 275.348 2.453 10 10 CECE Cc1cc(O)c(CN2CCC[C@H](C(N)=O)C2)c(Cl)c1 840907746 IJFZXVAQNWVCSD-JTQLQIEISA-N 282.771 2.051 10 10 CECE CN(C/C=C/c1ccc(N(C)C)cc1)CC(C)(C)N 849349686 DXXNTCXXPPQLTQ-VOTSOKGWSA-N 261.413 2.435 10 10 CECE CCCCCNC(=O)CN1CCCc2cc(CN)ccc21 843349783 CECVTCZEMVLEMA-UHFFFAOYSA-N 289.423 2.204 10 10 CECE C[C@@H](N[C@H]1CNOC1)c1cc(Cl)c(Cl)cc1O 925866546 MIIYPWMSBKWHSD-RQJHMYQMSA-N 277.151 2.253 10 10 CECE COC(C)(C)[C@@H](C)NC(=O)NCc1cc(C)ccc1O 925526485 JFRYSGBHLDHZGO-LLVKDONJSA-N 280.368 2.313 10 10 CECE Nc1ccc(CCNC(=O)N2C[C@H]3CC[C@@H](C3)C2)cc1 851664678 ISDAGPADDXMJFF-KBPBESRZSA-N 273.380 2.253 10 10 CECE CCOc1cccc(CN[C@@](C)(CC)CO)c1O 70940157 GPVNVLVDBPOVQZ-AWEZNQCLSA-N 253.342 2.042 10 10 CECE C[C@@H]1CC[C@@H](C)N1CC(=O)N1Cc2cccc(O)c2C1 871202300 CPJKRBHAEDCVBM-VXGBXAGGSA-N 274.364 2.107 10 10 CECE COc1ccc(N(C[C@@H]2CCCN2)C(C)C)c(N)c1 1876276765 BKULAFIHSDSLGV-LBPRGKRZSA-N 263.385 2.244 10 10 CECE OCC[C@H]1CSCCN1Cc1cc(Cl)ccc1O 770308078 YGVKURCDSIGFRE-LBPRGKRZSA-N 287.812 2.345 10 10 CECE Cc1ccc(C(=O)OC[C@@H]2CCO[C@H](C)C2)c(O)c1O 783344309 LOUJGWUCLQNHNA-GHMZBOCLSA-N 280.320 2.378 10 10 CECE NC(=O)N=Nc1ccc(C(=O)N2CC[C@H](CF)C2)cc1 899205481 NCFLZOJDVPKLGY-SECBINFHSA-N 278.287 2.281 10 10 CECE CCCNC(=O)CN(C)[C@H](C)c1cc(C)ccc1O 132977076 XUCNVGANCWXELG-GFCCVEGCSA-N 264.369 2.220 10 10 CECE COC(=O)c1cnc(CNCc2cc(C)ccc2O)s1 895392573 QVVCRBVDIPAECI-UHFFFAOYSA-N 292.360 2.234 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@@H](O)[C@@H](C)C2)c(F)c1 1880479219 LQQVBINKLGNCHN-MWODSPESSA-N 271.307 2.225 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)C[C@@H]2CCN2C)c(F)c1 1880478602 GSXUDXRHQCSCBS-KOLCDFICSA-N 270.323 2.158 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@](C)(CO)C2)c(F)c1 1880480348 VKMLITXXDGQAIB-XPTSAGLGSA-N 271.307 2.227 10 10 CECE CCc1nnc2sc(CCc3ccc(N)cc3)nn12 133404931 SBQYCVCZIUSONE-UHFFFAOYSA-N 273.365 2.116 10 10 CECE COc1ccc(O)c(CN(Cc2ccccc2)C2CNC2)c1 1958648487 KQBLEWUHLSZCCJ-UHFFFAOYSA-N 298.386 2.375 10 10 CECE COc1ccc(O)c(CNCc2nc(C(F)F)no2)c1 1333848977 HCTIYCFDBLEZIL-UHFFFAOYSA-N 285.250 2.011 10 10 CECE CC(C)NCc1ccc(N2CC[C@H]3COC[C@@H]32)cc1 1899147933 JSKXLTFRMQILQS-HOCLYGCPSA-N 260.381 2.410 10 10 CECE O=C(C[C@H]1COC(=O)C1)NCc1c(O)ccc2ccccc12 1157041468 HIILJYYZAOGVOP-LLVKDONJSA-N 299.326 2.115 10 10 CECE CN1CCc2cc([C@H](O)C(=O)CCCCF)ccc21 1886629379 CHGZFHAWPIJCFZ-HNNXBMFYSA-N 265.328 2.421 10 10 CECE C[C@H](Nc1c(N)cccc1Br)[C@@H](C)N 1888912922 SEEDENUIBDXHQR-RQJHMYQMSA-N 258.163 2.179 10 10 CECE Oc1ccc(CNCc2ccccc2F)c(O)c1O 83458267 QHTRDJROYMJZFW-UHFFFAOYSA-N 263.268 2.232 10 10 CECE CC[C@@H]1CN(CC)[C@H](c2cc(OC)ccc2O)CN1 83479593 BUAVLTZZWFAFQM-RISCZKNCSA-N 264.369 2.146 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)c1c(F)cccc1F 1963989104 HNHQYJWVUARVJA-UHFFFAOYSA-N 290.295 2.334 10 10 CECE COc1cccc2c1[C@H](c1ccc(O)cc1O)NCC2 83597545 LCWZPHHSEWAJNV-INIZCTEOSA-N 271.316 2.342 10 10 CECE CC1(C)C[C@@H]1c1nnc([C@@H](N)c2ccc(O)cc2O)o1 83543878 SOYPJGRGUDMXOT-KOLCDFICSA-N 275.308 2.042 10 10 CECE COc1cc(F)c(N(C)[C@H]2CCCNC2)cc1F 84606700 WMTLBMNLKAEOFE-VIFPVBQESA-N 256.296 2.162 10 10 CECE CC(C)(C)CN(CC(=O)O)Cc1ccc(F)cc1O 1964687444 NUROPKAAUIUFTQ-UHFFFAOYSA-N 269.316 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2.362 10 10 CECE Oc1cc(Br)ccc1CNCc1cnoc1 718887172 FMZJOGKTOBIYEW-UHFFFAOYSA-N 283.125 2.433 10 10 CECE CCNCc1ccc(N(C)CC2CN(CC)C2)c(C)c1 692256770 ZYNZYGORZZOYTI-UHFFFAOYSA-N 275.440 2.492 10 10 CECE CCN(CC1CN(C)C1)c1ccc(CNC)cc1Cl 692246647 LCNTWOBBMUYIFG-UHFFFAOYSA-N 281.831 2.447 10 10 CECE NCc1cc(F)c(N2CCO[C@@H](C3CC3)C2)c(F)c1 694844175 GEJPUXRTCRIHGZ-CYBMUJFWSA-N 268.307 2.039 10 10 CECE C[C@](COCc1ccccc1)(NCCCN=[N+]=[N-])C(=O)O 699403066 IPOAORNOGHJBNN-CQSZACIVSA-N 292.339 2.337 10 10 CECE NC(=O)c1c(F)cccc1NCc1ccc(N)cc1 93410530 CCOIAVLXSATWFW-UHFFFAOYSA-N 259.284 2.119 10 10 CECE COc1ccc2c(c1)CCN2C(=O)/C=C(\C)c1cnccn1 1434902332 RXMHNUXGWVWGSQ-FMIVXFBMSA-N 295.342 2.478 10 10 CECE CCNCc1ccc(N2CC[S@](=O)C[C@@H]2C)c(C)c1 2115327107 YBNVPYDPVRTELC-DJJJIMSYSA-N 280.437 2.062 10 10 CECE c1cc(N2C[C@H]3CCO[C@H]3C2)ccc1CNC1CC1 2115405777 VDSPXPFHVLWYOQ-CJNGLKHVSA-N 258.365 2.164 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1C[C@@H](C2CC2)[C@H]1C1CC1 1449833267 LPFFPTKPVYCFIH-SUMWQHHRSA-N 287.359 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2.004 10 10 CECE CC[C@@H](O)CN(CC)c1ccc(CNC)c(OC)c1 2139703338 XIZHLJBJFAIQNX-CQSZACIVSA-N 266.385 2.012 10 10 CECE OCC[C@H]1COCCN1c1ccc2c(c1)CCCC2 2226759703 LVEMLMBTUAPAIT-INIZCTEOSA-N 261.365 2.153 10 10 CECE OC[C@@H]1C[C@H]2CN(c3ccc(OC4CC4)cc3)C[C@H]12 2226767926 ZFKVVZFVEVKPOU-MKBNYLNASA-N 259.349 2.292 10 10 CECE COc1ccc(N2C[C@H](C)C(O)[C@@H](C)C2)cc1OC 2226801371 CJCJGFZDJWGXAH-QWRGUYRKSA-N 265.353 2.157 10 10 CECE COc1ccc(N2CC(C)(C)NC[C@H]2C)cc1F 86218031 PSSMRLUFJVMMEV-SNVBAGLBSA-N 252.333 2.411 10 10 CECE COC[C@@H]1C[C@H]1CN(C)c1ccc(CCN)c(C)c1 2133420752 CPIGILRUQOSFFT-GJZGRUSLSA-N 262.397 2.215 10 10 CECE CN(Cc1cc(F)ccc1O)[C@@H]1CCCNCC1 231462788 WKDSWILNWCWRKO-CYBMUJFWSA-N 252.333 2.105 10 10 CECE CC(C)(CO)[C@H](N)c1ccc(Br)c(F)c1O 95706310 XJFNYLRYCDRQOA-SNVBAGLBSA-N 292.148 2.312 10 10 CECE CN(Cc1c(O)cccc1Cl)C[C@H]1CCCNC1 234357689 WRUMUNRCYRHSPJ-NSHDSACASA-N 268.788 2.477 10 10 CECE Cc1ccc(NC(=S)NCc2ccccn2)c(N)c1 243820473 QUXVAIMIHUZBKC-UHFFFAOYSA-N 272.377 2.459 10 10 CECE Cc1ccc(-c2nc(O)n(CC(C)C)c2C=O)n1C 606593858 CPHFTKPUENHTOF-UHFFFAOYSA-N 261.325 2.371 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC[C@@H](C)[C@H](N)C1 251704670 OJONCKPGKYMLME-GBIKHYSHSA-N 252.333 2.261 10 10 CECE O=C(O)/C=C/c1ccc(N2CCN3CCC[C@H]3C2)cc1 250056365 NEJPKKHNMILGLL-PXTSUWAFSA-N 272.348 2.069 10 10 CECE CO[C@H](C)c1noc(CN(C)Cc2cccc(C)c2O)n1 271864940 RABNMNWTRYTMPG-LLVKDONJSA-N 291.351 2.423 10 10 CECE CC(C)Oc1ccc(N(CCO)C[C@@H]2CCCN2)cc1 2162650769 URGGOKKKHXMIMW-AWEZNQCLSA-N 278.396 2.025 10 10 CECE CNC(=O)CCN(C)c1ccc([C@H](C)NC)cc1Cl 723191250 HPCNVESQEUXIAW-JTQLQIEISA-N 283.803 2.193 10 10 CECE CN1CCc2cc([C@H](O)[C@H]3CC[C@@H](C4CC4)N3)ccc21 2163060252 APFFZVVMVLDSJA-UXLLHSPISA-N 272.392 2.243 10 10 CECE Cc1nc(C[C@H](NN)c2ccc3c(c2)CCN3C)cs1 2163135351 IZLAGWKFZNAQPC-AWEZNQCLSA-N 288.420 2.191 10 10 CECE CCN(CC)c1ccc([C@H](NN)C2CCOCC2)cc1 2163142236 ANBJHTKTYHXSFF-INIZCTEOSA-N 277.412 2.464 10 10 CECE C[C@@H](NS(=O)(=O)Cc1ccc(N)cc1)[C@H]1CC1(C)C 397669533 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CC(=O)c1ccc(O)c(CN2CCC[C@@](C)(CO)C2)c1 688030135 JNVNKZJEYBLMPC-MRXNPFEDSA-N 277.364 2.189 10 10 CECE CC[C@@](C)(CO)NCc1ccc2c(c1)CCCN2C 80886404 HZKNNKURAIHXPE-INIZCTEOSA-N 262.397 2.320 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1CCCN2CCSC[C@@H]12 720410488 VIQUIHVYBHMZOE-KGLIPLIRSA-N 296.411 2.201 10 10 CECE CCCOc1cc(N(C)C[C@H](C)CO)ccc1N 689045277 XUBZXSCKAXGATM-NSHDSACASA-N 252.358 2.122 10 10 CECE C[C@@H](NC[C@@H]1CCC2(COC2)O1)c1ccc(N(C)C)cc1 1335823024 ZRQGEXSWOCFBTG-CJNGLKHVSA-N 290.407 2.351 10 10 CECE C[C@H](C[C@@H]1CCCN1)NCc1ccc(N(C)C)cc1 93462744 ZBLFUQKICQYLFX-HIFRSBDPSA-N 261.413 2.373 10 10 CECE Cc1cc(N2CCO[C@@H]3C[C@@H]32)ccc1CNC(C)C 2115161384 JMGLSOWUFKUPIZ-JKSUJKDBSA-N 260.381 2.471 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@@H]1[C@H]2COC[C@H]21 2118013312 ARRZFTQZZDXJQO-GTXQXIFRSA-N 259.349 2.483 10 10 CECE CCCCN(CC)C(=O)Cc1ccc(O)c(O)c1 1290046154 OJQUEUVEAWAGBH-UHFFFAOYSA-N 251.326 2.289 10 10 CECE COC[C@@H]1CN(c2ccc([C@H](C)O)c(O)c2)C[C@@H]1C 2118619793 RKDRPUBVAWIBKE-SRVKXCTJSA-N 265.353 2.164 10 10 CECE COc1ccc([C@H](C)NC[C@@H]2[C@H]3CCO[C@@H]23)c(O)c1 2119928553 GVMZPIRUUYIMQW-XRFFLINXSA-N 263.337 2.086 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@H](F)[C@@H](C(=O)O)C2)c1 2120636825 CXCHYHLCARWZEQ-DLOVCJGASA-N 267.300 2.116 10 10 CECE CCN(C)[C@@H]1CCN(c2cc(Cl)c(CN)cc2F)C1 2120881307 KMOKLJDUSNAOHU-LLVKDONJSA-N 285.794 2.468 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@](C)(O)C(C)(F)F 2122329459 ZYTUBEWKTZRXPR-CHWSQXEVSA-N 272.339 2.419 10 10 CECE C[C@@H](C(=O)NC1CCCC1)N1CCC[C@H]1CN=[N+]=[N-] 2123016360 XDGUYVFUCIWTHQ-JQWIXIFHSA-N 265.361 2.208 10 10 CECE C[C@H](CN(C)C(=O)Cc1ccc(N)cc1)C(F)(F)F 2123194234 LNXXKZJRGFJERW-SECBINFHSA-N 274.286 2.468 10 10 CECE Cc1cc(CC(=O)NCc2ccc3cccnc3c2O)no1 1557123589 RIGCEVWXYKPBBT-UHFFFAOYSA-N 297.314 2.096 10 10 CECE COC[C@]1(F)CCN(c2ccc([C@@H](C)O)c(O)c2)C1 2123227217 JDPLPDISBKNYAG-YGRLFVJLSA-N 269.316 2.010 10 10 CECE COc1ccc(CNC(=O)c2c(F)ccnc2F)c(O)c1 1626079853 NFIVFFKCAYUHHK-UHFFFAOYSA-N 294.257 2.004 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@@H]1[C@H]2CCCC[C@H]21 1558175328 MCHLOUKXABSHGN-IMRBUKKESA-N 261.321 2.150 10 10 CECE O=C(CCc1ccncc1)NCc1c(O)cccc1F 1558455414 SNRCKMYTRPNXAM-UHFFFAOYSA-N 274.295 2.175 10 10 CECE CNc1nc(C)ccc1C(=O)NCc1ccccc1O 1631540202 OGTZEDQMURZWHN-UHFFFAOYSA-N 271.320 2.067 10 10 CECE CC(C)C(C)(C)CNC(=O)Cc1ccc(O)c(O)c1 1556239634 ZTWFISRWKVPYHP-UHFFFAOYSA-N 265.353 2.439 10 10 CECE CC(=O)NN1C(=O)/C(=C/c2cccs2)SC1=S 1093057 DSSRQSWMRMDUQZ-YVMONPNESA-N 284.387 2.000 10 10 CECE Cc1cnc(Cl)c(C(=O)NCc2ccc(O)cc2O)c1 1638356129 FZSPRWZVQKXZIZ-UHFFFAOYSA-N 292.722 2.385 10 10 CECE Cc1ccncc1[C@H](C)NC(=O)Cc1ccc(O)c(O)c1 1566837754 UJEYJRLPCYVTQH-NSHDSACASA-N 286.331 2.221 10 10 CECE O=C(Cc1cnccc1Cl)NCc1cc(O)ccc1O 1637126451 ZBNBEPKDPYUWMM-UHFFFAOYSA-N 292.722 2.005 10 10 CECE C[C@H]1COCCN1c1c(F)cc(C=CC(=O)O)cc1F 1911894515 PIHISHSDHZQTAU-VIFPVBQESA-N 283.274 2.288 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])C1CCC(F)CC1 1912148169 QANVOOAOHZSPRF-ILDUYXDCSA-N 272.324 2.346 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(CCN2CCSCC2)C1 1912175872 RBTJQWGLENWFGK-ZDUSSCGKSA-N 283.445 2.448 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)Cc2ccccn2)CC1 1912153732 DFZXJSAHCCPNHM-UHFFFAOYSA-N 259.313 2.173 10 10 CECE CCC(C)(C)NC(=O)[C@H](C)N1CC[C@H](CN=[N+]=[N-])C1 1912181727 RJETZHXWJRWGGR-WDEREUQCSA-N 267.377 2.312 10 10 CECE [N-]=[N+]=NC1CCN(CC(=O)NCc2ccccc2)CC1 1912179652 XAEUDVBNJCNEQL-UHFFFAOYSA-N 273.340 2.078 10 10 CECE CCCCC[C@H](C)NC(=O)CN1CC(N=[N+]=[N-])C1 1912166433 XKWNNVZRGHOZFE-JTQLQIEISA-N 253.350 2.066 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2cc(C(N)=O)ccc2F)C1 1912154133 GOEBYRZQPRNGDA-LLVKDONJSA-N 277.303 2.199 10 10 CECE CCn1c(C)nnc1CN1CCC(CN=[N+]=[N-])CC1 1912210239 GZJPEZJOCWDDFW-UHFFFAOYSA-N 263.349 2.129 10 10 CECE Cc1nc(C(=O)NCc2cc(O)ccc2O)c(C)s1 1651225356 GQIVAFMXQMRWHX-UHFFFAOYSA-N 278.333 2.101 10 10 CECE COc1ccc(N(C)C[C@@H]2C[C@H]3COCC[C@@H]3O2)cc1 1966142669 CKJTUFODEBRBJN-RCBQFDQVSA-N 277.364 2.325 10 10 CECE CCN[C@H]1CCc2cc(N3CC4(CCO4)C3)ccc21 2128293111 CIMOJLGAGOTJEU-HNNXBMFYSA-N 258.365 2.263 10 10 CECE C[C@@H]1C[C@@H](O)CCN(c2ccc3c(c2)CC[C@@H]3O)C1 2128327782 OKUGJOBPCDJQDY-WPGHFRTFSA-N 261.365 2.263 10 10 CECE CCN1CCN(c2ccc3c(c2)CC[C@@H]3O)C[C@@H]1C 2128317712 QZZMKDOZHVWPQJ-LRDDRELGSA-N 260.381 2.197 10 10 CECE CO[C@@]1(CN(C)c2ccc(CO)c(Cl)c2)CCOC1 2129656576 NRNXCQWPCSYUSM-CQSZACIVSA-N 285.771 2.074 10 10 CECE COCOc1cccnc1NC(=O)Oc1ccc(N)cc1 1858690954 MAWHMHWMCMISIX-UHFFFAOYSA-N 289.291 2.257 10 10 CECE CN[C@@H]1CN(c2ccc3c(c2)OCO3)CCC1(C)C 259269757 NPXNSQCWTGBURE-CQSZACIVSA-N 262.353 2.240 10 10 CECE COc1ccc(N(C)Cc2nc(CO)cs2)cc1 1660194478 IPGZMTIGTMDTHN-UHFFFAOYSA-N 264.350 2.280 10 10 CECE CC(C)N1C[C@@H]2C[C@H]1CN2Cc1c(O)cccc1F 2131024430 VTIHHNPAGDIRIP-RYUDHWBXSA-N 264.344 2.198 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2ccn3cnnc3c2)C1 2131652211 QTYHBVSXTVVXGL-LLVKDONJSA-N 257.301 2.004 10 10 CECE CCC1(CC)C[C@@](O)([C@H](N)c2ccccc2O)CO1 2132910038 FKFCQECEYSNPJN-HIFRSBDPSA-N 265.353 2.102 10 10 CECE O=C1Nc2cc(N3CC4(CCCCC4)C3)ccc2[C@@H]1O 1915346417 BJWUYTCTFHVGCB-AWEZNQCLSA-N 272.348 2.443 10 10 CECE NCc1ccc(N2[C@H]3CCC[C@@H]2COC3)c(F)c1F 1900652528 JIYFXBWZPBSRCX-PHIMTYICSA-N 268.307 2.181 10 10 CECE Nc1ccc(COc2ccc(N)c3nsnc23)cc1 1904638611 JBJPUZBWLLOSNF-UHFFFAOYSA-N 272.333 2.435 10 10 CECE CCc1conc1CN[C@H](C)c1ccc(O)cc1O 2136050112 AGKGAKFCHZAQDX-SECBINFHSA-N 262.309 2.499 10 10 CECE COc1ccc(N2CCC([C@H](C)O)CC2)c([N+](=O)[O-])c1 225742380 TVXRRJDYIJYVTL-JTQLQIEISA-N 280.324 2.201 10 10 CECE CC(C)NC[C@@H](C)NCc1ccc2c(c1)CCCO2 229123045 PZDJHFPGTLYWAL-CYBMUJFWSA-N 262.397 2.488 10 10 CECE C[C@@H](c1c(O)cccc1O)N(C)C(C)(C)CC(=O)O 1926939268 PLMRWWGZPQGOLR-VIFPVBQESA-N 267.325 2.344 10 10 CECE CCN(C)[C@H]1CCCN(Cc2ccc(F)cc2O)C1 2139792920 TZKAIJFBBZOMOQ-AWEZNQCLSA-N 266.360 2.447 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1C[C@]12CCOC2 1968787915 ADJMMRKNOYJNPQ-KFNAQCHYSA-N 275.348 2.338 10 10 CECE CC(C)[C@@H](C)[S@](=O)CC(=O)N(C)c1ccc(N)cc1 232701545 WEBXVZXBQUTEHD-NSPYISDASA-N 282.409 2.025 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@H]2C[C@]2(CO)C1 2146309364 FDWTYWGEWOEVRZ-RHSMWYFYSA-N 272.392 2.066 10 10 CECE Cc1cc(N2C(=O)[C@@]34CCC[C@]3(C4)C2=O)ccc1N 2142222328 WNEFNZQEEVEXDG-GJZGRUSLSA-N 256.305 2.011 10 10 CECE OC[C@H](NCc1ccc2c(c1)CCO2)[C@H]1CC=CCC1 1971211933 OHPHASBYGASLPR-HOCLYGCPSA-N 273.376 2.428 10 10 CECE C[C@@]12CC[C@H]1CN(c1ccc([N+](=O)[O-])c(CO)c1)C2 2143202252 MDVUGKTWOMYYRN-FZMZJTMJSA-N 262.309 2.323 10 10 CECE COc1cccc([C@](C)(N)CC(=O)OC(C)(C)C)c1O 1951852538 DGAWQMNKHWHJPI-OAHLLOKOSA-N 281.352 2.307 10 10 CECE CCN(CC)c1ccc([C@](C)(N)CC(=O)OC)cc1 1951905135 LHYVIQWCOMYCSZ-OAHLLOKOSA-N 264.369 2.270 10 10 CECE Cc1cc(CN)ccc1N(C)[C@@H]1[C@H]2[C@@H]3C[C@@H]4[C@H]([C@H]23)[C@@H]41 2143306822 GAAKOBFUAFANHM-CHNABZMASA-N 254.377 2.400 10 10 CECE CC(C)(C)OC(=O)Nc1cccc(O)c1[C@H]1NCC[C@H]1O 1952932100 SNRAARFSBGGWPO-YPMHNXCESA-N 294.351 2.135 10 10 CECE CN(C)CCOc1ccc(N(C)Cc2cnsn2)cc1 2143459544 PNRVPFIEDLSEQJ-UHFFFAOYSA-N 292.408 2.115 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1CCN(CCN=[N+]=[N-])C1 1953752480 UFHPBGMPUHNRFU-SNVBAGLBSA-N 269.349 2.143 10 10 CECE Cc1cccc(CN2CCOC[C@H]2C(F)F)c1O 1971848287 FAEWUOPOUPIRSW-NSHDSACASA-N 257.280 2.167 10 10 CECE COc1ccc(O)c(CN(C)C[C@]2(C)CCCO2)c1 1973996645 YVJQPKSMFIYSGV-HNNXBMFYSA-N 265.353 2.402 10 10 CECE COc1cccc(CN[C@H]2CCCC[C@@H]2CO)c1O 152310278 YSBLFOXBPYGBRA-OLZOCXBDSA-N 265.353 2.042 10 10 CECE COc1ccc(CNC[C@H]2CCCCNC2=O)cc1C 2144038181 ZDLVSXYOWYAHGD-CQSZACIVSA-N 276.380 2.010 10 10 CECE CC[C@H](C)[C@@H](N)Cc1nc(-c2ccc(O)c(O)c2)no1 2149619934 LEAMSJQFTYUAGW-WPRPVWTQSA-N 277.324 2.064 10 10 CECE CCOC(=O)C[C@H](N)c1c(C)cc(C)c(C)c1O 260058340 AIULGQNOVYPRTD-NSHDSACASA-N 251.326 2.270 10 10 CECE COC(=O)C[C@H](N)c1cc(C(C)C)cc(OC)c1O 260305955 NEYUCXZDZAXKGH-NSHDSACASA-N 267.325 2.087 10 10 CECE CN1C[C@@H]2CC[C@H](N[C@@H]3CCc4cccc(O)c43)[C@H]2C1 2149714096 XICJOKIANMNNHY-ZQDZILKHSA-N 272.392 2.309 10 10 CECE CN(Cc1ccc(Br)cc1O)CC1(N)CC1 1984019497 ANFUQLMJMHOBGP-UHFFFAOYSA-N 285.185 2.078 10 10 CECE Cc1c(-c2cc(C#N)no2)ccc(O)c1CN(C)C 260859204 OQBDHBGDRWKPBS-UHFFFAOYSA-N 257.293 2.289 10 10 CECE C[C@@H](Cc1nccn1C)N[C@@H](C)c1ccc(O)cc1O 2148109626 SKFPNJXVFQBUIG-QWRGUYRKSA-N 275.352 2.113 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@@H]2C2CCCC2)cc1 2145747920 DHCMUBIQVWCMMP-OAHLLOKOSA-N 273.380 2.472 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H]2C2CCOCC2)cc1O 2145737529 SELQSZNKRWTZIB-IAQYHMDHSA-N 276.380 2.417 10 10 CECE COc1ccc(O)c([C@H](C)Nc2ccc(=O)n(C)c2)c1 37785365 QRLBLNHQECTDMN-JTQLQIEISA-N 274.320 2.273 10 10 CECE CCCN[C@@H](CCN1CCOCC1)c1ccccc1O 2146240640 LCILYFJSJUWADI-HNNXBMFYSA-N 278.396 2.155 10 10 CECE CCN1CCN(c2ccc([C@@H](C)NC)cc2)C[C@H]1C 250252842 ISCPELWDFISSGG-ZIAGYGMSSA-N 261.413 2.497 10 10 CECE CC(=O)c1ccc(O)c(CN2CC3(CC=CCO3)C2)c1 2151332707 KMWKVLJZXCAVLW-UHFFFAOYSA-N 273.332 2.126 10 10 CECE COCC1(O)CCN(c2ccc([C@H](C)O)cc2Cl)CC1 2151757415 XLPCYCCSFJIUIY-NSHDSACASA-N 299.798 2.371 10 10 CECE CCCSC1CN([C@@H](C)C(=O)Nc2ccc(N)cc2)C1 2153904738 CRTAEKMIIKMJLY-NSHDSACASA-N 293.436 2.423 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1COC2CC1C2 2011803128 KFQQRHWWFRIBKS-KWPJZBAWSA-N 253.729 2.313 10 10 CECE Oc1ccc(CN[C@H](CF)C(F)(F)F)cc1O 2012895925 KQELWKGDWCDZFT-SECBINFHSA-N 253.195 2.088 10 10 CECE CO[C@H](C(=O)NCc1ccc(N)cc1)c1ccccc1 50437052 QCIJRKDMWVNBKQ-HNNXBMFYSA-N 270.332 2.273 10 10 CECE Cc1cc(N(CCO)C(C)C)ccc1CNC1CC1 50584305 APSVUNKEZKKZAN-UHFFFAOYSA-N 262.397 2.454 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])C1CC2(C1)CC(F)(F)C2 2158865675 AGFAEDAFEJCMPB-SECBINFHSA-N 288.298 2.253 10 10 CECE CCN(Cc1nnc(C)s1)c1ccc(CN)cc1 2027250003 ARLYEKYBHCILQN-UHFFFAOYSA-N 262.382 2.332 10 10 CECE C[C@@H]1CN(c2ccc(CN)cc2Cl)[C@H](C)C[C@H]1O 2032208217 OOLBEUAKOKPYFL-GPCCPHFNSA-N 268.788 2.394 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@@H]2CN(C)C)cc1 61644823 MRKPYBINQPNTBE-XJKSGUPXSA-N 261.413 2.497 10 10 CECE C[C@H]1CC[C@H](C2OCCO2)N(c2ccc(CN)cc2F)C1 2034577969 VPWCLPSATNYLHI-XHDPSFHLSA-N 294.370 2.262 10 10 CECE CCOC(=O)C(C)(C)COCc1ccc(N)cc1 2035782772 CJLGHNARXLDUCE-UHFFFAOYSA-N 251.326 2.375 10 10 CECE Cc1coc(S(=O)(=O)Nc2ccc(O)c(F)c2)c1 2036560066 JVUUHZWVYPKZBQ-UHFFFAOYSA-N 271.269 2.234 10 10 CECE Nc1ccc(O)c(CN2CCC[C@]23CCSC3)c1 2040687803 XQWZKZUCPDLOCM-CQSZACIVSA-N 264.394 2.446 10 10 CECE CN(Cc1cc(Cl)ccc1O)[C@H]1CN2CC[C@H]1C2 2040874550 OHGUFIJCBLVGIY-GWCFXTLKSA-N 266.772 2.182 10 10 CECE C[C@@H]1CC[C@@H](CN(C)S(=O)(=O)Cc2ccc(N)cc2)C1 2157889333 GDKMENYDKKKWAE-TZMCWYRMSA-N 296.436 2.467 10 10 CECE COCC1(c2noc(CCc3ccc(N)cc3)n2)CC1 2157886941 YQWOQRLBDYREIN-UHFFFAOYSA-N 273.336 2.115 10 10 CECE COc1ccc(CNCCN(C)C2CCCC2)c(O)c1 71377118 QRXLHQOGSPCWOW-UHFFFAOYSA-N 278.396 2.365 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@@H](C)C[C@H](O)C1 401515995 ZBDJANWYCRDIOR-LRDDRELGSA-N 274.408 2.454 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CC[C@H](C)OC1 401500621 GVPWGEIXQFOTLP-UWVGGRQHSA-N 264.325 2.035 10 10 CECE Nc1ccc(NC(=O)N2CCC3(CCOCC3)C2)cc1 312488438 IQGRSXOKCCIVIF-UHFFFAOYSA-N 275.352 2.303 10 10 CECE COCC(C)(C)N(C)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 312534326 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CC(C)[C@H]1CN(c2c(F)cc(CN)cc2F)CCO1 708871365 JQBNWTUOICXKNA-CYBMUJFWSA-N 270.323 2.285 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@@H]3CCC[C@@H]32)cc1 378683535 ZIGOMPDRIQJLBX-FZMZJTMJSA-N 259.353 2.082 10 10 CECE CCN1CC[C@H](N(C)c2ccc(CN)cc2Cl)C1 688584794 VBDGHKYRZBPGGJ-LBPRGKRZSA-N 267.804 2.329 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCCC[C@@H]1C1CC1 709940659 FJHUABKQNFCMOJ-YPMHNXCESA-N 266.345 2.398 10 10 CECE CC(C)NCc1cc(F)c(N2CCC23COC3)c(F)c1 2171805428 NQFAVNSNEPPNRF-UHFFFAOYSA-N 282.334 2.442 10 10 CECE C[C@@H](CNCc1ccc(O)cc1O)[C@@H]1CCCCO1 711965552 OXQPTMDAOTVGOG-NHYWBVRUSA-N 265.353 2.393 10 10 CECE CC[C@H](NC)c1ccc(N(C)C[C@H](COC)OC)cc1 691274494 VXJNCRCUKUVQMK-CVEARBPZSA-N 280.412 2.455 10 10 CECE CC(C)(C)c1cc(=NCCc2ccc(N)cc2)[nH]cn1 380521189 RJJUHVOBIRSQAS-UHFFFAOYSA-N 270.380 2.433 10 10 CECE CCN1CCc2cc([C@H](O)[C@H]3CCC[C@@H]3CN)ccc21 2163073848 MXEDIJXYPHUQHB-VYDXJSESSA-N 274.408 2.477 10 10 CECE NCc1ccc(N2C[C@@H]3CCO[C@H]3C2)c(C(F)(F)F)c1 2172043912 HFLONOKCBZGODF-GWCFXTLKSA-N 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260.316 2.062 10 10 CECE COc1ccc(N2C[C@H](O)C(C)(C)C2)c(OC)c1C 2277977362 OINOZFAQIQWAMF-ZDUSSCGKSA-N 265.353 2.219 10 10 CECE CSc1ncc(CNC(=O)C[C@H]2CCC[C@H](N)C2)s1 2269091550 YJDBVMWVEBWCCW-UWVGGRQHSA-N 299.465 2.389 10 10 CECE Cc1cc(N2CCN(C3CC3)CC2)ccc1[C@@H](C)O 2269676841 AWVYFUVBEGJVBW-CYBMUJFWSA-N 260.381 2.333 10 10 CECE Cc1cc(CCN2CCCc3cc(CN)ccc32)on1 2280097429 QFWPWSQHXPLXBL-UHFFFAOYSA-N 271.364 2.437 10 10 CECE COc1ncc(N[C@@H](C)c2ccccc2O)nc1OC 2280715013 GIOMYQVBSRAMCK-VIFPVBQESA-N 275.308 2.373 10 10 CECE CCS(=O)(=O)C[C@@H](C)N(C)c1ccc([C@H](C)O)c(C)c1 2285175082 RBRGWHPBLQAECB-OLZOCXBDSA-N 299.436 2.308 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)[S@](=O)C1C[C@@H]2C[C@H]2C1 2285665818 HKIRETDLKINXJB-GGRBLDGOSA-N 292.404 2.143 10 10 CECE COc1cc(OC)c(N(C)[C@H]2CCC[C@H]2O)c(OC)c1 2287067109 DYTPEGSYMJSMNH-NWDGAFQWSA-N 281.352 2.062 10 10 CECE CN[C@H](C)c1ccc(N(C[C@H](C)O)C2CCC2)cc1O 2288052874 BBELNSXCBSSWCS-NWDGAFQWSA-N 278.396 2.412 10 10 CECE O=C(/C=C\c1cnccn1)N1CCc2cc(F)c(F)cc21 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O=C(O)[C@@H]1CCC[C@@H]2[C@H]1CCN2Cc1ccccc1O 2173155818 OCIQNSSLHKIZFP-BFHYXJOUSA-N 275.348 2.467 10 10 CECE CCNCc1ccc(N(C)C2CC(C(N)=O)C2)c(Cl)c1 703491385 XPCJCOBEHCAICD-UHFFFAOYSA-N 295.814 2.150 10 10 CECE C[C@H]1C[C@@H](O)CCN1c1ccc(CNC2CC2)cc1 706002899 WKGPLDURIXRORG-LRDDRELGSA-N 260.381 2.288 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3CN(C)C[C@@H]3C2)cc1 706802454 CJCJEBMXSSSPMH-BMFZPTHFSA-N 273.424 2.355 10 10 CECE CN1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(c2ccc(N)cc2)C1 707793635 NFUSQBCQERPLMB-KSYCFECVSA-N 257.381 2.045 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H]2CN(C)CCO2)c(Cl)c1 707863964 PMAFMHBSGGKPGX-YPMHNXCESA-N 297.830 2.127 10 10 CECE CCN([C@@H](C)C(=O)O)[C@H](C)c1cc(OC)ccc1O 707970431 CPKIWCQDLPNSFB-ZJUUUORDSA-N 267.325 2.257 10 10 CECE CC[C@@]1(O)CCCN(Cc2cc(C(C)=O)ccc2O)C1 710246448 DMPVMVXWGOQGOD-MRXNPFEDSA-N 277.364 2.332 10 10 CECE CC[C@@H]1CN(c2ccc([C@H](C)O)c(O)c2)C[C@H](C)O1 689187951 CYPWVFHWDXPRQH-GMXVVIOVSA-N 265.353 2.449 10 10 CECE c1cc(N2CCCC2)ccc1CNC[C@]12COC[C@@H]1C2 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COc1ccc(CN(C)[C@H]2CCO[C@@H](C)C2)c(O)c1 721480299 VOKQZTIBVRYSEV-AAEUAGOBSA-N 265.353 2.400 10 10 CECE CCS[C@H]1CCCN(C(=O)c2ccc(O)c(O)c2)C1 394920344 MYXWDMBERJPHEW-NSHDSACASA-N 281.377 2.456 10 10 CECE C[C@H]1C[C@@H](CO)CN(c2ccc([C@H](C)N)cc2F)C1 398905873 HKEPXVGXPOVOHW-SDDRHHMPSA-N 266.360 2.300 10 10 CECE CN1CCc2cc(N3C[C@@H]4CCCC[C@]4(N)C3)ccc21 2169622216 AMONFMYWBHPLOT-YOEHRIQHSA-N 271.408 2.387 10 10 CECE C[C@H](N)c1ccc(N2CCS[C@H]3COCC[C@@H]32)cc1O 2170488527 XWZQRBCVBCMZAT-XEGUGMAKSA-N 294.420 2.123 10 10 CECE Oc1cccc(F)c1CN1CCO[C@@H](C(F)(F)F)C1 1137838577 CXYPKMOJWBXXTK-LLVKDONJSA-N 279.233 2.294 10 10 CECE Nc1ccc(CCOc2ccc(C(=O)O)c(N)c2)cc1 2199009247 FIPLRYLBSVZFER-UHFFFAOYSA-N 272.304 2.171 10 10 CECE CN(c1ccc(C=CC(=O)O)cc1)[C@H]1COC2CC1C2 2183059357 JEASECLTXVDIED-ZALBZXLWSA-N 273.332 2.398 10 10 CECE O=c1cc(-c2ccncc2)c2ccc(O)c(O)c2o1 1529596315 HXAJSJYICFHSBU-UHFFFAOYSA-N 255.229 2.266 10 10 CECE C[C@@H](O)c1ccc(N(C)CC23CC(C)(CO2)C3)cc1O 2194327155 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Cc1nscc1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2213582326 GXENOGQULUYJPP-RKDXNWHRSA-N 251.315 2.413 10 10 CECE Cc1nccn1[C@H](C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2185981351 YNLLTYWQURWKNW-ZYHUDNBSSA-N 276.344 2.444 10 10 CECE COc1cccc(O)c1CNC[C@H]1C[C@H]1C(F)F 2042581133 LTAWBWDBQPISSU-RKDXNWHRSA-N 257.280 2.392 10 10 CECE CC[C@@H](C)N[C@H](C(=O)OC)c1c(O)cccc1F 2042606790 DBGBUCSJNIVQEE-PELKAZGASA-N 255.289 2.134 10 10 CECE Oc1ccc(CNC2C[C@@H]3CSC[C@H]3C2)cc1O 2042847081 MIRNKUQLQMADKT-GHMZBOCLSA-N 265.378 2.329 10 10 CECE COc1ccc(N(C)[C@@H]2CNCC[C@H]2C)c(F)c1 2045212305 GBLWATFJXGFVAJ-QMTHXVAHSA-N 252.333 2.269 10 10 CECE CN(CCCOc1ccc(N)cc1)CC[C@H]1CCOC1 2196317872 UNILUYPVHRQTCZ-AWEZNQCLSA-N 278.396 2.396 10 10 CECE CN(Cc1cc2c(cc1O)OCO2)CC(C)(C)F 2047226671 TVUZJRALVPLAFV-UHFFFAOYSA-N 255.289 2.301 10 10 CECE CO[C@H]1C[C@@H](CCNCc2ccc(O)c(O)c2)C1 2049047248 XKSNUQRDFVFQKM-KLPPZKSPSA-N 251.326 2.003 10 10 CECE CC(C)(C)[C@H]1NC[C@@]1(O)c1ccc(N2CCCC2)cc1 2196878396 JEFAMWCKAHNJEZ-NVXWUHKLSA-N 274.408 2.492 10 10 CECE COC1(CC(=O)NCC2(CN=[N+]=[N-])CC2)CCC1 2054031848 PURANRDRSKDCEH-UHFFFAOYSA-N 252.318 2.152 10 10 CECE Cc1c(-n2c(C)ccc2C)cccc1S(N)(=O)=O 2055383371 SHSPAPIVAIKFNC-UHFFFAOYSA-N 264.350 2.050 10 10 CECE C[C@]1(C(F)F)C[C@H]1CNCc1cccc(O)c1O 2057262511 YNBJKVAFSGWERC-ZANVPECISA-N 257.280 2.479 10 10 CECE C[C@H]1OCC[C@@H]1CCNCc1cccc(O)c1O 2057455728 UCZRGJUOQBCAKK-MNOVXSKESA-N 251.326 2.003 10 10 CECE C[C@@H]1OCC[C@@H]1CN(C)Cc1cc(F)ccc1O 2057469092 OLNKQLPHEQLATN-WDEREUQCSA-N 253.317 2.388 10 10 CECE CN1[C@H]2CCC[C@H]1CN(c1c(F)cc(CO)cc1F)C2 2187622311 HTIYYIOQAZNDDB-RYUDHWBXSA-N 282.334 2.130 10 10 CECE CN(C)C[C@@H]1CN(c2ccc(CN)cc2F)C(C)(C)C1 2192942244 ALOKRPDXYKIVTR-CYBMUJFWSA-N 279.403 2.451 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H]2CCC(=O)N(C)C2)c(Cl)c1 2188481734 ATBYNJBWDUZDHI-CMPLNLGQSA-N 295.814 2.417 10 10 CECE Cc1ncn(C)c1[C@@H](O)c1ccc(N2CCCC2)cc1 2188542984 MJOKNYPURMNCGG-INIZCTEOSA-N 271.364 2.410 10 10 CECE CSCCCN(C)c1ccc(CO)c([N+](=O)[O-])c1 2068304558 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10 10 CECE COc1ccc(N2CCCC[C@H](O)C2)c(OC)c1C 2277996015 UFBHBFKUQDRUOF-LBPRGKRZSA-N 265.353 2.363 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)c2cccc3c[nH]nc23)C1 2238711708 SWKQFPUSWRRKNI-VIFPVBQESA-N 270.296 2.335 10 10 CECE CN(C)C[C@@H]1C=CCN1c1ccc2c(c1)CCC[C@H]2O 2238706920 MWNOGBRBQSCANF-DOTOQJQBSA-N 272.392 2.363 10 10 CECE Cc1ccc(O)c([C@H](C)N2CC=C[C@@]2(C)C(=O)O)c1 2228854351 WZQONPYLMIWWJR-NHYWBVRUSA-N 261.321 2.477 10 10 CECE CC(=O)c1ccc(O)c(CN2CCOC[C@H]2C(C)C)c1 2240255222 LNIUGJGHMIZMFY-HNNXBMFYSA-N 277.364 2.452 10 10 CECE CCC1(C)CN(C(=O)N2CC[C@H](CN=[N+]=[N-])C2)C1 2255960023 KJMQABFDDCPWLT-SNVBAGLBSA-N 251.334 2.471 10 10 CECE Nc1cccc(Cl)c1N[C@H]1CCNCC1(F)F 2246412018 VTMQTCOXGMTWEI-VIFPVBQESA-N 261.703 2.331 10 10 CECE C[C@H](CCN(C)C)N(C)c1ccc(CO)cc1F 2260330865 HEPKJXXROUAXFY-LLVKDONJSA-N 254.349 2.094 10 10 CECE COc1ccc(N(C)C[C@H](C)CO)c(OC)c1C 2263598024 DNDNPWSYAUDOLT-JTQLQIEISA-N 253.342 2.077 10 10 CECE Cc1cc(N2CCN(C)C[C@@H](C)C2)ccc1[C@H](C)O 2269693527 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Cc1cncc(CNCc2cc3c(cc2O)OCO3)c1 123211522 XPXLYOZVAVNUJU-UHFFFAOYSA-N 272.304 2.114 10 10 CECE C[C@H]1CN2CCC[C@H]2CN1CCCc1ccc(N)cc1 252688150 NHPQPYQSFZLEMP-YOEHRIQHSA-N 273.424 2.370 10 10 CECE COc1cc(N(C)C[C@@H]2CCO[C@@H]2C)ccc1CN 2139681970 ALTOCNUNRJAVSP-YPMHNXCESA-N 264.369 2.015 10 10 CECE CCNCCCCC(=O)NCc1cccc(C)c1O 2139752039 WHUMYIUZXHIYAS-UHFFFAOYSA-N 264.369 2.097 10 10 CECE CCNCc1ccc(N2CC[C@](C)(O)C2)cc1Cl 233543074 WYMZXPWICFICCT-AWEZNQCLSA-N 268.788 2.411 10 10 CECE CC[C@@H]1OCC[C@@H]1C(=O)N(CC)c1ccc(N)cc1 233930271 MTABNESBGZNMMY-KBPBESRZSA-N 262.353 2.437 10 10 CECE C[C@H]1CC[C@@H](N)CN1Cc1ccc(Cl)cc1O 1942495357 SLIHNIXFMXZPQB-JOYOIKCWSA-N 254.761 2.357 10 10 CECE C[C@H]1OCC[C@H]1SCC(=O)N(C)c1ccc(N)cc1 235635486 HTDJUAFOXSXJDI-ZWNOBZJWSA-N 280.393 2.142 10 10 CECE Oc1ccccc1CN(CC1CC1)C[C@H]1CCCN1 236560259 GLKSLWGIKBDLTL-OAHLLOKOSA-N 260.381 2.356 10 10 CECE CC(C)N[C@@](CSc1nccs1)(C(N)=O)C1CCC1 2142869231 IEXLMCGBCMDACS-CYBMUJFWSA-N 299.465 2.257 10 10 CECE 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262.309 2.135 10 10 CECE Cc1cccc(C(=O)N(C)Cc2ccc(N)cc2)n1 35360147 HTCCUEAKDBDKOA-UHFFFAOYSA-N 255.321 2.244 10 10 CECE C[C@H](NC(=O)CCc1ccc(N)cc1)c1cccnc1 35692724 QGSOCCRGWNQVQZ-LBPRGKRZSA-N 269.348 2.474 10 10 CECE Cc1sncc1C(=O)[C@H](O)c1ccc2c(c1)CCN2C 2150650950 WQFWCFCPKOEHKG-CQSZACIVSA-N 288.372 2.360 10 10 CECE CCCCCN(C)CC(=O)N(C)c1ccc(N)cc1 37273492 NQSXNHSSYZBKJJ-UHFFFAOYSA-N 263.385 2.354 10 10 CECE CC(C)(C)[C@@H]1C[C@](O)([C@@H](N)c2ccccc2O)CCO1 2148148322 OVWFBYRHQGPETG-DZKIICNBSA-N 279.380 2.348 10 10 CECE CCCNCc1ccc(N2CC[C@H](CO)C2)cc1C 162183486 SZSHDQDYRXDJPG-AWEZNQCLSA-N 262.397 2.313 10 10 CECE CC[C@H](C)NCC(=O)N(C)[C@H](C)c1ccccc1O 37826568 VNGPOAZUHILWRQ-NWDGAFQWSA-N 264.369 2.300 10 10 CECE Nc1ccc(OC[C@@H]2COc3ccccc3O2)cc1 38055584 VZCITDDMTBQBLN-CYBMUJFWSA-N 257.289 2.488 10 10 CECE C[C@@H]1CCS[C@H]1CN(C)C(=O)COc1ccc(N)cc1 2150868368 NOGQKNTVSVSAJE-RISCZKNCSA-N 294.420 2.248 10 10 CECE CN1CC[C@H]2CCN(CCCc3ccc(N)cc3)C[C@@H]21 2158546090 KNOMIHSYCRKRJG-RDJZCZTQSA-N 273.424 2.227 10 10 CECE Oc1ccc(F)cc1CNCC[C@H]1CN2CCC1CC2 2151296825 QUBBNCNZVVBGRO-ZDUSSCGKSA-N 278.371 2.353 10 10 CECE NCc1cc(F)c(N2CCC[C@H]3OCC[C@H]3C2)c(F)c1 2151887187 UTCWPIZJKKAMHT-SMDDNHRTSA-N 282.334 2.429 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1C[C@H]2NC(=O)Nc1ccc(N)cc1 2158643328 ZDGBINUFEUZOOH-QOBDMFJFSA-N 275.352 2.204 10 10 CECE Nc1ccc(COc2nc(Cl)nc(Cl)n2)cc1 2012666822 MBUJUYWAMAZAJB-UHFFFAOYSA-N 271.107 2.340 10 10 CECE Cc1[nH]ncc1CNCc1ccc2c(c1)CCN2C 50286732 SOJPNMIQJXZZBD-UHFFFAOYSA-N 256.353 2.000 10 10 CECE Nc1ccc(OC[C@@H](O)COCc2cccs2)cc1 51328177 XNSKGYWENGXDAG-LBPRGKRZSA-N 279.361 2.287 10 10 CECE CCn1cncc1[C@@H](N)c1ccc2c(c1)CCCN2C 2154770617 MHSKCXKLIBXLGP-INIZCTEOSA-N 270.380 2.334 10 10 CECE CN1CCc2cc([C@H](N)c3cnn(C4CC4)c3)ccc21 2154718921 JPWCOWASICPQEV-INIZCTEOSA-N 268.364 2.258 10 10 CECE CNCc1ccc(OCCn2nc(C)nc2C)c(C)c1 2155012135 DUVWZABINLLHDV-UHFFFAOYSA-N 274.368 2.002 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CC[C@H](N)C2(CCC2)C1 2155074117 FUJZYSTWGLVHDB-ABAIWWIYSA-N 276.380 2.362 10 10 CECE CO[C@H]1CCCN(c2ccc(CO)cc2[N+](=O)[O-])[C@@H]1C 2155356884 IAIRJBMNYUUJTO-YGRLFVJLSA-N 280.324 2.091 10 10 CECE CC(C)CN(CCN)Cc1cc(F)cc(F)c1O 2030265542 JHBWIOHWZXMBDB-UHFFFAOYSA-N 258.312 2.087 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(Cc2cccc(C(N)=O)c2)CC1 2155559532 DDHAAFRNDQLJSD-CYBMUJFWSA-N 273.340 2.450 10 10 CECE CCNCc1cc(F)c(N2CCCOCC2)c(F)c1 62719293 RYWHOOSDKPMTLB-UHFFFAOYSA-N 270.323 2.301 10 10 CECE CO[C@@H]1CCCN(c2ccc(CN)c(F)c2)[C@H]1C 2037813733 WQZVBHYHZIJZFM-IINYFYTJSA-N 252.333 2.288 10 10 CECE CC(C)(C)c1nc(C2=S=Nc3ccccc32)[nH]c(=N)n1 2159963044 HHNPFWHWZTVBFS-UHFFFAOYSA-N 285.376 2.062 10 10 CECE COCc1nc(-c2ccc(N(C)C)cc2)oc1CO 401109013 GBSIMCYLOWXOIV-UHFFFAOYSA-N 262.309 2.046 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C[C@@H](C)C2)cc1C 401493631 IGUFTUOTJNEYPG-WBMJQRKESA-N 262.397 2.312 10 10 CECE Cc1ccc([C@@H](NCCCN=[N+]=[N-])C(N)=O)c(Cl)c1 404670633 BSBCAEPDEMQYMO-LLVKDONJSA-N 281.747 2.465 10 10 CECE CN1CC[C@@]2(CCN(CCCc3ccc(N)cc3)C2)C1 312778384 AIAJMGDSPAIKLX-QGZVFWFLSA-N 273.424 2.229 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CCC(F)(F)C2)cc1 313350498 NGNUFQUUESZSKX-LLVKDONJSA-N 284.306 2.342 10 10 CECE CN1CCCc2cc(CNC[C@H](O)C3CCC3)ccc21 315829428 ZWQRWCNUZWEYTB-KRWDZBQOSA-N 274.408 2.320 10 10 CECE CCN[C@H](C)c1ccc(N2CCNC(=O)CC2)cc1Cl 78927773 YBZJBPDBWBVPTI-LLVKDONJSA-N 295.814 2.337 10 10 CECE CC1(C)C[C@@H](c2noc(-c3cccc(O)c3O)n2)CO1 2159392912 MBUQDFBWJKGAOY-MRVPVSSYSA-N 276.292 2.430 10 10 CECE c1cc2c(cc1CN[C@@H]1CC[C@@H]3NCC[C@H]3C1)CCO2 2160559377 NCUFKVVTXBBRFG-IMJJTQAJSA-N 272.392 2.242 10 10 CECE CCOCCOc1ccc(N2CCC[C@H](N)C2)c(F)c1 87439517 BGBLUCMRCFYVKA-LBPRGKRZSA-N 282.359 2.169 10 10 CECE COc1ccc([C@H](C)NCC2(CN(C)C)CC2)c(O)c1 2161185137 JBYXYPWBXOIMOK-LBPRGKRZSA-N 278.396 2.393 10 10 CECE Nc1ccc(N2C(=O)N[C@@H]3CCCCC[C@H]3C2=O)cc1 94748589 BHWLCRLKMVUDRL-CHWSQXEVSA-N 273.336 2.274 10 10 CECE Nc1ccc(CCCN2CC[C@H]3CC[C@@]32C(=O)O)cc1 2179655487 RZNVHJKMRHETBO-CJNGLKHVSA-N 274.364 2.141 10 10 CECE CC1(C)CCN1c1cc2c(cc1Cl)[C@@H](O)C(=O)N2 706792127 LKWCLJNAUODRDP-LLVKDONJSA-N 266.728 2.314 10 10 CECE COc1ccc(N2CCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 380265873 UZKRAOFYRMNCIZ-WDEREUQCSA-N 280.324 2.343 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCCC12CCOCC2 380321985 ZIUJXPQLJZGBJM-CYBMUJFWSA-N 282.344 2.081 10 10 CECE CN1CCC[C@H](CN2CCCc3cc(CN)ccc32)C1 691530794 DKVASFIGMXKVOL-HNNXBMFYSA-N 273.424 2.240 10 10 CECE CCn1nc(C)cc1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 691690939 XKHUIKYBTUNREU-SNVBAGLBSA-N 262.317 2.126 10 10 CECE COC(C)(C)COc1ccc(N2CCC[C@@H](N)C2)cc1 381800047 PROHBQDKWRCKEW-CYBMUJFWSA-N 278.396 2.418 10 10 CECE CN(C[C@]12CCC[C@@H]1C2)S(=O)(=O)Cc1ccc(N)cc1 693822335 GTLKBRHTWQMMND-UKRRQHHQSA-N 294.420 2.221 10 10 CECE CN1CCCc2cc([C@H](O)[C@]34C[C@@H]3CCCN4)ccc21 2163098538 WFVBDLSTZOAXPM-XIRDDKMYSA-N 272.392 2.245 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H]2CCC[C@@]2(CN)C1 383275548 HDKNDANDYVZRHF-XHBSWPGZSA-N 276.380 2.220 10 10 CECE CC(C)C[C@H](C(=O)O)N(C)Cc1ccc(N)cc1 695055294 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CC(C)[C@@](C)(O)CN1CCc2cc([C@@H](C)N)ccc21 2087140079 XHNRSIGSQCIFIO-WBMJQRKESA-N 262.397 2.476 10 10 CECE COc1nccc(CN2CCC[C@@H](CN=[N+]=[N-])C2)n1 2107558182 RLVGIOGFTPVZHL-JTQLQIEISA-N 262.317 2.008 10 10 CECE CCCN[C@H](c1ccc2c(c1)CCCN2C)[C@H](C)N 2107975121 QQHJNCQSKUNITF-LRDDRELGSA-N 261.413 2.457 10 10 CECE C[C@@H](O)c1ccc(N2CC3(CC(N(C)C)C3)C2)cc1 2108166002 WSTWOCWZBQPJCF-GFCCVEGCSA-N 260.381 2.270 10 10 CECE COc1ccc(N(C)Cc2ccc(=N)[nH]c2)cc1F 2109351342 OKSIDMJDECYSSW-UHFFFAOYSA-N 261.300 2.278 10 10 CECE CCCOCC1CN(c2ccc([C@@H](C)N)c(O)c2)C1 2109584017 LBUAHHXYZNXIOE-LLVKDONJSA-N 264.369 2.275 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1C[C@H]2CCC[C@H]1C2 2089621907 OLUAQJKJPBUKDF-JQWIXIFHSA-N 262.309 2.466 10 10 CECE CCC[C@@H](C(=O)O)[C@H](O)c1ccc2c(c1)CCN2C 2110646626 SWLZVIVUSITVIV-TZMCWYRMSA-N 263.337 2.213 10 10 CECE C[C@H](NCCc1ccc(O)c(O)c1)c1ccncc1 2091748370 QEOOFNKENUWYKR-NSHDSACASA-N 258.321 2.386 10 10 CECE COc1ccc2c(c1)NC(=O)C[C@H](C(F)(F)F)N2C 2093243342 SOZNZTUEQYVZPR-SNVBAGLBSA-N 274.242 2.405 10 10 CECE CNCc1ccc(N2CCOC3(CCC3)C2)c(C)c1 2095417639 PBXRNMGLIYOQQY-UHFFFAOYSA-N 260.381 2.474 10 10 CECE COc1nc([C@@](C)(N)c2ccc(N(C)C)cc2)cs1 2098362425 MEPVVSNZFIMANK-AWEZNQCLSA-N 277.393 2.440 10 10 CECE CO[C@@H]1CCCN(c2c(F)cc(CN)cc2F)[C@@H]1C 2099131702 SNLXWCLRBVEXBU-NOZJJQNGSA-N 270.323 2.427 10 10 CECE COc1ccc([C@H](C)NCC2CC(CO)C2)c(O)c1 2112386891 VNODRDRVBOWCOO-UNXYVOJBSA-N 265.353 2.070 10 10 CECE CCN(C[C@H]1CCOC1)c1ccc([C@H](C)O)c(O)c1 2113611603 CIUTZHFULRKFHQ-NWDGAFQWSA-N 265.353 2.308 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1nnc(O)o1 2201209227 RESAEMGOGPUYEN-IUCAKERBSA-N 275.308 2.127 10 10 CECE CNCc1ccc(N2CCOC(C)(C)[C@H]2C)cc1OC 2204543634 PYZSAGWCVMRSJW-GFCCVEGCSA-N 278.396 2.418 10 10 CECE COc1cc(N(CCN(C)C)CC(C)C)ccc1CN 2204546786 DQLRCJBDWVNIIO-UHFFFAOYSA-N 279.428 2.178 10 10 CECE COc1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]32)cc1Cl 2214343943 XUNYPHFBSXXXEO-DLOVCJGASA-N 253.729 2.308 10 10 CECE Cc1cccc(CNc2ncc(C(=O)O)nc2C)c1O 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CECE CN(c1ccc(=O)n(C)c1)[C@@H]1CCc2cccc(O)c21 2233246718 SPERHOCLSRELSK-CYBMUJFWSA-N 270.332 2.215 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1nc(C(N)=O)cs1 2225540186 OSGGFQIZIRPFEN-QMMMGPOBSA-N 277.349 2.145 10 10 CECE COc1ccc(N2CCO[C@@H]3CCCC[C@@H]32)c(CN)c1 2235962270 JFWUFTJUQAGUPN-JKSUJKDBSA-N 276.380 2.302 10 10 CECE COc1ccc(N(C)C2[C@@H]3[C@@H]4C[C@H]5[C@@H]2[C@H]5[C@@H]43)c(C=O)c1 2235983612 AVNNCYBOKYPFRW-HBCXIOBYSA-N 269.344 2.454 10 10 CECE COc1ccc(N(C)[C@H]2C[C@@H]3COC[C@@H]3C2)c(CO)c1 2236003024 PFPACVVMGUDNFO-WDNDVIMCSA-N 277.364 2.049 10 10 CECE COc1ccc(N(C)[C@@H](C)[C@@H]2CCCOC2)c(CO)c1 2236000553 AJHMBLBPMHNBMZ-QWHCGFSZSA-N 279.380 2.439 10 10 CECE O=c1c2c(ccn1CC=Cc1ccccc1)CCNC2 2236806348 SZZOGVKHPCJIPC-UHFFFAOYSA-N 266.344 2.207 10 10 CECE COCCNCC(F)(F)COc1ccc(N(C)C)cc1 2237680941 UEXFGZZVXOGDOG-UHFFFAOYSA-N 288.338 2.003 10 10 CECE CN(C)c1ccc(OC[C@@](O)(CN)C2CCCC2)cc1 2237696015 PCTUZKSABRXOOQ-INIZCTEOSA-N 278.396 2.011 10 10 CECE COc1ccc(N(C)C[C@@H]2CC[C@@H]2OC)c(CN)c1 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234718025 ARWKORMSHGATPY-QWRGUYRKSA-N 251.326 2.127 10 10 CECE Nc1oncc1-c1c(Br)cc(F)c(O)c1O 258480388 IPNOQZNLDSZEQQ-UHFFFAOYSA-N 289.060 2.237 10 10 CECE CC(C)(O)c1c(F)cc(O)c(O)c1Br 258560285 WZXAVJJPDONLBG-UHFFFAOYSA-N 265.078 2.227 10 10 CECE CCNCc1cc(F)c(N2CC[C@@H](C)[C@H]2CO)c(F)c1 299967153 MCSMCBORZSGSRG-QMTHXVAHSA-N 284.350 2.281 10 10 CECE CC(=O)c1ccc2c(c1)c1c3c(oc1n2C)CNCC3=O 606608748 UGRUMIOTELELBI-UHFFFAOYSA-N 282.299 2.413 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H]2COC[C@@H]2C1 700787180 DQPXGLPPWXWXCX-WOPDTQHZSA-N 263.337 2.127 10 10 CECE COC(=O)CC1(NCc2ccccc2O)CCCC1 279639375 JCSZPFIJNIASQW-UHFFFAOYSA-N 263.337 2.358 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC[S@@](=O)C[C@@H]1C 2223981643 WWRPFMJMZAIAPB-VNBZBWLYSA-N 267.394 2.006 10 10 CECE CC[C@H](Oc1ccccc1Cl)C(=O)OCC(=O)C(C)=O 808545317 WLCLZPDOGZNAIK-LBPRGKRZSA-N 298.722 2.199 10 10 CECE CN1CCCC[C@@H]1CCC(=O)NCc1ccccc1O 806717508 IMLQAJXWAMGYLA-CQSZACIVSA-N 276.380 2.273 10 10 CECE COCC1(CNCc2cccc(OC)c2O)CC=CC1 2166493440 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Cn1ccc([C@H]2CCCN(C(=O)Nc3ccc(N)cc3)C2)n1 926140421 AJAUMLVJBCEPOC-LBPRGKRZSA-N 299.378 2.414 10 10 CECE CCn1[nH]c(C)nc1=NCc1c(O)cc(C)cc1Cl 840887197 HCAOBKGMGCGOGA-UHFFFAOYSA-N 280.759 2.308 10 10 CECE COc1ccc(N2CC[C@H](N[C@H]3CCNC3(C)C)C2)cc1 925714901 YTYQXILFIKCALA-BBRMVZONSA-N 289.423 2.004 10 10 CECE CCN(Cc1nccnc1C)c1ccc(CN)cc1 687305515 FQDGPPVIOKVJSK-UHFFFAOYSA-N 256.353 2.270 10 10 CECE Cc1c(CNC2CC(CO)C2)n(C)c2ccccc12 698976024 LZDGKJHCTNABLP-UHFFFAOYSA-N 258.365 2.347 10 10 CECE C[C@H](NC(=O)[C@]1(C)CCCCN1)c1ccccc1O 870988299 MEEMGTTYDNYCGO-NHYWBVRUSA-N 262.353 2.102 10 10 CECE Cc1cc(NC(=O)c2cccc(O)c2O)cnc1C 1455226227 OMWXULMQBLHCRO-UHFFFAOYSA-N 258.277 2.362 10 10 CECE CCOc1ccc(CN[C@@H]2CCOC[C@H]2C)c(O)c1 762504695 VTPZCADTXBKAAW-BXUZGUMPSA-N 265.353 2.306 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@H]2C[C@]1(C(=O)O)C2 1877385493 OIOXUWSQNZNCOG-UINNMSKDSA-N 265.284 2.141 10 10 CECE CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)CCN=[N+]=[N-])C1 953126591 GRQMNNYJHUNUTJ-SNVBAGLBSA-N 297.359 2.203 10 10 CECE CCN(C(=O)C12CCC(CC1)O2)c1ccc(N)cc1 1876795998 XCZOGLISXQAGML-UHFFFAOYSA-N 260.337 2.333 10 10 CECE NCc1cc(F)c(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)c(F)c1 1877071632 IXNXPGSMBYQYHF-VROVMSAKSA-N 274.261 2.371 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1CCC2(CC2)[C@H]1O 1877524398 RHASUYHKSQGXDP-ZFWWWQNUSA-N 261.365 2.375 10 10 CECE CC[C@@H](NCc1cn(C)nn1)c1ccc(N(C)C)cc1 783533892 ZTGJOVPAGRZBAS-OAHLLOKOSA-N 273.384 2.122 10 10 CECE Oc1ccccc1CNCC1(Br)CC1 1956599330 UDAHAVXPIUGHMW-UHFFFAOYSA-N 256.143 2.409 10 10 CECE CCc1cccc(CNC[C@@]23CCOC[C@H]2C3)c1O 1880195667 OIDBQTQJKYPQGY-ZBFHGGJFSA-N 261.365 2.471 10 10 CECE C[C@H](O)c1cc(F)c(N2CCN(C)[C@@H](C)C2)c(F)c1 1880488212 UXNHWOUIUOHNGO-UWVGGRQHSA-N 270.323 2.158 10 10 CECE CN(Cc1ccccc1O)CN1C(=O)c2ccccc2C1=O 1881222364 OYCNKYVCRYVGJS-UHFFFAOYSA-N 296.326 2.078 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)CCNC(=O)OC(C)(C)C 1882298782 XLCMMJOXHHXXLZ-UHFFFAOYSA-N 285.348 2.060 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@@H]2C[C@H](C1)O2 1899781605 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276.380 2.194 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@H]3CNC[C@]3(C)C2)c1 703613082 AGTUUTKKYPRHLG-WOSRLPQWSA-N 260.381 2.303 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)[C@@H]1CCCC12CC2 706608653 PXNQZSGCSLWDRD-KGLIPLIRSA-N 271.364 2.407 10 10 CECE CC[C@@H](O)c1ccc(N(C)CCN(C)C(=O)OC)cc1 690805552 NFLKJZDMKCPDMY-CQSZACIVSA-N 280.368 2.264 10 10 CECE Cc1cc(C(=O)N(Cc2ccc(N)cc2)C(C)C)n[nH]1 716631439 OCCCOUOSWDPGKZ-UHFFFAOYSA-N 272.352 2.351 10 10 CECE CCC[C@@H](CCO)NCc1ccc(OC)cc1O 716886752 REJWFVDIALIUBB-LBPRGKRZSA-N 253.342 2.042 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@@H]2CCN(C)C2)cc1 71189405 DUFLJYSOOOCFNO-ZIAGYGMSSA-N 261.413 2.355 10 10 CECE CC(C)(C)c1ccc([C@H](NCCN=[N+]=[N-])C(N)=O)cc1 90258066 UIHUYTTZSLVALY-LBPRGKRZSA-N 275.356 2.410 10 10 CECE COC[C@H]1CCCN1c1ccc(CN)c(Cl)c1 696542393 VQNQETCDYDGZCJ-GFCCVEGCSA-N 254.761 2.414 10 10 CECE COc1ccc(CN[C@@H]2C[C@@H]3OCCC[C@@H]32)c(O)c1 190339098 KISHIRBZGDJIPD-NFAWXSAZSA-N 263.337 2.058 10 10 CECE O=C1Nc2cc(N3CC[C@@H]3C(F)F)c(Cl)cc2[C@@H]1O 2115273170 ZCEKBQQZHQQNEA-SCZZXKLOSA-N 288.681 2.169 10 10 CECE Cc1cc(NC(=O)c2cc(O)cs2)cc(C(N)=O)c1 1449893995 KLLJTXQZHXUNCG-UHFFFAOYSA-N 276.317 2.113 10 10 CECE CC1=NN(C)C(=O)/C1=C/c1cc(Br)ccc1O 1865672157 NRKWPOIHKRWAKQ-UXBLZVDNSA-N 295.136 2.386 10 10 CECE O=Cc1c[nH]c(C(=O)NCc2cc(Cl)ccc2O)c1 1452935843 MEYSRQCUXYNDDQ-UHFFFAOYSA-N 278.695 2.116 10 10 CECE COc1cc(CNCC(C)C)ccc1N1CCC(O)CC1 211680807 YZZJVRXHJIRAPR-UHFFFAOYSA-N 292.423 2.402 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)[C@H]2CCCC[C@@H]2F)CC1 2118935287 DAVMKSIBXRAKPP-UWVGGRQHSA-N 290.364 2.277 10 10 CECE COc1ccc(CN[C@@H](CO)c2cscn2)cc1C 2119000719 CUXRFGIMUOSSBF-LBPRGKRZSA-N 278.377 2.283 10 10 CECE C=C/C=C/CCNC(=O)/C=C/c1ccc(O)c(O)c1 1471634990 MMCSUXBYGBPERO-DQTVNRMBSA-N 259.305 2.360 10 10 CECE CC1CCN(C(=O)CN2CCC[C@@H]2CN=[N+]=[N-])CC1 2123018997 IQBDVWMWPDJMIR-GFCCVEGCSA-N 265.361 2.020 10 10 CECE Cc1ccc2c(c1)OCCN2C(=O)Cc1ccc(O)c(O)c1 1620991479 ZVZJNODRXWLKNY-UHFFFAOYSA-N 299.326 2.374 10 10 CECE COc1cc(N)c(N(C)CC[C@@H](C)OC)cc1OC 2123324104 PORYKGVHHLQIQV-SNVBAGLBSA-N 268.357 2.147 10 10 CECE O=[N+]([O-])c1c(Sc2nccs2)ccnc1O 1559077680 COWPSRWLYKMYEC-UHFFFAOYSA-N 255.280 2.303 10 10 CECE O=C(Cc1ccc(O)c(O)c1)N1CCC[C@@H](CCF)C1 1645439936 VWRXXUYXILYSCJ-NSHDSACASA-N 281.327 2.239 10 10 CECE C[C@@](O)(C(=O)NCc1c(O)ccc2ccccc12)C1CC1 1645440414 CFNCJVUKYWSRJU-KRWDZBQOSA-N 285.343 2.323 10 10 CECE CC(C)Cn1ncnc1CN(C)CCCN=[N+]=[N-] 1912146846 UWIJOTLRJKGLOM-UHFFFAOYSA-N 251.338 2.066 10 10 CECE CN(CCCN=[N+]=[N-])S(=O)(=O)c1cc(F)ccc1F 1912167069 GCMUZCGNTYTUPG-UHFFFAOYSA-N 290.295 2.286 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)C[C@H]1CCCOCC1 1912178711 OFZCULBINKLWHF-NWDGAFQWSA-N 266.345 2.495 10 10 CECE [N-]=[N+]=NC1CN(C(=O)[C@H]2CSC(c3ccccc3)=N2)C1 1912150799 YLDNNHDAZAOFQE-LLVKDONJSA-N 287.348 2.070 10 10 CECE C[C@@H](CS(=O)(=O)N1CCC[C@H]1CN=[N+]=[N-])C1CC1 1912198692 JNRLKWSMTPFUSH-ONGXEEELSA-N 272.374 2.137 10 10 CECE COc1ccc(C(=O)N2CC[C@H](N=[N+]=[N-])C2)cc1OC 1912171935 QENMNOYGWDAKEA-JTQLQIEISA-N 276.296 2.229 10 10 CECE Cc1ccc(S(=O)(=O)N2CC[C@H](N=[N+]=[N-])C2)c(C)c1 1912185388 PBUMFMMXEQIGOE-NSHDSACASA-N 280.353 2.377 10 10 CECE CC[C@@H](CCOC)C(=O)N1CCC[C@H]1CN=[N+]=[N-] 1912192583 HTGZQXIKAZVRPD-QWRGUYRKSA-N 254.334 2.350 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)c1c(O)cccc1F 1912211283 VACHRLILYTWBNW-UHFFFAOYSA-N 252.249 2.304 10 10 CECE Cc1conc1C(=O)NCc1cc(Cl)ccc1O 1583821271 XPVVVYQCKKRONH-UHFFFAOYSA-N 266.684 2.272 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@@H]1C=CCCN1 2126016403 ZLTOANAAOKOKSN-HOTGVXAUSA-N 258.365 2.238 10 10 CECE CC(C)CN(CCO)c1ccc2c(c1)CCC[C@@H]2N 2128274015 YLBLXTVKOYLZJL-INIZCTEOSA-N 262.397 2.477 10 10 CECE CN[C@H]1CCCc2cc(N3CC(CCO)C3)ccc21 2128268699 KGYKCTOUCGEVSG-INIZCTEOSA-N 260.381 2.102 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)CC[C@H]1O 2128273514 WVDPICKEEITMQW-XZJROXQQSA-N 261.365 2.263 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@@H]4COCC[C@@H]43)ccc21 2128309913 AESVZFWYESAGQV-WQVCFCJDSA-N 258.365 2.248 10 10 CECE 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274.408 2.454 10 10 CECE CN(C)c1ccc([C@@H](OCCCN)C2=COCC2)cc1 2294289235 FDJZAXTZLXXHGS-MRXNPFEDSA-N 276.380 2.463 10 10 CECE COc1ccc(N2[C@H](CO)C[C@@H]3OCC[C@H]32)c(C)c1C 2284595382 ANGKTLXYSBSDCA-BJJXKVORSA-N 277.364 2.041 10 10 CECE COc1ccc(N2C[C@H]3C[C@@H](O)C[C@H]2C3)c(OC)c1C 2295377419 FLYIILIVAXBLFD-JHJVBQTASA-N 277.364 2.362 10 10 CECE COCC[C@@H]1CNCCN1c1ccc(OC(F)F)cc1 2295959698 FXVUEIKNLHONQP-GFCCVEGCSA-N 286.322 2.103 10 10 CECE COc1cc(OC)c(N2C[C@H](O)CC[C@H]2C)c(OC)c1 2287070440 UNVJWRWNRTWAML-GHMZBOCLSA-N 281.352 2.062 10 10 CECE C[C@H](N[C@@H]1CCCN(C2CC2)C1)c1ccc(O)cc1O 2288809522 GLUYQDNXRNRYPE-NWDGAFQWSA-N 276.380 2.375 10 10 CECE CCc1nsc(CN(C)CCOc2ccc(N)cc2)n1 2288833863 LZWNEZBTGXPRQY-UHFFFAOYSA-N 292.408 2.194 10 10 CECE O=C(N[C@@H]1CCC[C@@H]1CF)[C@@H]1CNc2ccccc2N1 2288946119 JBDCXLJWEZJKOP-GYSYKLTISA-N 277.343 2.147 10 10 CECE COc1cccc(CNC(=O)C=C(C)C2CC2)c1O 2297494604 NFFCLYRXFMGBFP-UHFFFAOYSA-N 261.321 2.373 10 10 CECE N[C@](CCC1CC1)(CSc1nccs1)C(=O)O 2302270373 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CECE Cc1c([C@H](C)O)ccc(N2CCN(C)[C@@H]3C[C@@H]32)c1C 2340857928 ZLUGSNXDTJONAU-MAZHCROVSA-N 260.381 2.249 10 10 CECE COC[C@@H](C)CCN1CCc2cc(O)c(O)cc2C1 2341208084 CLYWWUUFPINATP-NSHDSACASA-N 265.353 2.129 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)C[C@H]1CCO1 2341209563 WUUUXPDZVHNISF-OAHLLOKOSA-N 260.381 2.472 10 10 CECE CSc1cc(N(C)CCN(C)C2CC2)ccc1CN 2353857045 MKARPDWWWBITTI-UHFFFAOYSA-N 279.453 2.398 10 10 CECE CN1CCc2cc([C@@H](N)[C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@@H]43)ccc21 2354608447 YQBYMRJGPMHQKT-IJVGXZNQSA-N 270.376 2.102 10 10 CECE CCOC(=O)C1=C(C)NC(=O)/C1=C/c1cccs1 106542630 QPZUKUNDNVPAON-JXMROGBWSA-N 263.318 2.098 10 10 CECE Cc1cc(N(C)CCCO)ccc1CNC(C)C 306019000 PWTZBWBCHYJRDX-UHFFFAOYSA-N 250.386 2.312 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](C)C[C@@H](O)C2)c(F)c1 401454831 BYOWZLOSRPNPRI-CMPLNLGQSA-N 284.350 2.281 10 10 CECE CCC[C@H](C)NC(=O)Cc1nnc2cc(C)ccc2n1 217389297 KTGAPAPRJDDEAC-NSHDSACASA-N 272.352 2.181 10 10 CECE C[C@H]1CN(C)CCCN1c1ccc(CN)c(Cl)c1 235694091 QFWMHEUXRFTQRE-NSHDSACASA-N 267.804 2.329 10 10 CECE COc1cccc2c1C(=O)c1cccc(N)c1C2=O 34183608 XIIKBXBGOHXWMO-UHFFFAOYSA-N 253.257 2.053 10 10 CECE CC(C)N(CCCO)CCCC(=O)Nc1ccc(N)cc1 42482930 AJNZKKPAQIFEQE-UHFFFAOYSA-N 293.411 2.080 10 10 CECE C[C@](N)(CCCCSc1nccs1)C(=O)O 45596016 PFJJVHSFULXFNZ-JTQLQIEISA-N 260.384 2.208 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H](C3)[C@@H]2CO)cc1OC 2226800767 VHFHDSCWDYJCCM-GVXVVHGQSA-N 263.337 2.053 10 10 CECE COc1cc(Cl)cc(CNCc2c[nH]nc2C)c1O 228674705 NKRMJZCUEFDQMX-UHFFFAOYSA-N 281.743 2.376 10 10 CECE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCC[C@H]1N 85367115 XFFWOKWCJJBDKY-JKSUJKDBSA-N 289.423 2.229 10 10 CECE COC(=O)[C@H](N[C@H](C)c1cc(F)ccc1O)C(C)C 94617090 GABUYZQFQNRQGF-NOZJJQNGSA-N 269.316 2.380 10 10 CECE O[C@H]1CCCCC[C@H]1Oc1ccc(N2CCNCC2)cc1 148436718 QIHLALFQKLZYAY-DLBZAZTESA-N 290.407 2.169 10 10 CECE CCNCc1ccc(OC)c(CN2CCOC[C@@H]2C)c1 50124802 DQCZKVKGTYBOKC-ZDUSSCGKSA-N 278.396 2.025 10 10 CECE COC1CCN(c2ccc([C@H](C)N)c(O)c2)CC1 93670393 ILMKKHJERBGXSU-JTQLQIEISA-N 250.342 2.027 10 10 CECE COc1cc(Cl)c(NC(=O)Nc2ccc(N)cc2)nn1 242813603 FJXVNQLIEHYUNZ-UHFFFAOYSA-N 293.714 2.365 10 10 CECE CC[C@H](C)N(CCOC)[C@H](C)C(=O)Nc1ccc(N)cc1 252028322 YTBQXCSUSDGUIE-QWHCGFSZSA-N 293.411 2.343 10 10 CECE CON(C1CCCC1)[C@@H](C)C(=O)Nc1ccc(N)cc1 2164729394 DKJIREMRDRRKBL-NSHDSACASA-N 277.368 2.402 10 10 CECE CCOc1ccc(CNCC[C@@H](O)C(F)(F)F)c(O)c1 809743648 YPKNTXDJYXQXAT-GFCCVEGCSA-N 293.285 2.194 10 10 CECE CCOCc1nc(Cl)cc(=NCc2ccc(N)cc2)[nH]1 2162362380 OEGZPEDRPLNVIR-UHFFFAOYSA-N 292.770 2.283 10 10 CECE FC1(F)Oc2ccc(N3CCC[C@@]34CCNC4)cc2O1 2162672379 XFVJDQUSHLJGMV-ZDUSSCGKSA-N 282.290 2.340 10 10 CECE c1cc2c(cc1N1CCC[C@H]3NCC[C@H]31)OCCCO2 2162677516 VVVFNBOGWICHAL-ZIAGYGMSSA-N 274.364 2.179 10 10 CECE C[C@H](NCc1cnn(C)n1)c1cc(Cl)ccc1O 806167277 PTQMVOJOKQQBAU-QMMMGPOBSA-N 266.732 2.025 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H]3CNC[C@@H]3C)ccc21 2163064912 ZDSXPEWMOQHEQI-XGWLTEMNSA-N 274.408 2.348 10 10 CECE CN1CCc2cc([C@H](O)c3cccc(N)c3F)ccc21 2163060406 BMMYPHHIZWZQAU-INIZCTEOSA-N 272.323 2.482 10 10 CECE CN1CCc2cc([C@H](O)[C@@]34CCC[C@H]3CNC4)ccc21 2163065924 GBUORKDPRTXMMZ-BHYGNILZSA-N 272.392 2.102 10 10 CECE CCN1CCc2cc(N3C[C@H](C)[C@@](C)(CN)C3)ccc21 2163070403 WJNOATJVIZWIMK-GUYCJALGSA-N 273.424 2.490 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3[C@@H]4CCOC[C@H]43)ccc21 2163071358 NYUUSLICFYNTEL-SRABZTEZSA-N 273.376 2.385 10 10 CECE CCCN[C@@H](c1ccc2c(c1)CCN2C)c1cnc[nH]1 2163073508 JVKQHDLDIPKRKT-INIZCTEOSA-N 270.380 2.491 10 10 CECE CN[C@@H](c1ccc2c(c1)CCCN2C)c1cnccn1 2163094302 KFQXZMXXLBDYPL-INIZCTEOSA-N 268.364 2.168 10 10 CECE COC1([C@@H](NN)c2ccc(N3CCCC3)cc2)CCC1 2163107260 RJEVZXQDUHKQRL-HNNXBMFYSA-N 275.396 2.360 10 10 CECE N[C@H](c1ccc(N2CCCC2)cc1)[C@@H](O)[C@H]1CC12CC2 2163229410 KJZOMBYNSCSINE-OAGGEKHMSA-N 272.392 2.448 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)c1ncc(C)n1C 2164223610 PTPGDXGHKMNARI-OAHLLOKOSA-N 272.396 2.493 10 10 CECE CCN[C@H](CC)c1ccc(N(CC)CC(N)=O)cc1 723179482 RDROPWVIKMSMDL-CQSZACIVSA-N 263.385 2.059 10 10 CECE O=c1cc(-c2cccnc2)ccn1CCN1CCCCC1 821185587 PRKQQBYHUDWJTQ-UHFFFAOYSA-N 283.375 2.396 10 10 CECE Cc1ccn2cc(CNC(=O)c3cc(O)cs3)nc2c1 731870011 HQMVPXCMWGSRPP-UHFFFAOYSA-N 287.344 2.340 10 10 CECE CCOc1cccnc1C(=O)NCc1ccccc1O 748846285 NMVSHBXHPOKGCK-UHFFFAOYSA-N 272.304 2.116 10 10 CECE CCN(C(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCCOC1 846447284 UESLCZAPIYDGBV-CFNZNRNTSA-N 291.347 2.139 10 10 CECE O=C(NCc1ccccc1O)c1c(O)cc(F)cc1F 748345322 AANRQLBVQUTZDZ-UHFFFAOYSA-N 279.242 2.306 10 10 CECE NCC1(CCNCc2c(O)cccc2Cl)CC1 844902580 RNOAFFVWKFHITH-UHFFFAOYSA-N 254.761 2.264 10 10 CECE O=S(=O)(NCc1c(O)cccc1F)C1CCCCC1 921452316 LNIAYODQVWBPGQ-UHFFFAOYSA-N 287.356 2.283 10 10 CECE C[C@H](Nc1c(N)cccc1Br)[C@@H](C)CO 697741458 UMKOEQMJJYHZBI-YUMQZZPRSA-N 273.174 2.460 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cn3c(n2)CC[C@H](C)C3)c1 857960888 GHCWBDUEJZKJOR-LBPRGKRZSA-N 299.374 2.409 10 10 CECE Cc1cc(CNC(=S)N2Cc3cccc(O)c3C2)no1 865258947 TXCYSWAZMXEOQI-UHFFFAOYSA-N 289.360 2.079 10 10 CECE CC(C)[C@@H]1C[C@H](CNC(=O)c2cccc(O)c2O)CCO1 1117826060 LNPCZIIXEDFTEO-RISCZKNCSA-N 293.363 2.279 10 10 CECE Cc1cccc(CN2CCC(OCCCO)CC2)c1O 775723312 FPBCJPABPSQFNP-UHFFFAOYSA-N 279.380 2.064 10 10 CECE COc1ccc(N2N=C(C(C)=O)CC2=O)cc1Cl 871959702 OXKINTZBFVMHRF-UHFFFAOYSA-N 266.684 2.030 10 10 CECE CCc1cccc(CN2CCN3C[C@@H](C)C[C@H]3C2)c1O 1876177595 NQSIYTBMMVPOMT-BBRMVZONSA-N 274.408 2.481 10 10 CECE COc1ccc(O)c(CNC(=O)c2csc(Cl)n2)c1 771625055 IUCKUJSXQLEIFQ-UHFFFAOYSA-N 298.751 2.441 10 10 CECE Cc1cc(Cl)cc(CN(C)CCNC(=O)N(C)C)c1O 779432618 XJGYPJRPGSZCSO-UHFFFAOYSA-N 299.802 2.057 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)C23CCC(CC2)OC3)C1 1878068313 LHNDQCLMLOOHKC-XSRFYTQQSA-N 264.329 2.247 10 10 CECE CC[C@@H]1CCN2C(=O)N(c3ccc(N)cc3)C(=O)[C@H]2C1 132691379 GQXVBIGPXPBIDF-ZWNOBZJWSA-N 273.336 2.226 10 10 CECE CN(C)c1ncc(CNCc2ccc3c(c2)CCO3)s1 1461132716 YXGYQWCSWQHASF-UHFFFAOYSA-N 289.404 2.434 10 10 CECE CN(CCCCO)Cc1c(O)ccc(Cl)c1F 792180671 RNFZZGOTKIPRNU-UHFFFAOYSA-N 261.724 2.389 10 10 CECE CN[C@@H](C)c1cc(F)c(N(C)CC[C@H](C)O)c(F)c1 1880961223 UWAJAESAAJVHBE-UWVGGRQHSA-N 272.339 2.452 10 10 CECE CN[C@H](C)c1cc(F)c(N2CC[C@H]2[C@H](C)O)c(F)c1 1880925833 YYFGVTVBZKOIAY-ZDMBXUJBSA-N 270.323 2.205 10 10 CECE CO[C@H]1CCN(c2ccc(CN)cc2C)[C@@H]1C1CC1 1882979856 FNYSBOXRIBGCCM-JKSUJKDBSA-N 260.381 2.457 10 10 CECE COCCN(CCOC)[C@H](C)c1cc(C)ccc1O 133417629 SCTHPBNIFAIUOK-CYBMUJFWSA-N 267.369 2.356 10 10 CECE C[C@@H]1C[C@@H](C(=O)N(C)CCN=[N+]=[N-])N1C(=O)OC(C)(C)C 1885562076 AGPKFCQCLZSPFD-ZJUUUORDSA-N 297.359 2.153 10 10 CECE Cc1cccc(CN[C@H]2CCOC23CCOCC3)c1O 898116592 RVBULDKTAWJYNQ-AWEZNQCLSA-N 277.364 2.128 10 10 CECE CC[C@@H]1CN(CCN2CCCC2)c2ccc(CN)cc2O1 74337910 INESBVWORPOQSJ-OAHLLOKOSA-N 289.423 2.219 10 10 CECE CCN(Cc1c(O)cccc1F)C[C@@H]1CCOC1 1964544486 HHWLUEMFCKXNAV-NSHDSACASA-N 253.317 2.390 10 10 CECE CCCN(c1ccc(N)cc1)S(=O)(=O)CC(C)C 80187032 BMHWSKAOUZVPIS-UHFFFAOYSA-N 270.398 2.471 10 10 CECE OCc1ccc(N(CC(F)(F)F)C2COC2)c(F)c1 1886820838 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CNCc1ccc(N(C)[C@H]2C[C@H]3CC[C@H]2O3)cc1OC 2236350397 OVNJFFVSSDYPJE-QLFBSQMISA-N 276.380 2.171 10 10 CECE CN(C[C@]12COC[C@H](C1)C2)c1ccc2c(c1)CC[C@H]2N 2236416967 IGTHNXYLPJGPFL-JLZZUVOBSA-N 272.392 2.495 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CCCO3)[C@H]1C1CC1 2226665348 JWMWDVRIZVSHNK-HOCLYGCPSA-N 259.349 2.361 10 10 CECE CO[C@H]1C[C@H](O)CN(c2ccc3c(c2)CCCC3)C1 2226758144 WDYNDJBTOWJIHR-HOTGVXAUSA-N 261.365 2.151 10 10 CECE OCC[C@H]1CN(c2ccc3c(c2)COCC3)CCS1 2226714702 BNEBMQXFJXCLDM-HNNXBMFYSA-N 279.405 2.064 10 10 CECE COc1ccc(N2CC[C@@H](CO)C23CC3)cc1OC 2226803961 FTURJGGFDHHTEY-NSHDSACASA-N 263.337 2.055 10 10 CECE COc1ccc(N2C[C@H](C)OC[C@@H]2C)c(C(=O)O)c1 2227678537 XGJHPGVSNALMII-UWVGGRQHSA-N 265.309 2.007 10 10 CECE COc1ccc(N(C)C[C@@H]2[C@H]3CC[C@H]32)c(C(=O)O)c1 2227673281 OIWZGHZTSMFNRU-PJXYFTJBSA-N 261.321 2.486 10 10 CECE COc1ccc(N2CC[C@@H](OC)[C@H](C)C2)c(CN)c1 2227674646 XBETWCLOJGDNBS-IAQYHMDHSA-N 264.369 2.015 10 10 CECE Nc1ccc(N2CCN(C[C@@H]3C[C@H]3CF)C2=O)cc1 2228667454 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286.379 2.331 10 10 CECE Cc1cccc(CN2CCNC[C@@H]2c2cccnc2)c1O 843114706 GBCPGIYRRZOTAH-MRXNPFEDSA-N 283.375 2.242 10 10 CECE C[C@H]1CNCCN1C/C=C/c1ccc(N(C)C)cc1 843047791 VIHHOHRNXOTLHE-NNTXTVRGSA-N 259.397 2.060 10 10 CECE CO[C@@H]1CC[C@@H](C(=O)NCc2ccc(N(C)C)cc2)C1 854271559 LFTYPDHZRQNSPB-UKRRQHHQSA-N 276.380 2.184 10 10 CECE COc1ccc(N2CC[C@H](NC(=O)/C=C\C3CC3)C2)cc1 855231088 JMUOIIRVARBWBC-DFGFTWQDSA-N 286.375 2.356 10 10 CECE CCN(C)c1ccc(CN2CCC[C@](CO)(OC)C2)cc1 852412614 WZMZWCYWKOGROM-KRWDZBQOSA-N 292.423 2.116 10 10 CECE C[C@H](NCc1ccc2c(c1)CCCN2C)[C@@H]1[C@H]2CN[C@H]1C2 925530104 BPEBOTFCLOQZJE-OBZJAWTPSA-N 285.435 2.155 10 10 CECE CCCN(CCC)c1ccc(CNC[C@H](O)[C@@H](C)O)cc1 865742338 YMCGXKGCSLLDDS-PBHICJAKSA-N 294.439 2.144 10 10 CECE CCNc1nccnc1N1Cc2cccc(O)c2C1 866118121 WRQOKYFYAMXILN-UHFFFAOYSA-N 256.309 2.134 10 10 CECE CCc1cc(C(=O)N2Cc3cccc(O)c3C2)cc(O)n1 871204443 JOMYKUHPYWFRRO-UHFFFAOYSA-N 284.315 2.211 10 10 CECE O=C([C@H]1CCCOCC1)N1Cc2cccc(O)c2C1 871204471 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2.421 10 10 CECE Cc1nnccc1CN(C)c1ccc2c(c1)CC[C@H]2N 2290049321 PLECXHMLSYKWBW-MRXNPFEDSA-N 268.364 2.367 10 10 CECE Cc1ncc(C=CC(=O)NCc2ccc(O)c(O)c2)s1 2307787298 CEMJSHKBYQNINP-UHFFFAOYSA-N 290.344 2.192 10 10 CECE C[C@@H]1COCC[C@H]1C(=O)N[C@@H]1CCC[C@@H]1N=[N+]=[N-] 2312333158 AMQCRGUCTVOLMI-DBIOUOCHSA-N 252.318 2.007 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)C[C@H]1CCCOCC1 2315986391 CTFSCFYLNJMCCY-NSHDSACASA-N 254.334 2.352 10 10 CECE O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2Cc1ccc(Cl)cc1O 2329076117 PIPZNSVRURZAPX-SDDRHHMPSA-N 281.739 2.483 10 10 CECE CO[C@H]1CC[C@@H]2CN(Cc3ccc(F)cc3O)C[C@@H]21 2333191787 RXQIQXPGHWBTJV-DGFSRKRXSA-N 265.328 2.388 10 10 CECE CC[C@](C)(C(=O)NCc1cc(N)ccc1O)C(F)F 2336602460 DMAMXMSIAUATLH-ZDUSSCGKSA-N 272.295 2.272 10 10 CECE C[C@@]12C[C@@H](CO1)N(c1ccc(CN)c(C3CC3)c1)C2 2339157308 HNJAOCDNARRMDA-HOCLYGCPSA-N 258.365 2.390 10 10 CECE COc1cc(Cl)c(N2CC=C[C@]2(C)CO)c(OC)c1 2342436217 ZQJHPSFYBAEOGL-CQSZACIVSA-N 283.755 2.484 10 10 CECE C[C@@]1(CS(=O)(=O)Cc2ccc(N)cc2)CCCOC1 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CC[C@@H](CC(=O)O)CC(=O)N(C)Cc1ccc(N)cc1 2151596984 URLGQGISPTYCBK-LLVKDONJSA-N 278.352 2.118 10 10 CECE COC1(CF)CN(c2ccc(CO)c(Cl)c2)C1 2003079826 ASMWJQCCQWCVKL-UHFFFAOYSA-N 259.708 2.007 10 10 CECE CN1CCc2cc([C@@H](O)[C@H](N)CCC(C)(F)F)ccc21 2153573361 PJPDNFNTRSWVFK-TZMCWYRMSA-N 284.350 2.475 10 10 CECE CN[C@@H](C)c1ccc(N2CCOC[C@@H](CO)C2)c(Cl)c1 2154454719 DGNDERQWESQCGH-NWDGAFQWSA-N 298.814 2.066 10 10 CECE CNCc1ccc(N2CC[C@H]2[C@H](C)O)cc1Cl 2011147698 YNUVVQLQDWLWTR-ZANVPECISA-N 254.761 2.019 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CCC[C@@H]2OCC[C@H]21 2160447192 SQEUZIFHUWNTMY-BIMULSAOSA-N 276.336 2.337 10 10 CECE COc1ccc(CNC(C)C)cc1CN1CCOC1=O 50125543 UADBFXMGCFWYFY-UHFFFAOYSA-N 278.352 2.145 10 10 CECE CC(=O)C(=O)CSCCN(C)Cc1ccccc1 289724445 SGBNMSGQKMGLGK-UHFFFAOYSA-N 265.378 2.010 10 10 CECE CC(C)N(Cc1ncccn1)c1ccc(CN)cc1 54458651 NUBQRXCUKYUIEU-UHFFFAOYSA-N 256.353 2.350 10 10 CECE CN(C)[C@@]1(C)CCN(c2ccc(CN)cc2Cl)C1 2032600782 YGOQKAQOGXRZGL-AWEZNQCLSA-N 267.804 2.329 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H](C)CC(N)=O)cc1Cl 2033933602 RWWWQYJDDFZFKX-IUCAKERBSA-N 270.760 2.093 10 10 CECE C[C@@H]1CC[C@@H](CNC(=O)c2cccc(O)c2O)S1 2034231688 KAKIHXLVPOHMPR-BDAKNGLRSA-N 267.350 2.112 10 10 CECE Oc1ccc(CNC[C@H]2CCCCCO2)cc1O 2035186692 BCWRQRYWSRSWOW-GFCCVEGCSA-N 251.326 2.147 10 10 CECE CCOC1CC(CC(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 403843676 QFLIHCRTFUDYMM-CXQJBGSLSA-N 266.345 2.493 10 10 CECE C[C@H]1CCC[C@@H](S(=O)(=O)Nc2ccc(O)cc2N)C1 407231112 SCYAKBONAUUYON-GXSJLCMTSA-N 284.381 2.295 10 10 CECE CC(C)N(C)C[C@H](C)N[C@@H](C)c1c(O)cccc1O 311656038 FMTCPKVVXFUYQK-RYUDHWBXSA-N 266.385 2.477 10 10 CECE Cn1cc(N[C@H]2CCc3cccc(O)c32)ccc1=O 312093815 QUAVIEGGUFWUFZ-LBPRGKRZSA-N 256.305 2.190 10 10 CECE COc1ccc(CN2CCC(C)(OC)CC2)c(O)c1 312051880 CMFVVJMQUWWARN-UHFFFAOYSA-N 265.353 2.402 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](N(C)C)[C@H]2C)cc1O 313148181 GNEFBXJLACIGQM-LALPHHSUSA-N 277.412 2.201 10 10 CECE CCC1(CC)CN(C[C@@H](O)COc2ccc(N)cc2)C1 313521968 LWUPOSVAIXNCPM-CQSZACIVSA-N 278.396 2.131 10 10 CECE Nc1ccc(CS(=O)(=O)N[C@H](C2CCC2)C2CC2)cc1 324941797 QVUODLFIYMEDNA-OAHLLOKOSA-N 294.420 2.267 10 10 CECE CCN([C@@H](C)c1ccccc1O)[C@@H]1CCCCNC1=O 2171193772 XBQUVWJUOKAXPS-GXTWGEPZSA-N 276.380 2.444 10 10 CECE COc1ccc(N2CCO[C@H](c3nccs3)C2)c(N)c1 2171852881 SJTCOIDKDQNVAA-ZDUSSCGKSA-N 291.376 2.312 10 10 CECE NCc1ccc(N2C[C@H]3C[C@@H](O)[C@H]2C3)cc1C(F)(F)F 2177152529 KFSVUHQFEWYALK-BZHVJNSISA-N 286.297 2.124 10 10 CECE Oc1c(F)cccc1CNC[C@H]1CCn2ccnc2C1 364601296 GNXOAIWNXXRNBJ-NSHDSACASA-N 275.327 2.080 10 10 CECE C[C@@H](N[C@@H]1CCc2nccn2C1)c1cc(F)ccc1O 368327798 MPCGCMGMONRWOZ-ZYHUDNBSSA-N 275.327 2.393 10 10 CECE COc1nscc1[C@](C)(O)c1ccc2c(c1)CCN2C 2163073900 NJKBKNIOACKGEA-OAHLLOKOSA-N 290.388 2.400 10 10 CECE CN1CCc2cc([C@@H](O)C3CC4(CCNC4)C3)ccc21 2163080682 VLYZOIMHTPNHQC-ARWYELJZSA-N 272.392 2.102 10 10 CECE CCN1CCc2cc([C@H](O)[C@@H]3C[C@@]34CC[C@@H]4N)ccc21 2172518417 IOQQSYWVDKJQPJ-HJWJTTGWSA-N 272.392 2.230 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CC[C@H](N(C)C)[C@H](C)C1 710521070 MQVWVQUJSIVDOA-AGIUHOORSA-N 278.396 2.431 10 10 CECE Cc1csc(CNCc2ccc(O)c(O)c2O)c1 393360391 BCJCHKPDLYLJDB-UHFFFAOYSA-N 265.334 2.463 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H](O)c3nccs3)ccc21 2163138923 SFSPSKKZBQPICO-KGLIPLIRSA-N 289.404 2.259 10 10 CECE CN1CCCc2cc([C@H](O)c3cccc(N)n3)ccc21 2163109061 VZDSHNPVMNBZBB-INIZCTEOSA-N 269.348 2.128 10 10 CECE CN1CCc2cc([C@@H](N)[C@@]3(O)C[C@H]4CC[C@H]3C4)ccc21 2163123422 LGELKYLVPQWCOH-HYEYJGRESA-N 272.392 2.230 10 10 CECE COc1ccc(CNC[C@@H]2CCN2C(C)(C)C)c(O)c1 690390739 HWVSNBPGZPYNGR-ZDUSSCGKSA-N 278.396 2.363 10 10 CECE CC1(C)[C@H]2CN(C(=O)CCc3ccc(N)cc3)C[C@@H]21 379535191 VQMWDNNBRNXLQS-KBPBESRZSA-N 258.365 2.316 10 10 CECE C[C@@H]1CSCCN([C@@H](CN)c2ccc(N(C)C)cc2)C1 379539294 ZNGLTTCLNNEFEF-BBRMVZONSA-N 293.480 2.437 10 10 CECE CCn1ccnc1CN1CCc2cc([C@@H](C)N)ccc21 692575977 KUCSBIXESAPOIX-GFCCVEGCSA-N 270.380 2.485 10 10 CECE C[C@H](NCC1(CN(C)C)CCC1)c1c(O)cccc1O 2163650642 QZXDUOCGAMLGMX-LBPRGKRZSA-N 278.396 2.480 10 10 CECE CC(=O)c1ccc(O)c(CN(C)[C@@H](C)C(C)(C)O)c1 382906973 YXNZELQPJLBZLE-NSHDSACASA-N 265.353 2.186 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@@H](O)C[C@H]1C 384804220 XKZXUZXQXNUCQM-DOMZBBRYSA-N 260.381 2.207 10 10 CECE CC[C@H](C[C@H](C)O)NCc1cc(OC)ccc1O 716915416 KJYWECTXIMETTL-CMPLNLGQSA-N 253.342 2.040 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1c(F)cc(CN)cc1F 385691032 JUHIJSIMJXGBLX-GXFFZTMASA-N 270.323 2.021 10 10 CECE C[C@@H](NCCC(C)(C)CO)c1c(O)cccc1O 385879501 KVTPBCPNSCGELF-SNVBAGLBSA-N 253.342 2.157 10 10 CECE Nc1ccc(CCCN2[C@H]3CC[C@H]2CC(CO)C3)cc1 719132027 LHWRMVBSGOVJNI-IRXDYDNUSA-N 274.408 2.437 10 10 CECE CO[C@]1(c2noc(-c3sccc3O)n2)CCSC1 719535972 MIOCWTXDJMRQKI-LLVKDONJSA-N 284.362 2.482 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1CCCC[C@@H]1C 394799063 RLVKMIXIGKSKPI-HBNTYKKESA-N 254.334 2.254 10 10 CECE CCNCc1ccc(N2C[C@H](C)C[C@@H](CO)C2)c(F)c1 398913716 OYSMRFRRSVGEII-TZMCWYRMSA-N 280.387 2.390 10 10 CECE CC(C)(C)c1nc(=NCc2cccc(O)c2O)s[nH]1 2062370716 RPUDQAHGKLRYLF-UHFFFAOYSA-N 279.365 2.281 10 10 CECE C[C@@H](Cc1ccnn1C)N[C@H]1CCc2cccc(O)c21 2174323791 BYTWVQCRZCGQKW-FZMZJTMJSA-N 271.364 2.334 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC(C)(CCC(=O)O)C1 2179844923 QGXHKDJFEFBBHK-JTQLQIEISA-N 279.336 2.346 10 10 CECE CNCc1ccc(N2CC(C(=O)NC(C)C)C2)c(Cl)c1 2168054874 JDROIROLLDQXHB-UHFFFAOYSA-N 295.814 2.020 10 10 CECE C[C@@H](N)c1ccc(N2CC(C(=O)NC(C)(C)C)C2)cc1 2168059565 XOCOLZQWAKAZSA-LLVKDONJSA-N 275.396 2.057 10 10 CECE C[C@H](NC[C@H](O)CC(F)(F)F)c1ccccc1O 879650858 UHBPITKWCFLNLB-DTWKUNHWSA-N 263.259 2.356 10 10 CECE CC(C)c1cc(CN)n(Cc2cc(F)ccc2O)n1 2070057830 IJTKTCVIDRQJNM-UHFFFAOYSA-N 263.316 2.358 10 10 CECE Cc1nn(Cc2cc(C(F)(F)F)ccc2O)cc1CO 2070286720 TUNCOVZQSLBHNH-UHFFFAOYSA-N 286.253 2.457 10 10 CECE Cc1ncc(C)c(N2Cc3ccccc3[C@H](CN)C2)n1 2176226276 LECZRGMNBWDPFU-CQSZACIVSA-N 268.364 2.156 10 10 CECE NCc1ccc(N2CC[C@H](CN3CCCCC3)C2)cc1 2170225203 OJMSQGNHNIBVSD-MRXNPFEDSA-N 273.424 2.458 10 10 CECE O=C1CCC2(CCN(Cc3ccc(Cl)cc3O)CC2)N1 1140464616 XFWDEFHCACIDRQ-UHFFFAOYSA-N 294.782 2.290 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)C1CCC(CO)CC1 2171094991 UKCSVCAKHGLYDW-UHFFFAOYSA-N 277.368 2.284 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@@H]1C[C@@H]2CC[C@H](C1)O2 2181364474 XGVLQUIQBPNXIO-BTTYYORXSA-N 275.352 2.443 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC=C(CC(=O)O)CC1 2181679839 XILWUKLZYZZLGZ-SNVBAGLBSA-N 277.320 2.266 10 10 CECE O=C(N[C@H]1CCC[C@H]1C1CC1)c1cc(O)c(O)c(O)c1 2188930951 UCOIEDKQRCDHTH-QWRGUYRKSA-N 277.320 2.112 10 10 CECE Oc1ccc(CN[C@@H]2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)c(O)c1O 2193771404 NAOABKLXJTWIEB-GMEDAVPMSA-N 275.348 2.328 10 10 CECE NCc1ccc2c(c1)CCN2C[C@H](O)c1ccccc1 2189917666 BCUWHRIJPXOBQN-KRWDZBQOSA-N 268.360 2.241 10 10 CECE COCCN(CCOC)c1ccc2c(c1)CCC[C@@H]2N 2184686769 KOFXVGQEYPWXJY-INIZCTEOSA-N 278.396 2.122 10 10 CECE CC[C@@H]1[C@@H](CO)CCN1c1ccc2c(c1)CC[C@H]2NC 2184722532 ACXGEQBUHWPCQZ-KBRIMQKVSA-N 274.408 2.491 10 10 CECE CC1(C)CCN(c2ccc3c(c2)CC[C@H]3O)CC[S@@]1=O 2184733944 MYOKQSNZKIYINV-QRWLVFNGSA-N 293.432 2.404 10 10 CECE COc1nc(C2=S=Nc3ccccc32)nc(=S)[nH]1 2041862005 FAIDBCNTFDSROR-UHFFFAOYSA-N 276.346 2.023 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H]1CSCCO1 2044707725 GQOLROAKCJFZJP-KBPBESRZSA-N 266.410 2.145 10 10 CECE Nc1ccc(OCCC(=O)N[C@H](CF)C(F)(F)F)cc1 2185141983 DSJQZKPRQZGGHJ-SNVBAGLBSA-N 294.248 2.054 10 10 CECE CO[C@@H]1CN(C(=O)Nc2ccc(N)cc2)CC(F)(F)C1 2185146619 HTBCXELNCLJKAS-NSHDSACASA-N 285.294 2.157 10 10 CECE CCCOc1cc(N2C[C@H]3CC(O)C[C@@H]3C2)ccc1N 2185191969 GONDHKDGUHSHSG-VXGBXAGGSA-N 276.380 2.265 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C(F)(F)C2CCOCC2)CC1 2185369768 ZFKQIPWUYGWPGH-UHFFFAOYSA-N 288.298 2.255 10 10 CECE CN(Cc1cc(N)ccc1O)[C@H]1CO[C@@H](C(F)(F)F)C1 2185552265 OVTSUEAKBTWECP-ZYHUDNBSSA-N 290.285 2.126 10 10 CECE OCc1cc(F)c(N2CCC3(CC2)CC(O)C3)c(F)c1 2186076519 NSWISALYLKSCOW-UHFFFAOYSA-N 283.318 2.198 10 10 CECE COC[C@H]1CN(Cc2c(O)cccc2F)C[C@@H]1C 2054829197 AAYXJPKYMMOQGU-WDEREUQCSA-N 253.317 2.246 10 10 CECE COC[C@]1(C)CCN1c1ccc([C@@H](C)N)c(O)c1 2055902349 HFSFVYXZMHJGLH-YGRLFVJLSA-N 250.342 2.027 10 10 CECE Cc1c(CN2C[C@@H]3C[C@@H]3[C@H]2CN)n(C)c2ccccc12 2198963894 VVZLGZQMERAFHH-DUVNUKRYSA-N 269.392 2.266 10 10 CECE CN[C@]1(C(=O)OC)CC[C@@H](Sc2nccs2)[C@H]1C 2058695261 PKCYPWZUIUDVRY-KBVBSXBZSA-N 286.422 2.165 10 10 CECE CN1CCCc2cc(CN[C@H]3CC[C@](C)(O)C3)ccc21 2186852431 LDLHTRJYGULOGP-RDJZCZTQSA-N 274.408 2.462 10 10 CECE Nc1ccc(OCC(=O)N2[C@H]3CC[C@H]2CC(F)C3)cc1 2192117159 RZQDYGWVSIWTNV-STQMWFEESA-N 278.327 2.139 10 10 CECE CO[C@@H]1CC[C@@H]1CN[C@@H](C)c1cc(O)ccc1O 2066807352 OYPPDNWMMVYVMD-IMSIIYSGSA-N 251.326 2.173 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)c1cc(N)ccn1 2192591509 IEUNXUCAPYPYCM-SNVBAGLBSA-N 271.320 2.203 10 10 CECE C[C@@H](c1ccccc1O)N(C)c1cccc(C(=N)N)n1 2192588727 BZVLWOKDLCXJCM-JTQLQIEISA-N 270.336 2.269 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCN2CC[C@H]1C2 2072643828 JMYPJEMGZLNHNM-AAEUAGOBSA-N 266.772 2.229 10 10 CECE C[C@@H](CN)N(C)c1ccc(OCC(F)(F)F)cc1 2073885534 ILIZHCLQEQRLET-VIFPVBQESA-N 262.275 2.411 10 10 CECE C[C@@H](O)c1cc(F)c(N2CCOC[C@H]2C)c(F)c1 2074081852 LXVWGMUDSOXPPH-RKDXNWHRSA-N 257.280 2.243 10 10 CECE Oc1cc2c(cc1CNC1(CCF)CC1)OCO2 2074497451 GAQYZKQIBRJXOB-UHFFFAOYSA-N 253.273 2.103 10 10 CECE COC[C@@](C)(CN1CCC[C@H](N=[N+]=[N-])CC1)OC 2077549252 ULCJAPGKAPREKF-NWDGAFQWSA-N 256.350 2.203 10 10 CECE COc1ccc(CN[C@@H]2C[C@@H]2C2CCOCC2)c(O)c1 2200172075 KQFMZKLGTOOLMR-HUUCEWRRSA-N 277.364 2.306 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@H]1CC12CCCC2 2100559368 GBLRLKGLXYJNGX-GHMZBOCLSA-N 266.345 2.398 10 10 CECE CCN1CCC[C@H](N(CC)c2ccc(N)cc2)C1=O 2101119728 VFVZSMBPPBXHCH-AWEZNQCLSA-N 261.369 2.106 10 10 CECE CC[C@H](c1ccccc1O)N1CCOCCOCC1 2103239279 POXCHJKITMJWOP-CQSZACIVSA-N 265.353 2.192 10 10 CECE CN[C@H](c1ccccc1O)[C@@H]1CCc2nccn2C1 2103650468 RDHFWBNFOWZSPV-ABAIWWIYSA-N 257.337 2.112 10 10 CECE C[C@@H]1CNC[C@@H](C)C1NCc1ccc(N(C)C)cc1 2103886020 JEKRIFLUQQAMGG-CHWSQXEVSA-N 261.413 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252.333 2.233 10 10 CECE Cc1cccc(O)c1CN(C)CCCC(=O)N(C)C 2104476635 GCGSCVKMSQEVJF-UHFFFAOYSA-N 264.369 2.001 10 10 CECE NC(=O)[C@H](Nc1ccccc1)c1c(O)cccc1F 2104474625 UHPNHVBLWXNFOV-CYBMUJFWSA-N 260.268 2.170 10 10 CECE Cc1cccc(O)c1CN1CC[C@@H]([C@H]2CCCN2)C1 2104506865 FKTRZGBUXRTPFO-UKRRQHHQSA-N 260.381 2.275 10 10 CECE C[C@H]1CC[C@@H](CN)CN1c1ccc2c(c1)OCCO2 2106334004 KKGJLDMTLUBAON-RYUDHWBXSA-N 262.353 2.021 10 10 CECE c1cc2c(cc1N1CCC[C@@H]3NCC[C@@H]31)COCC2 2106394387 LLGDSOHRQTZPTO-HOTGVXAUSA-N 258.365 2.090 10 10 CECE CC1(C)CN(c2ccc3c(c2)OC(F)(F)O3)C[C@H]1N 2106394457 MJDIXKDVUTZBAD-LLVKDONJSA-N 270.279 2.182 10 10 CECE CCN1CCc2cc([C@](C)(N)[C@@H]3CCOC3)ccc21 2106787966 LRJCBTVMTNLTPR-ZBFHGGJFSA-N 260.381 2.279 10 10 CECE CCN1CCc2cc([C@@H](O)[C@@H](N)CC(F)F)ccc21 2106789746 BAGCVRROZTUYFR-SMDDNHRTSA-N 270.323 2.085 10 10 CECE NC[C@@H]1CCC[C@@]1(O)c1ccc(N2CCCC2)cc1 2106834634 WFNUNRLJCJVWSJ-GOEBONIOSA-N 260.381 2.233 10 10 CECE CCCN(Cc1ccccc1O)C[C@@H]1COC(=O)O1 2087053668 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Nc1ccc(CN(C(=O)Cc2cnsc2)C2CC2)cc1 2280204242 ILRGIUOPLAIENW-UHFFFAOYSA-N 287.388 2.459 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CCC[C@](F)(C(=O)O)C1 2280527409 MZRVUCJHRNEWNL-LKFCYVNXSA-N 283.299 2.048 10 10 CECE Nc1ccc(CCN=c2cccc(OC(F)F)[nH]2)cc1 2284407840 PMJWZNRBVPMTRX-UHFFFAOYSA-N 279.290 2.342 10 10 CECE COc1cc(C)c(N(CCN)C2CCOCC2)c(C)c1 2285038799 QZDIBMFIFPRAEB-UHFFFAOYSA-N 278.396 2.256 10 10 CECE CCCN[C@H](C)c1ccc(N(C)CCC(N)=O)cc1C 2285143518 IMFYSKMGYDKEAN-CYBMUJFWSA-N 277.412 2.367 10 10 CECE Cc1cc(N2CCC(F)(F)[C@@H](CO)C2)ccc1[C@@H](C)N 2285139620 OQSFNHXKIPSIFQ-VXGBXAGGSA-N 284.350 2.469 10 10 CECE COc1ccc(N2C[C@]3(CO)C[C@@]3(C)C2)c(OC)c1C 2295356400 AJBAHEQIUBDIPM-HOTGVXAUSA-N 277.364 2.221 10 10 CECE COc1ccc(N2CC(F)(F)C[C@H]2CO)c(OC)c1C 2295379105 WYTNWZFVKOCZLM-JTQLQIEISA-N 287.306 2.219 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cc(C(=O)O)cnn1 2289734928 JHKVCOWATLPCMX-SECBINFHSA-N 273.292 2.078 10 10 CECE CC[C@H](NC(=O)C=Cc1ccc(O)c(O)c1)[C@H]1CCCO1 2308005967 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262.397 2.476 10 10 CECE CNCc1ccc(N2C[C@H](O)C2(C)C)cc1C1CC1 2339160499 MGAQBXMDBIGXKR-HNNXBMFYSA-N 260.381 2.243 10 10 CECE CNC[C@H]1CN(Cc2cc(Cl)ccc2O)CC12CC2 2340549604 CHZDZTRQICYQJA-LBPRGKRZSA-N 280.799 2.477 10 10 CECE Oc1ccc(CN[C@H]2CCCC[C@@H]3C[C@H]23)c(O)c1O 2342552794 YBWOXSFKEMOSDU-USWWRNFRSA-N 263.337 2.472 10 10 CECE CC(C)[C@@H]1C[C@H](O)CN1c1c(F)cc(CN)cc1F 2344611594 YAMJSVGZPPZJEQ-GWCFXTLKSA-N 270.323 2.019 10 10 CECE CSc1cc(N2C[C@H](C)C[C@H](O)[C@@H]2C)ccc1CN 2353852022 JVBOPNMQMJXXGZ-SUNKGSAMSA-N 280.437 2.463 10 10 CECE CCOc1cccc(CN[C@@H]2CCCOC2)c1O 109543547 CJQDNBDXFJUZHX-GFCCVEGCSA-N 251.326 2.060 10 10 CECE COc1ccc(N2CC[C@@](C)(CO)C2)c(F)c1F 2219754177 ATYUAJQHNSLMRP-CYBMUJFWSA-N 257.280 2.182 10 10 CECE CCCN(CC(=O)NC)c1c(F)cc(CNCC)cc1F 62713053 DEFOGHCFIFERAE-UHFFFAOYSA-N 299.365 2.037 10 10 CECE CC(C)CNCc1ccc(N2CCCC[C@@H]2C(N)=O)cc1 62737530 KTGACDGXIZYWRY-MRXNPFEDSA-N 289.423 2.276 10 10 CECE C[C@@H](N[C@@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12)c1ccc(O)cc1O 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CN[C@H](C)c1ccc(N2CC[C@H](OC)[C@H]2C)cc1O 1914272701 SLNMZCDOWZGTKQ-HFAKWTLXSA-N 264.369 2.286 10 10 CECE Cc1ccc(O)c([C@@H](C)N[C@H]2C[C@@H]([C@@H](F)CO)C2)c1 1907231010 CHZSZYQSOGGKNT-NMKXLXIOSA-N 267.344 2.460 10 10 CECE Cc1ccc(CN2C[C@@H](N)CC3(CCC3)C2)c(O)c1 2139755310 BEZXKEPWENFFGR-AWEZNQCLSA-N 260.381 2.404 10 10 CECE CNCc1ccc(N2CCO[C@@H](C)[C@@H]2C)cc1OC 2139701950 YYAIRMUSNFHYDJ-RYUDHWBXSA-N 264.369 2.028 10 10 CECE CC1(C)CC([C@H](NCc2ccccc2O)C(=O)O)C1 1924197328 CLNITYLZEXTZRL-ZDUSSCGKSA-N 263.337 2.371 10 10 CECE C[C@H](c1ccc(O)cc1O)N1C[C@H](N)CC12CCC2 1925213421 BBHSPLWDWXUMBR-GHMZBOCLSA-N 262.353 2.115 10 10 CECE CC(C)(C(=O)O)[C@@H]1CCCN1Cc1ccccc1O 1968210790 RTZQAFZLYSNMHE-ZDUSSCGKSA-N 263.337 2.467 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCCC[C@H]1CCN 251780724 SPFJUYUCVJCVOA-RYUDHWBXSA-N 264.369 2.362 10 10 CECE COC[C@@H]1CC[C@H]1N(C)c1ccc(CN)c(F)c1F 2142421046 KZNVMIXFZRVTKS-WDEREUQCSA-N 270.323 2.285 10 10 CECE COc1ccc(O)c(CNCc2c(Cl)ncn2C)c1 1969650922 FOXUQOPTFRIDJT-UHFFFAOYSA-N 281.743 2.078 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CCCN3)C[C@@H]1N(C)C 124282448 VIVMXGMWCNVHBN-WBMJQRKESA-N 259.397 2.431 10 10 CECE CCCNCc1ccc(N2CCN(C)C[C@@H]2C)c(F)c1 233109210 ISEROVBPWCQRAZ-ZDUSSCGKSA-N 279.403 2.466 10 10 CECE COCCn1cc(N[C@H](C)c2c(O)cccc2O)cn1 234685448 LSEYTCNJPAVXEG-SNVBAGLBSA-N 277.324 2.114 10 10 CECE C[C@@H](NCCCCn1ccnc1)c1c(O)cccc1O 235212014 YJEVYOPUCPZEBC-GFCCVEGCSA-N 275.352 2.425 10 10 CECE O=C(O)c1cnc(-c2ccc(O)c(O)c2)nc1C(F)F 236489099 QYTWJNZLDMHFTK-UHFFFAOYSA-N 282.202 2.191 10 10 CECE C[C@H](N)c1ccc(N2CC[C@]2(C)CO)cc1Br 1947982453 OFGUKNHEEYOENT-TVQRCGJNSA-N 299.212 2.430 10 10 CECE CC[C@@H](O)c1ccc(N(C)C[C@H]2OCCO[C@@H]2C)cc1 2143685627 XSZOPBDLUYHABD-DAXOMENPSA-N 279.380 2.370 10 10 CECE Oc1ccc(CCN=c2[nH]c3cnccc3s2)cc1O 2148020330 NMMZNPNTYTZQAC-UHFFFAOYSA-N 287.344 2.179 10 10 CECE CN(c1ccc(N)cc1)C1CN(C(=O)OC(C)(C)C)C1 1954674031 OERWHBNQOPMMPH-UHFFFAOYSA-N 277.368 2.324 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H](O)C1CCOCC1 2148154436 RXHAEDBHPXFUEQ-CVEARBPZSA-N 279.380 2.220 10 10 CECE CNCc1ccc(N2CCO[C@H]3C[C@H]32)cc1Br 2004423097 OHRCHNLSJUOMOD-OLZOCXBDSA-N 297.196 2.146 10 10 CECE CC[C@@H]1C[C@@H]1C[C@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2148330985 MXCNCIFSZQYKSA-FIUQPQMISA-N 274.408 2.476 10 10 CECE Oc1cccc(CNCc2cncc3c2CCC3)c1O 2152020205 BUAUSULZAKGYDJ-UHFFFAOYSA-N 270.332 2.271 10 10 CECE Cc1ccc(Sc2ncc([C@H](C)N)s2)nn1 1976521615 XTVMXTNBDBEBGB-ZETCQYMHSA-N 252.368 2.412 10 10 CECE CCOc1cccc(CN2CC[C@H](C)[C@@H](N)[C@H]2C)c1O 2152054406 FJLUCBQNDUJMGL-YWPYICTPSA-N 278.396 2.349 10 10 CECE COc1ccc(CN(C)CC(C)(C)CN(C)C)c(O)c1 2144759610 RLFKILRUIBUBJR-UHFFFAOYSA-N 280.412 2.420 10 10 CECE CN1C[C@H](CN)C[C@@H]1c1c(O)cccc1C(F)(F)F 258672811 RFUJYSDDWWJPNN-WCBMZHEXSA-N 274.286 2.363 10 10 CECE Oc1ccc(Cl)cc1CN1CCOC[C@@H]1[C@H]1CCOC1 2144952554 HLRGJXLMRIFZQF-SMDDNHRTSA-N 297.782 2.283 10 10 CECE CC(=O)C(=O)[C@H](O)c1c(F)cc(C)cc1Br 1981755361 YILBJZPNHCPBHY-LLVKDONJSA-N 289.100 2.088 10 10 CECE CC[C@H]1CN(C(=O)COc2ccc(N)cc2)CCS1 157197678 LYUOSWXFWYHWRT-ZDUSSCGKSA-N 280.393 2.002 10 10 CECE CC(C)OCC(=O)N(Cc1ccc(N)cc1)C1CC1 157960463 WQHXHPYTDFYJCF-UHFFFAOYSA-N 262.353 2.185 10 10 CECE CCOCCCOCCCC(=O)Nc1ccc(N)cc1 2149058642 ROULNTKZYJWJRC-UHFFFAOYSA-N 280.368 2.431 10 10 CECE CCc1noc(CN2CCc3cc([C@H](C)N)ccc32)n1 2145822964 MBIIDWBIBSNZMM-JTQLQIEISA-N 272.352 2.214 10 10 CECE CCCNCc1ccc(N2CC[C@@H](CO)C2)cc1C 162183617 SZSHDQDYRXDJPG-CQSZACIVSA-N 262.397 2.313 10 10 CECE CCN[C@H](C)c1ccc(N2CC3(CC(O)C3)C2)c(F)c1 2146334607 OXDDVBLLIKTWNJ-LLVKDONJSA-N 278.371 2.457 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1C[C@@H](N)CC2(CCC2)C1 2151124594 BPZZQMNQKGUFFR-RYUDHWBXSA-N 276.380 2.362 10 10 CECE CN(C)c1ccc(CNCC(=O)OC(C)(C)C)cc1 164092068 WROJYOOJODGQBH-UHFFFAOYSA-N 264.369 2.184 10 10 CECE CCC1(CN(C)c2ccc3c(c2)N(C)C(=O)[C@H]3O)CC1 2146810124 ZNFCXJZLHQFHJQ-AWEZNQCLSA-N 274.364 2.323 10 10 CECE CN(Cc1nnc2n1CCC2)c1ccc(CO)cc1Cl 2146925608 PDSDMVBBRCLPMV-UHFFFAOYSA-N 292.770 2.006 10 10 CECE C[C@H](NCc1cccc(F)c1O)C(=O)N1CCCCC1 165028324 TUVXXKJNZLMQRV-NSHDSACASA-N 280.343 2.022 10 10 CECE C[C@@H](CC(N)=O)N(C)c1ccc(CNC2CC2)cc1Cl 2151336841 PQSUMPDQWBLJTA-JTQLQIEISA-N 295.814 2.292 10 10 CECE C[C@H](CNCc1cccc(O)c1O)CN1CCCCC1 41117879 MTYAQQFYVNILFZ-CYBMUJFWSA-N 278.396 2.309 10 10 CECE CCn1cncc1CN(C)c1ccc(CN)c(F)c1F 2153011651 PTMWXDXFRPIWSV-UHFFFAOYSA-N 280.322 2.276 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)C1CC(C(F)F)C1 2153239404 KCPBASCEEIYBSP-YHBRXECLSA-N 281.306 2.118 10 10 CECE COc1cccc(O)c1CNC[C@H](C)CN1CCCC1 2160736502 PTXRYBVEPUNKOI-ZDUSSCGKSA-N 278.396 2.222 10 10 CECE CCN(CC)[S@@](=N)(=O)N(C)Cc1ccc(N(C)C)cc1 2154230889 NYODWSXEBDGYLO-FQEVSTJZSA-N 298.456 2.403 10 10 CECE CC1(C)CCO[C@@H]1COC(=O)COc1ccc(N)cc1 2154288900 UMVUMBQLEBMMRB-CYBMUJFWSA-N 279.336 2.006 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@]1(C)CCCN1C 2154970586 NGEUSGZMPDSFIQ-BLLLJJGKSA-N 276.380 2.396 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC[C@@H](N)C2(CCC2)C1 2155074120 FUJZYSTWGLVHDB-XHDPSFHLSA-N 276.380 2.362 10 10 CECE CCCn1ncnc1COc1ccc(CNC)cc1C 2155019460 RUCJALCFKYZCIX-UHFFFAOYSA-N 274.368 2.295 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)[C@H](O)c2ccccc2)CC1 2155559577 DNZMLRFTPXAFMP-QWHCGFSZSA-N 274.324 2.411 10 10 CECE C[C@H](c1ccc(Cl)cc1O)N(C)CC[S@@](C)=O 2024140081 XORGEMMPBQECQV-VVVCHXIZSA-N 275.801 2.417 10 10 CECE CN1CCC[C@H](NCc2cc(F)ccc2O)CC1 2027961392 HJERUXZYTTVRCZ-ZDUSSCGKSA-N 252.333 2.105 10 10 CECE CCCOc1cc(N2CC[C@@H](C3OCCO3)C2)ccc1N 2029141067 VBMANONQKKJDHQ-GFCCVEGCSA-N 292.379 2.257 10 10 CECE C[C@@](O)(Cc1ccsc1)[C@@H](N)c1ccccc1O 2031160864 PPLTZWPQEMZQQW-UONOGXRCSA-N 263.362 2.447 10 10 CECE C[C@H](N[C@H]1CCN(C)C[C@H]1C)c1c(O)cccc1O 300440362 HMSUINPROPNNOF-WOPDTQHZSA-N 264.369 2.089 10 10 CECE Nc1ccc(OCC(=O)OCCc2ccsc2)cc1 70244031 NLBBMXWRECOWLR-UHFFFAOYSA-N 277.345 2.495 10 10 CECE CCN(CC)CC(C)(C)NCc1ccc(O)c(O)c1 308616628 YZJWVHZUZGHEEY-UHFFFAOYSA-N 266.385 2.308 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@@H](CO)C2)c([N+](=O)[O-])c1 700458789 OBGVTJNGDUOQQC-GHMZBOCLSA-N 280.324 2.058 10 10 CECE CC[C@H]1CN(c2ccc(OC)cc2N)[C@H](C)CO1 403819785 LSWBFBNSJLEHQH-MNOVXSKESA-N 250.342 2.281 10 10 CECE CNC1(C(=O)N(C)[C@@H](C)c2ccccc2O)CCC1 311482796 RSIZQLVWZFVGEB-NSHDSACASA-N 262.353 2.054 10 10 CECE CNCc1ccc(N2CC[C@@H]3CCN(C)[C@@H]3C2)c(C)c1 2158541741 MYWDUTDRHIFIQO-DOTOQJQBSA-N 273.424 2.245 10 10 CECE C[C@@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@H](CN)C2 2159211267 PINYWMOKZDEODZ-RVMXOQNASA-N 276.380 2.361 10 10 CECE COc1cccc(CN(CC(C)(C)C)C2CNC2)c1O 2160190868 VTEVPIRHOOKBIK-UHFFFAOYSA-N 278.396 2.221 10 10 CECE COc1ccc(O)c([C@@H](C)NCC2(O)CCSCC2)c1 702266742 OLYMYGPIIMVRDZ-LLVKDONJSA-N 297.420 2.310 10 10 CECE CCN1CC[C@@H](N(C)Cc2ccc(F)c(F)c2O)C1 703515648 CUNYWXRCKPFZGR-LLVKDONJSA-N 270.323 2.196 10 10 CECE Nc1ccc(OCc2nc([C@@H]3CCCCO3)no2)cc1 705714763 XZCHBOVGDNUNOW-LBPRGKRZSA-N 275.308 2.472 10 10 CECE C[C@@H](NCc1c(O)cccc1Br)c1nc[nH]n1 706830397 UFFGVTWEEMUYPF-SSDOTTSWSA-N 297.156 2.124 10 10 CECE CN(C)C[C@@H]1CCCN1Cc1cc(F)cc(F)c1O 708399330 MCSOVZIOQZGRPC-LBPRGKRZSA-N 270.323 2.196 10 10 CECE CO[C@H](C)CN(Cc1cc2c(cc1O)OCO2)C(C)C 688102604 BPJJXGLTURASDH-LLVKDONJSA-N 281.352 2.366 10 10 CECE O=C(CNCc1cccc(F)c1O)Nc1ccccc1 2175475229 QZYHWTZBVJXTHB-UHFFFAOYSA-N 274.295 2.260 10 10 CECE COCC1(CNCCc2ccc(O)c(O)c2)CC=CC1 2166520664 BNVNZWXKXZBBLF-UHFFFAOYSA-N 277.364 2.213 10 10 CECE COC[C@]1(C)CCN(CCOc2ccc(N)cc2)C1 381616735 QJOYFFIDGHUBIW-OAHLLOKOSA-N 264.369 2.006 10 10 CECE Nc1ccc(CCNc2nccc3nc[nH]c23)cc1 714218471 RSZZUZCZAUVVBB-UHFFFAOYSA-N 253.309 2.195 10 10 CECE CN(C[C@]12CCC[C@@H]1C2)c1ccc2c(c1)NC(=O)[C@@H]2O 693836290 GYWXONOOJGXEAH-QSGSBWRWSA-N 272.348 2.299 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@@H](C(=O)O)C2(CC2)C1 715986692 FMEQDEZNFVWLOE-SKDRFNHKSA-N 279.311 2.389 10 10 CECE CCNCc1cc(F)c(N2[C@H]3CC[C@H]2COC3)c(F)c1 695041134 CKEJTVTVJVBLHB-RYUDHWBXSA-N 282.334 2.442 10 10 CECE CNCc1ccc(N2C[C@H](O)C[C@@H]2C)cc1Br 384791044 SYIIGBQUTYAERF-JOYOIKCWSA-N 299.212 2.128 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1NC(=O)CCOc1ccc(N)cc1 717137553 RJGCLXYYDVYJQL-KJEVXHAQSA-N 274.364 2.198 10 10 CECE CC1(C)CO[C@H](CCNCc2ccc(O)c(O)c2)C1 717332918 SZLGGIALKNWLMT-GFCCVEGCSA-N 265.353 2.393 10 10 CECE COC(=O)[C@H](C1CC1)[C@@](C)(O)c1ccc(N(C)C)cc1 2167002475 WOUUSCNLCGWNLY-HOCLYGCPSA-N 277.364 2.159 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)CC1(C)CCC1 720466578 UWAUIPQKFPDGSU-UHFFFAOYSA-N 261.369 2.329 10 10 CECE C[C@H](CNCc1ccc(O)c(O)c1)[C@H]1CCCO1 720592330 RICWVQXELIIUIF-QMTHXVAHSA-N 251.326 2.003 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@H]3[C@H]2CCCN3C)cc1 720535824 QAGBZBCFVLCAIW-UHOFOFEASA-N 259.397 2.379 10 10 CECE CC[C@H](N[C@@H](C)c1nc(O)n[nH]1)c1ccccc1O 392420803 QQTCVCIUFVRNLJ-WPRPVWTQSA-N 262.313 2.018 10 10 CECE Oc1ccc(CN[C@@H]2COc3ccccc3C2)c(O)c1 393308930 GZKGSWWGWUTHDV-ZDUSSCGKSA-N 271.316 2.191 10 10 CECE CN(C)CC1CN(c2ccc(CN)c3ccccc23)C1 394661391 LCKBRSIONUQBIT-UHFFFAOYSA-N 269.392 2.296 10 10 CECE CCS[C@@H]1CCN(CCOc2ccc(N)cc2)C1 394996451 HNXUSWDESHFEEW-CQSZACIVSA-N 266.410 2.475 10 10 CECE Cc1ccc(CN[C@@H](C)c2cc(O)ccc2O)nn1 396668042 BEYVHVUBTLYLTP-JTQLQIEISA-N 259.309 2.047 10 10 CECE Cc1ncc(CN(C)c2ccc([N+](=O)[O-])c(CO)c2)s1 400067171 LPEYSBLKBCBAKK-UHFFFAOYSA-N 293.348 2.488 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C(=O)[C@@H]2[C@@H]3CCCO[C@@H]32)C1 2176434425 PPQVNZDAASBVKH-RVMXOQNASA-N 278.356 2.350 10 10 CECE CC(C)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)C(F)(F)F 2062433039 MFOVDAMSBCQWHP-GFCCVEGCSA-N 291.269 2.343 10 10 CECE CC[C@@](NCCN=[N+]=[N-])(C(=O)OC)c1cccc(C)n1 2182557345 USPIDSIMOLWZMK-ZDUSSCGKSA-N 277.328 2.068 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3C[C@H]4CC=CC[C@@H]43)c(Cl)cc21 2177145822 DYYAXSLOBWOZGJ-XOZVTBISSA-N 289.766 2.447 10 10 CECE COc1cccc(O)c1CN(C)[C@@H]1CCN(C)C[C@@H]1C 2170423263 YORGSWBNUBYVGU-GXTWGEPZSA-N 278.396 2.173 10 10 CECE CC(C)c1cnn(Cc2ccc([N+](=O)[O-])cc2O)c1N 2070300549 DFHJALNBZGVJHD-UHFFFAOYSA-N 276.296 2.251 10 10 CECE CCN(c1ccc([C@H](C)NC)c(Cl)c1)[C@@H]1CCNC1=O 2171241948 AGJIAVSSLGFJEY-IINYFYTJSA-N 295.814 2.335 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3[C@H]2C(C)(C)[C@@H]3O)c(F)c1 2178166457 YHHXKJMHOJTJLV-LHAJWOIZSA-N 278.371 2.441 10 10 CECE Cn1cc([C@@H]2CCN(c3ccc(CN)cc3F)C2)cn1 2171788762 ZAYCZCUIFKFXIC-GFCCVEGCSA-N 274.343 2.012 10 10 CECE CC[C@@H]1C[C@@H](NC(=O)CCc2ccc(N)cc2)CCO1 2182858052 NZKSXIUYTQEWQS-LSDHHAIUSA-N 276.380 2.275 10 10 CECE CCc1ncncc1C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2178806060 KSQRJDWNFLVPDW-JTQLQIEISA-N 274.328 2.344 10 10 CECE N[C@H]1CCN(c2ccc3c(c2)OCCCO3)C2(CC2)C1 2162632589 XAINTAHSSLGVGL-LBPRGKRZSA-N 274.364 2.308 10 10 CECE CCN1CCc2cc([C@@]3(O)C[C@@H](CN)C3(C)C)ccc21 2173217372 MOHQQEPPLNCFRF-YOEHRIQHSA-N 274.408 2.261 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@H](O)c2csnn2)cc1 2163150065 QLAMKHLQEZNQLR-KBPBESRZSA-N 292.408 2.118 10 10 CECE Cc1ccc([C@@H](NN)c2ccc(N(C)C)cc2)nc1C 2163134210 VYYXXJZZIPSFGT-INIZCTEOSA-N 270.380 2.317 10 10 CECE Cn1cnc([C@@H](O)c2ccc(N3CCCCC3)cc2)c1 2163105179 DALJJEQCLKWEAX-INIZCTEOSA-N 271.364 2.492 10 10 CECE C[C@@H]1CNCC[C@@]1(O)c1ccc(N2CCCCC2)cc1 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2.406 10 10 CECE CCCNCc1ccc(N2C[C@@H]3CC(O)C[C@H]3C2)cc1 2185193886 KZRVZDUCCXERFN-GJZGRUSLSA-N 274.408 2.393 10 10 CECE COc1cccc(O)c1CN[C@H](C)[C@@H]1CCCO1 2042580425 BYZPOBMPKPFLJY-MFKMUULPSA-N 251.326 2.058 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@@H]1CC[C@@H]1C1CC1 2191828386 YYWQHEDODYTFII-HUUCEWRRSA-N 273.380 2.328 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@H](O)C(C)C 2044749494 FEKRZKVEZHAZKW-HUUCEWRRSA-N 250.386 2.420 10 10 CECE COc1ccc(N2CC[C@@H](O)CC2(C)C)c(N)c1 2050629488 DHBGDHMJIXSQHP-SNVBAGLBSA-N 250.342 2.017 10 10 CECE CC1(C)CN(c2ccc(CO)c(Cl)c2)CC[S@]1=O 2051265044 NEPOJFCWJXNACN-GOSISDBHSA-N 287.812 2.180 10 10 CECE CC[C@H](NC(=O)c1ccc(O)c(O)c1)C(C)(F)F 2051875130 XKEOJMPTJDVQCT-JTQLQIEISA-N 259.252 2.261 10 10 CECE C[C@H]1C[S@@](=O)CCN1c1ccc([C@@H](C)O)c(Cl)c1 2051910999 YUBFKIHWGXNQAE-VOQFUICPSA-N 287.812 2.351 10 10 CECE COC(=O)NCC1CN(c2ccc([C@@H](C)N)cc2Cl)C1 2187295040 VRNFKZBWXSEDJL-SECBINFHSA-N 297.786 2.152 10 10 CECE CC(C)(C)NC(=O)CCN1CCC[C@@H](N=[N+]=[N-])C1 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2.115 10 10 CECE CO[C@@H]1C[C@@H]1CN(C)Cc1cc(F)cc(F)c1O 2067872767 NAOBPLHCVQNEIH-PRHODGIISA-N 257.280 2.137 10 10 CECE C[C@H](CN1CCC[C@H](CN=[N+]=[N-])C1)N1CCCC1 2068425658 YTAGKZPKGMYQQD-CHWSQXEVSA-N 251.378 2.493 10 10 CECE Oc1cc(-c2nc(C[C@@H]3CCSC3)no2)cc(O)c1O 2188925963 YWKGCOPYSCZUHI-ZETCQYMHSA-N 294.332 2.149 10 10 CECE COc1ccc(N2CCSCC(F)(F)C2)c(N)c1 2073071971 NEWGSPZVTYZYRT-UHFFFAOYSA-N 274.336 2.466 10 10 CECE Cc1cccc(CN[C@@H]([C@H](C)O)C(F)(F)F)c1O 2074730219 RITIONZCVXHMBV-KWQFWETISA-N 263.259 2.102 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)CCC4CC3C4)ccc21 2189656680 SGIHARKDSRPSFN-VAVAVGOZSA-N 272.392 2.230 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@H]2COC[C@H]21 2077854299 ZBVMWIULXIUGGD-GIPNMCIBSA-N 251.301 2.313 10 10 CECE CC[C@H](C)[C@H](CO)N[C@@H](C)c1ccc(O)cc1O 2081328485 HAPLGVAFRHJMQH-KWBADKCTSA-N 253.342 2.155 10 10 CECE COc1ccc(N2CCNC[C@H](C)C2)c(F)c1F 2081861633 RFPIPYWQBFSHFS-VIFPVBQESA-N 256.296 2.019 10 10 CECE Cc1ccc(CN(C)[C@@H]2CCOC[C@@H]2F)c(O)c1 2084090658 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CCNCc1ccc(N2C[C@H](OC)[C@H](F)C2)c(F)c1 2090288357 PTKBQHNGDBSMRT-OCCSQVGLSA-N 270.323 2.108 10 10 CECE C[C@@H]1C[C@H]1[C@@H](C)NC(=O)CCOc1ccc(N)cc1 2090354903 CENXQZQWVNYWTI-JTNHKYCSSA-N 262.353 2.198 10 10 CECE C[C@@H](c1ccccc1O)N1CCC[C@@H](C2CNC2)C1 2092579254 POBJBYCSWCXTOO-QWHCGFSZSA-N 260.381 2.385 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@@H]3[C@H](CO)[C@@H]3C2)cc1 2093099183 UKEQTNQRRPWMPW-FZKCQIBNSA-N 260.381 2.161 10 10 CECE CN1C[C@@H]2CCC[C@H](NCc3ccc(N)cc3)[C@H]2C1 2094588122 PJZITSZUZBJTOX-BPUTZDHNSA-N 259.397 2.089 10 10 CECE C[C@H](N[C@@H](C)c1cnn[nH]1)c1ccc(N(C)C)cc1 2112754240 JFAZMZJANJQDFE-QWRGUYRKSA-N 259.357 2.283 10 10 CECE Nc1ccc(COCCOC[C@H]2CCCCO2)cc1 2113468582 PJGJJVOCYBJVPF-OAHLLOKOSA-N 265.353 2.371 10 10 CECE CN(CCCn1cccn1)CCc1ccc(N)cc1 2113778557 VGFPIUKBLIFTEB-UHFFFAOYSA-N 258.369 2.030 10 10 CECE COc1ccc(CN2CCC[C@@H](C)[C@H]2C(=O)O)c(O)c1 2201052244 XKNDNLPRLWHLFO-YGRLFVJLSA-N 279.336 2.086 10 10 CECE CCNCc1ccc(N(C)Cc2cnsn2)cc1OC 2204552065 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275.396 2.249 10 10 CECE COC(C)(C)C[C@@H](N)CNCc1cnc(SC)s1 2257124721 ZEQKWTVMIPIBDY-SECBINFHSA-N 289.470 2.097 10 10 CECE c1cc(N2CCn3cncc3C2)ccc1CNC1CC1 2286545093 RNUXYVOFSMMWCH-UHFFFAOYSA-N 268.364 2.155 10 10 CECE CSc1ncc(CNCC[C@@H]2CN[C@@H](C)C2)s1 2249206596 YVACYQAKLYIVPY-UWVGGRQHSA-N 271.455 2.343 10 10 CECE C[C@H]1CN(c2ccc(OCF)cc2)C[C@@]1(C)CN 2263919808 AFBXAXQYTCBIPY-SMDDNHRTSA-N 252.333 2.414 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCC[C@](F)(C(=O)O)C1 2280521551 VPOYUGDYMPIERB-LKFCYVNXSA-N 283.299 2.048 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@H]2C[C@@H]2C1(C)C 2284536092 HKBVZBIAMDDPNI-GYSYKLTISA-N 273.380 2.326 10 10 CECE CCN(Cc1cnnn1C)c1ccc([C@@H](C)N)c(C)c1 2285142104 XGWXQOIQSHAIQI-GFCCVEGCSA-N 273.384 2.170 10 10 CECE Cc1cc(N2CCC(F)(F)[C@@H](CO)C2)ccc1[C@H](C)N 2285124364 OQSFNHXKIPSIFQ-NWDGAFQWSA-N 284.350 2.469 10 10 CECE COc1ccc(N2C[C@@H]3CNC[C@@H]3[C@@H]2C)c(OC)c1C 2295432484 IGASFZNFPWYNEH-RWMBFGLXSA-N 276.380 2.056 10 10 CECE O[C@H](C[C@@H]1C=CCC1)c1ccc(N2CCNCC2)cc1 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10 CECE Cc1cc(N2CC[C@]3(CO[C@H](C)C3)C2)ccc1CO 2335475012 HKXOKXQQAUDLKF-CZUORRHYSA-N 261.365 2.493 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)c1C 2340860939 CXVCEIPDWQTPJE-RKLWJJNISA-N 260.381 2.283 10 10 CECE COc1cc(Cl)c(N2C[C@H]3C[C@@]3(CN)C2)c(OC)c1 2342285847 IGWTZFCHRKMKFG-YMTOWFKASA-N 282.771 2.142 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)[C@H]2CC[C@@H]3C[C@H]23)cc1 2354747633 VTYWZWLXYMUBJY-BSWAZPDLSA-N 273.424 2.483 10 10 CECE C[C@@]1(c2ccccc2)NC(=O)N(c2ccc(N)cc2)C1=O 52879562 RCFMZQYMECIOPJ-INIZCTEOSA-N 281.315 2.240 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)[C@@H]1CCCNC1 110926151 FLNFINABZZFGIF-CMPLNLGQSA-N 252.333 2.276 10 10 CECE CCOC(=O)c1cnc(Sc2nc(C)cc(O)n2)s1 311584654 PIYYLHIZBGBJCA-UHFFFAOYSA-N 297.361 2.275 10 10 CECE CN(c1ccc(CO)cc1F)[C@@H]1C[C@H]2[C@@H]1[C@@H]1CC[C@H]2O1 2356926804 IUWBOMBJIKFALD-VWOPQJGGSA-N 277.339 2.320 10 10 CECE CCN(C(=O)c1cccc(O)c1O)[C@@H]1CCCC[C@@H]1CN 126696948 PBWFSUUUOQGTRW-DGCLKSJQSA-N 292.379 2.077 10 10 CECE C[C@@H](NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1O 185114929 MRLUALLZLQWTKW-OCCSQVGLSA-N 296.386 2.029 10 10 CECE CCn1nncc1CNCc1c(C)c2ccccc2n1C 418022705 AXWWLLFPGQLROB-UHFFFAOYSA-N 283.379 2.388 10 10 CECE Oc1cc(Br)ccc1CN[C@@H]1[C@@H]2CCO[C@@H]21 1895430832 UNJBYXQGIRNKQR-WCQGTBRESA-N 284.153 2.032 10 10 CECE CC(C)(C)OC(=O)N[C@H]1CCN[C@H]1c1ccccc1O 218759860 OLZRYZXHKASYNQ-AAEUAGOBSA-N 278.352 2.320 10 10 CECE Cc1ncc(CNCc2ccc(O)c(O)c2)s1 40997364 DSZUAEJDUSGKOM-UHFFFAOYSA-N 250.323 2.153 10 10 CECE CCc1nsc(NCCOc2ccc(N)cc2)n1 87642559 RXGKKSLRIZOUCI-UHFFFAOYSA-N 264.354 2.174 10 10 CECE CO[C@@H](C)CCC(=O)N(C)Cc1ccc(N)cc1 228489707 KEOHFSVHMZCSTI-NSHDSACASA-N 250.342 2.042 10 10 CECE COC[C@H]1C[C@H]1CN(C)c1ccc2c(c1)CC[C@@H]2N 2133436687 IKGDAPOHISNXHS-ZENOOKHLSA-N 260.381 2.351 10 10 CECE Cc1ccc(O)c(CNC[C@@H]2CCC[C@@H]2C(=O)O)c1 89448270 CXCFGFAQTJFVOQ-AAEUAGOBSA-N 263.337 2.291 10 10 CECE CN1CC[C@@]2(CCN(Cc3cccc(F)c3O)C2)C1 292883687 YADHWHFQKAXLAA-OAHLLOKOSA-N 264.344 2.059 10 10 CECE CC(C)Cn1ncnc1C[C@@H](N)c1ccc(N(C)C)cc1 97278465 YEWZHVLHYMAJMY-OAHLLOKOSA-N 287.411 2.243 10 10 CECE CCN(C[C@H](C)C(=O)O)[C@H](C)c1ccccc1O 249964598 NKRLKPMDRUZNOY-WDEREUQCSA-N 251.326 2.496 10 10 CECE COC(=O)[C@H](N[C@@H](C)c1cc(OC)ccc1O)C1CC1 272963233 AYJNRQRCCPDSKZ-LKFCYVNXSA-N 279.336 2.003 10 10 CECE CC[C@H](c1ccccc1O)N1CCn2c(C)nnc2C1 372590671 FYXHWXDMNRJYGQ-CYBMUJFWSA-N 272.352 2.259 10 10 CECE C[C@H](N[C@@H](CO)C[C@H](O)C(C)(C)C)c1cc(F)ccc1O 284415590 QMHTWGDAJDUUCQ-NVBFEUDRSA-N 299.386 2.340 10 10 CECE CC(=O)C(=O)COC(=O)CCCCOc1cccc(C)c1 808508705 BNYKEKQIOXBRIK-UHFFFAOYSA-N 292.331 2.245 10 10 CECE COc1ccc([C@@H](C)NC[C@H]2C[C@H](OC)C2)c(O)c1 714677440 PFKDDTITSINEAJ-NQBHXWOUSA-N 265.353 2.476 10 10 CECE CN1CCCc2cc([C@H](O)[C@]3(N)CC[C@H]4C[C@H]43)ccc21 2165546078 WXXTYDHELKFADL-ISGYEWALSA-N 272.392 2.230 10 10 CECE CC[C@H](O)[C@@H](N)c1cc(Br)c(F)c(F)c1O 713760478 CMDATAWYDIIRCG-RCOVLWMOSA-N 296.111 2.204 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@@]2(C)CO)c(F)c1 722976908 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Oc1ccc(Cl)cc1CN[C@@H]1CNCCC1(F)F 841074995 KHDVJNCGCYFIRB-LLVKDONJSA-N 276.714 2.132 10 10 CECE C[C@H](C(=O)NCc1c(O)cccc1F)C(C)(F)F 928705884 MGMQIEXYEZWZHW-SSDOTTSWSA-N 261.243 2.439 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)C=C(C)C)C2)cc1 855234963 SDKJNQKXLAOWGX-CYBMUJFWSA-N 274.364 2.356 10 10 CECE COc1cccc([C@H](C)N[C@H]2C[C@H](C)n3ncnc32)c1O 850499457 PYBYDRZKWWWHLW-NHCYSSNCSA-N 288.351 2.349 10 10 CECE O=C(c1cnc2n1CCCCC2)N1Cc2cccc(O)c2C1 871207283 MGZRTMKYLUXETK-UHFFFAOYSA-N 297.358 2.471 10 10 CECE CN(C)c1ccc(C2=C[C@H](N3CCNCC3)CC2)cc1 71610840 SEWLYXRCHFOWQH-QGZVFWFLSA-N 271.408 2.204 10 10 CECE CCN(CC)c1ccc(CN[C@@](C)(CO)COC)cc1F 777483797 ZXJKEFPDCJKNKP-INIZCTEOSA-N 298.402 2.159 10 10 CECE CCCc1nn(C)c(NCc2ccc(N)cc2)c1N 1876387267 BEZJZUSYJMXZOM-UHFFFAOYSA-N 259.357 2.149 10 10 CECE Cc1cc(O)c(CN2CCNC(=O)CC2(C)C)cc1Cl 895399348 AUPNZCYCKNDNEE-UHFFFAOYSA-N 296.798 2.455 10 10 CECE COc1ccc(N2CC[C@@H](N[C@@H]3COCC3(C)C)C2)cc1 895228138 ISJDKYUSOWLMLF-CZUORRHYSA-N 290.407 2.289 10 10 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Cc1cc([C@H](C)N)ccc1N1C[C@H]2C[C@H]1CC[C@H]2O 2232102807 QGZMQWJDCLACQR-ADSMDIBLSA-N 260.381 2.364 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1CC(n2cccn2)C1 2232104735 OAYPDHVZOVJRQL-GFCCVEGCSA-N 257.337 2.306 10 10 CECE Nc1cccc(F)c1N[C@@H](C(F)F)[C@H]1CCOC1 2223196895 FGLISLYCPFWKQQ-OIBJUYFYSA-N 260.259 2.490 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCOC(F)(F)C1 2223985758 UIXBQUDJFUWKRJ-SNVBAGLBSA-N 256.296 2.444 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)C[C@H](CC(=O)O)C(F)F)C1 2234172538 UBOPKTNOZKLWMB-SFYZADRCSA-N 290.270 2.034 10 10 CECE CCO[C@@H]1C[C@@H]2CN(c3c(F)cc(CO)cc3F)C[C@H]21 2234328364 FDEBLISZNPQJHV-JTNHKYCSSA-N 283.318 2.318 10 10 CECE CCN(c1ccc2c(c1)CC[C@@H]2N)[C@H]1CCC[C@H]1O 2224419699 ISRXYZOIDQGPDK-HRCADAONSA-N 260.381 2.372 10 10 CECE Cn1cccc(N[C@@H]2CCc3cccc(O)c32)c1=O 2224782087 LJHSCGGFGQOXHP-LLVKDONJSA-N 256.305 2.190 10 10 CECE CC(C)Oc1ccc(N2C[C@H](CO)OC(C)(C)C2)cc1 2235095207 XIUPTCGJXOAXKM-OAHLLOKOSA-N 279.380 2.450 10 10 CECE C[C@@]12CN(c3ccc4c(c3)OC(F)(F)O4)C[C@@]1(CO)C2 2235068203 YKUBXKOKGWHJJK-CHWSQXEVSA-N 283.274 2.217 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@@]12CCC[C@@H]1OCC2 2225802347 YSTCSMWZCVEBEJ-SRRSOLGSSA-N 264.329 2.293 10 10 CECE COc1ccc(N2CC[C@@H](CCO)[C@@H](C)C2)c(C=O)c1 2235981065 ZZBLSRFUDHGJBM-STQMWFEESA-N 277.364 2.353 10 10 CECE COc1ccc(N(C)[C@H]2C[C@H](O)C2)c(CNC(C)C)c1 2235961106 AQEBAUXUGLYTKE-HDJSIYSDSA-N 278.396 2.153 10 10 CECE CCN1CCc2cc(N3CC[C@H]4C[C@@]4(O)C3)ccc21 2226657589 SSGXTDZILAGGHQ-XJKSGUPXSA-N 258.365 2.030 10 10 CECE C[C@H]1Cc2cc(N3C[C@H]4C[C@@H](O)C[C@H]4C3)ccc2O1 2226700809 BUTPKWIMAIXVRD-DNVSUFBTSA-N 259.349 2.217 10 10 CECE C[C@H]1Cc2cc(N3[C@H]4CC[C@@H](C4)[C@@H]3CO)ccc2O1 2226700974 SLAFMCLIHQFXLH-UHXUCMFUSA-N 259.349 2.360 10 10 CECE OC[C@H]1[C@H]2CN(c3ccc(OC4CC4)cc3)CC[C@H]21 2226760205 QQUNBYFXIJNAKC-OWCLPIDISA-N 259.349 2.292 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@@H]1CC1(F)F 2227038272 VIWYDDPFAPQFMF-YNEHKIRRSA-N 270.323 2.029 10 10 CECE CNCc1ccc(N2C[C@H](C)C[C@@H](O)[C@H]2C)c(F)c1 2227611752 FOBZQBGASLAEHM-UEKVPHQBSA-N 266.360 2.141 10 10 CECE C[C@@]1(C(=O)O)C=CCCN1CCCc1ccc(N)cc1 2239353535 YYBDIHOQCCWSGG-INIZCTEOSA-N 274.364 2.307 10 10 CECE COC[C@]12CN([C@H](C)c3ccccc3O)C[C@H]1CCO2 2239821331 FPGWBAPFTMFZLL-XJKCOSOUSA-N 277.364 2.191 10 10 CECE CC[C@@H](C)NCc1ccc(N(C)CC(=O)NC)c(C)c1 2240039247 CMYKUBSYFLQDAY-CYBMUJFWSA-N 277.412 2.065 10 10 CECE CCn1ncc([N+](=O)[O-])c1OCCc1ccc(N)cc1 2240581270 YBFDKGSUQWQNLI-UHFFFAOYSA-N 276.296 2.015 10 10 CECE Cc1cc([C@@H](C)N)ccc1N(C)CCCn1cncn1 2240743967 MGBGGMDBZRPTKL-CYBMUJFWSA-N 273.384 2.133 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C1CCS(=O)(=O)CC1 2240764787 WWLSWWSOJRPQJS-LBPRGKRZSA-N 296.436 2.028 10 10 CECE CO[C@H]1CCN(c2ccc([C@H](C)N)cc2C)C[C@@H]1OC 2240835219 HUJPRVZXARMJRS-RCBQFDQVSA-N 278.396 2.255 10 10 CECE Oc1cccc(Cl)c1CN[C@]12COC[C@H](C1)C2 2250904030 QDBKOGSGLOGZDP-GMZHKTEUSA-N 253.729 2.314 10 10 CECE Cc1cc(N2CCc3c(ncn3C)C2)ccc1[C@H](C)N 2285122900 YXCSKHHYIPDYNU-LBPRGKRZSA-N 270.380 2.311 10 10 CECE CSc1ncc(CNCc2nnc(C3CC3)o2)s1 2256942022 JWADDGFQVQVLEP-UHFFFAOYSA-N 282.394 2.415 10 10 CECE CSc1ncc(CNCC[C@H]2CC3(CC3)CN2)s1 2257129611 ZAIMIFIJYSRKAI-JTQLQIEISA-N 283.466 2.487 10 10 CECE C[C@@]1(CNCc2ccc(F)cc2O)CCC[C@@H]1O 2258805939 NISDMCLMTYJIGY-KBPBESRZSA-N 253.317 2.172 10 10 CECE COCCCCCOCCOc1ccc(N)cc1 2258958398 GLXCOKJRELMMFY-UHFFFAOYSA-N 253.342 2.481 10 10 CECE COc1cc(OC)c(N2CCC3(CNC3)C2)cc1Cl 2270356957 DLTCTDDJHDEEFG-UHFFFAOYSA-N 282.771 2.157 10 10 CECE COc1cc(OC)c(N2C[C@@H]3C[C@@H](O)[C@H]3C2)cc1Cl 2270375763 DXNIBMCSSBUXSB-HOTUBEGUSA-N 283.755 2.174 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3COC[C@H]2C3)c(F)c1 2271361488 QJGIXNMKSTUOMT-GMXVVIOVSA-N 264.344 2.331 10 10 CECE CC[C@@H]([C@H](C)CN(C)C)N(C)Cc1cc(N)ccc1O 2288781698 UKINJGRUVFYWMF-DOMZBBRYSA-N 279.428 2.383 10 10 CECE C[C@@H]1CCN(c2ccc(OC(F)F)cc2)C[C@H]1O 2263933293 KBODXSSBIPQIOK-BXKDBHETSA-N 257.280 2.495 10 10 CECE NC[C@H]1CC(F)(F)CN1Cc1ccc(Cl)cc1O 2264256238 HBYUWVFCIXZWNC-SNVBAGLBSA-N 276.714 2.214 10 10 CECE COc1cccc(O)c1CNCCc1csnc1C 2265448455 GFOHVKWYJJFZJF-UHFFFAOYSA-N 278.377 2.498 10 10 CECE CC[C@@H](C)[C@H](N[C@@H](C)c1cc(C)ccc1O)C(N)=O 2279015930 BKFGOWHMIOETCH-SUNKGSAMSA-N 264.369 2.251 10 10 CECE Cc1cc(N2CC[C@@H](C)[C@H](CO)C2)ccc1[C@H](C)N 2269751679 HMZAJVNMKGTYBI-XBFCOCLRSA-N 262.397 2.469 10 10 CECE COC1([C@H](NN)c2ccc(N(C)C)cc2)CC(CF)C1 2281141591 LPGAGICOSODSKW-XGTXGMFGSA-N 281.375 2.022 10 10 CECE CCOC(=O)CCS[C@H](C)C(=O)Nc1ccc(N)cc1 2281337230 OQODBAMCXYDPLI-SNVBAGLBSA-N 296.392 2.282 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])c1cc(OC)ccc1Cl 2283274945 SVHXAGLOGUVHBD-NSHDSACASA-N 298.730 2.463 10 10 CECE COCCN(c1ccc([C@@H](C)N)c(C)c1)[C@@H]1CCOC1 2285128508 ATKHJJJKSOPJKA-UKRRQHHQSA-N 278.396 2.256 10 10 CECE COc1ccc(N(C)[C@@H](CCO)C(F)F)c(OC)c1C 2295377145 BJKBPBCTQOYIIN-NSHDSACASA-N 289.322 2.465 10 10 CECE CC(C)CNCc1ccc(N2C[C@@H]3C[C@H](C2)[C@@H]3O)cc1 2286237702 ZXLDIFMALGNYKF-QLPKVWCKSA-N 274.408 2.249 10 10 CECE O=C(C=Cc1ccc(O)c(O)c1)N[C@H]1C=CCCC1 2307989547 AYMYFSCYLVNGQS-LBPRGKRZSA-N 259.305 2.336 10 10 CECE Cc1c([C@@H](C)O)ccc(N(C)CC[S@@](C)=O)c1C 2318554173 OQKZLLBUAITZDS-KZULUSFZSA-N 269.410 2.171 10 10 CECE COc1ncc(CN2CC[C@H](N=[N+]=[N-])C2)cc1F 2325197155 MKNDADDEJQPPAL-VIFPVBQESA-N 251.265 2.114 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)c1ccc(CN)c(SC)c1 2328543941 YJBMZOUMTZMVTG-QWHCGFSZSA-N 266.410 2.481 10 10 CECE C[C@H](NC[C@H]1[C@@H]2CCOC[C@@H]21)c1cc(F)ccc1O 2331249488 KADYGUNTXMSEJW-RETIQXCHSA-N 265.328 2.464 10 10 CECE CN(c1ccc(CO)cc1)[C@H]1C[C@H]2[C@H]3CC[C@@H](O3)[C@@H]12 2331816137 NEGMSMNNWCLRTL-AALSBFMBSA-N 259.349 2.181 10 10 CECE C[C@@H]1CCN(c2ccc(CN)c(C3CC3)c2)C[C@H]1O 2339143281 IVQVFYLTAIWUFT-BDJLRTHQSA-N 260.381 2.230 10 10 CECE C[C@H](O)[C@@H]1CCCN1c1ccc(CN)c(C2CC2)c1 2339154779 BCKSMCVYFWVBRP-ZBEGNZNMSA-N 260.381 2.372 10 10 CECE Cc1ccc(O)c(CN2C[C@@H](C(=O)O)C23CCC3)c1 2339438153 FPWRTTOQTSJHQS-LBPRGKRZSA-N 261.321 2.140 10 10 CECE CO[C@H]1C[C@@H]2C[C@H]1CN2CCCc1ccc(N)cc1 2340774143 HFLLKMFTIMPBGD-BPUTZDHNSA-N 260.381 2.311 10 10 CECE CN[C@H](C)c1ccc(N2CC(N(C)C)C2)c(C)c1C 2340847180 RUJGUGBNIZEMBY-CYBMUJFWSA-N 261.413 2.334 10 10 CECE Cc1c([C@@H](C)O)ccc(N2C[C@@H](F)[C@H](CO)C2)c1C 2340848168 JYSNGXHOUNCUQR-MBNYWOFBSA-N 267.344 2.123 10 10 CECE COC(C)(C)C1(C(=O)N2CCC(N=[N+]=[N-])CC2)CC1 2343521684 CVTVQWOTWREUNF-UHFFFAOYSA-N 266.345 2.493 10 10 CECE C[C@@H](NC[C@@]1(O)CCCSC1)c1cc(F)ccc1O 2343694057 QASHXLWZVMIGAX-YGRLFVJLSA-N 285.384 2.440 10 10 CECE C[C@H](NC[C@]1(O)C[C@H]1C(F)(F)F)c1ccccc1O 2344264102 BHLMJELTQYVFOJ-XXILOJSOSA-N 275.270 2.356 10 10 CECE CCN[C@@H](c1ccccc1O)C1(O)CC2(CSC2)C1 2353393282 YGLFFXWOXGBUKD-ZDUSSCGKSA-N 279.405 2.301 10 10 CECE CN1CCCc2cc(CN[C@H]3C[C@@H]4OCC[C@H]34)ccc21 2354056066 MAZCTXNFDNTWCK-VYDXJSESSA-N 272.392 2.336 10 10 CECE CC(C)CC[C@@](NCCCN=[N+]=[N-])(C(N)=O)C1CC1 305996190 FZFWPXOQBODEIL-ZDUSSCGKSA-N 267.377 2.347 10 10 CECE CN(C[C@H]1OCC[C@@H]1F)c1ccc2c(c1)CC[C@H]2N 2128313385 SICNFURWXWCVLX-RRFJBIMHSA-N 264.344 2.196 10 10 CECE CC(C)CN(CCO)c1ccc2c(c1)OCCCO2 2226805791 LFHRYJLXDKXCTK-UHFFFAOYSA-N 265.353 2.303 10 10 CECE Nc1ncccc1OCc1ncccc1Br 309267949 RMZGNUXKPRKBCL-UHFFFAOYSA-N 280.125 2.400 10 10 CECE N[C@@H](CF)c1ccc(F)c(Br)c1O 306794019 HFUMEYPNSHKNKN-LURJTMIESA-N 252.058 2.263 10 10 CECE CCCCN(CCO)c1ccc(CN)cc1Cl 62793031 JNBZLKUNISQVET-UHFFFAOYSA-N 256.777 2.398 10 10 CECE C[C@H](CC1CC1)NC(=O)/C=C/c1ccc(O)c(O)c1 181076269 FDWAPPRKCHMQLP-BREXMAIKSA-N 261.321 2.416 10 10 CECE Cc1cc(Br)c(O)c([C@@H](N)CCO)c1C 212713122 ASJOHJJDYDZFPK-VIFPVBQESA-N 274.158 2.154 10 10 CECE COC[C@@](C)(CNCc1ccc(OC)c(C)c1)OC 1895307298 DTHLAXMODORFFJ-OAHLLOKOSA-N 267.369 2.145 10 10 CECE Nc1ccc(Nc2cc3c(cc2[N+](=O)[O-])CC(=O)N3)cc1 35345295 SQMGCWYVLSKWIW-UHFFFAOYSA-N 284.275 2.415 10 10 CECE Cn1nccc1CNCc1cccc(Br)c1O 71138206 VTPPZPJGSYRHMZ-UHFFFAOYSA-N 296.168 2.178 10 10 CECE Cc1cc(OCCCN(C)C)ccc1N1CCC[C@H](N)C1 122403742 WXTGQOWOGJCRLJ-HNNXBMFYSA-N 291.439 2.253 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCN(C)[C@H](C)C1 133897410 XGWGSOFRHGGVSZ-MNOVXSKESA-N 252.333 2.228 10 10 CECE CC(C)CNC(=O)[C@H](C)NCc1cccc(Cl)c1O 228974652 CLHBBTWPEVBWPD-JTQLQIEISA-N 284.787 2.296 10 10 CECE CN1CCc2cc(CNC[C@@H]3CCC[C@@H]3CO)ccc21 89485533 JKBCPNWBJRCGDE-JKSUJKDBSA-N 274.408 2.177 10 10 CECE COC[C@H](C)[C@@H](C)N[C@@H](C)c1ccc(O)cc1O 381275379 STVHQGDOLIYDMR-AXFHLTTASA-N 253.342 2.419 10 10 CECE C[C@@H](c1cc(O)ccc1O)N1CCC[C@@H]([C@@H](C)N)C1 226332584 QDWOKOAOOKHGNW-GRYCIOLGSA-N 264.369 2.218 10 10 CECE CCN(c1ccc(N)cc1)S(=O)(=O)C1CCCC1 97834792 ATJGIRIWBSBJGB-UHFFFAOYSA-N 268.382 2.368 10 10 CECE Oc1c(Br)ccc(Cl)c1[C@@H]1COCCN1 95719060 DOLYQRXROFGHBL-QMMMGPOBSA-N 292.560 2.469 10 10 CECE N[C@H](CCO)c1cc(Br)cc(Cl)c1O 95716349 XLCMREXRSZYBJH-MRVPVSSYSA-N 280.549 2.190 10 10 CECE Oc1cc(Br)ccc1[C@H]1CCOCCN1 96886675 URBWOFNFGDGDBR-SNVBAGLBSA-N 272.142 2.206 10 10 CECE CCOc1ccc(O)c(CN[C@@H]2C[C@H]3OCCC[C@@H]23)c1 249194524 AUVCDYRXAOSFBO-SQWLQELKSA-N 277.364 2.448 10 10 CECE Oc1ccc(NC(=S)NCc2ccccn2)cc1 243455765 NFXVXZOEPXILOE-UHFFFAOYSA-N 259.334 2.274 10 10 CECE C[C@@H](N)c1c(Br)cc(O)c(O)c1F 258427688 SOTWMIMWMZPTQD-GSVOUGTGSA-N 250.067 2.019 10 10 CECE C[C@H](CCN)c1c(O)c(O)cc(F)c1Br 258441885 CGNXEPOQMRYBSU-RXMQYKEDSA-N 278.121 2.452 10 10 CECE Cc1cccc(CN2CCCC[C@H]2[C@H]2CNC(=O)C2)c1O 373216894 OZUWPSOJKGAXGY-CABCVRRESA-N 288.391 2.191 10 10 CECE CCN[C@@H](C)c1ccc(N2CCC[C@@H](O)CC2)cc1O 381160458 VRDTTYJYRMDRGY-GXTWGEPZSA-N 278.396 2.414 10 10 CECE CCn1nccc1CCSc1ncc(C(=O)OC)s1 295283277 KVRLJUJZXNJGJQ-UHFFFAOYSA-N 297.405 2.481 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 808531811 YFNCIBWKEJYHDE-YNEHKIRRSA-N 266.337 2.294 10 10 CECE Nc1ccc(CNC(=O)/C=C/c2ccc(O)cc2)cc1 700733530 LLPRQULRQGFHNV-BJMVGYQFSA-N 268.316 2.304 10 10 CECE CCOC(=O)c1cccc(N)c1N[C@H](CC)CCCO 2165151367 CKCWJUJTAAWDLJ-LLVKDONJSA-N 280.368 2.409 10 10 CECE CCc1cc(O)nc(CN(C)c2ccc(OC)cc2)n1 2165163316 DMUFKRXWSMQFEF-UHFFFAOYSA-N 273.336 2.390 10 10 CECE COCC12COC(CN(C)c3ccc(OC)cc3)(C1)C2 2165163042 BIUZUPNHDRBLKJ-UHFFFAOYSA-N 277.364 2.327 10 10 CECE CN1CCc2cc([C@@H](N)c3cc(C(F)F)n[nH]3)ccc21 2168507280 BBEFMWBAKXWMOC-CYBMUJFWSA-N 278.306 2.388 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1 715496288 XIPQHHFGHSABJN-VXGBXAGGSA-N 267.275 2.292 10 10 CECE COc1ccc(CNC[C@@H](C)[C@H]2CCCO2)c(O)c1 720545833 HHCOMOFUTCHLMA-IAQYHMDHSA-N 265.353 2.306 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](O)[C@H]3CC[C@@H]32)c(F)c1 2133738589 YUYZRFWWMLOIOU-PBLBJHRBSA-N 264.344 2.195 10 10 CECE CCc1cccc(CN2CC[C@H](O)C(F)(F)C2)c1O 826952630 ODIHSOLXVBDJNK-LBPRGKRZSA-N 271.307 2.157 10 10 CECE Cc1cc(O)c(CN2C[C@@H](C)C(O)[C@H](C)C2)cc1C 827151740 IWGLLSWCQUIKOZ-CHWSQXEVSA-N 263.381 2.458 10 10 CECE Cc1cccc(CN2CCC3=C(CCC(=O)N3)C2)c1O 826785593 YSHQJSSBEFAWMV-UHFFFAOYSA-N 272.348 2.070 10 10 CECE CCC/C=C\[C@H](O)C(=O)NCc1cc(Cl)ccc1O 911898408 QBFJCHBOBSGSIJ-ZFDPJTLLSA-N 283.755 2.379 10 10 CECE Oc1ccc(Br)cc1CN[C@@H]1CCCCNC1 841090335 ODVUUSLSQWYQKE-GFCCVEGCSA-N 299.212 2.386 10 10 CECE Cc1cc(Br)cc(CN[C@@H](C)[C@H](C)N)c1O 841076892 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CC1(C)C[C@H](O)C[C@@H](NC(=O)Nc2ccc(N)cc2)C1 693842389 BFNNBYUOZNTING-CHWSQXEVSA-N 277.368 2.330 10 10 CECE CC1CCN(C(=O)NCCOc2ccc(N)cc2)CC1 91972351 BNOMANCVIQZOKG-UHFFFAOYSA-N 277.368 2.089 10 10 CECE COc1ccc([C@@H](C)N[C@H](C)C(OC)OC)c(O)c1 79639518 WICPEMFWYXPYKK-NXEZZACHSA-N 269.341 2.059 10 10 CECE CN(C(=O)/C=C/c1cn(C)cn1)c1c(F)cccc1F 1355375795 NKQLFUVRCOOBNS-VOTSOKGWSA-N 277.274 2.375 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@@H](CO)[C@@H]3C2)c(Cl)c1 2117679889 DKMFEHZSXBPACO-RWMBFGLXSA-N 280.799 2.124 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)C2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)CC1 2117729608 XJYVBJKRDLQEAF-NAKRPEOUSA-N 260.341 2.485 10 10 CECE CCN[C@]1(C(N)=O)C[C@@H](Sc2nccs2)CC[C@H]1C 2119135292 YWWQUIXKIOMOSR-GBIKHYSHSA-N 299.465 2.257 10 10 CECE CC[C@]1(C)CCN1C(=O)CCOc1ccc(N)cc1 2119468260 SVSMFAWNWRDZNP-OAHLLOKOSA-N 262.353 2.439 10 10 CECE CN(c1cc(Cl)c(CN)cc1F)[C@@H]1CN2CC[C@H]1C2 2120887110 KATCUFWLGPGQRI-LKFCYVNXSA-N 283.778 2.078 10 10 CECE COC[C@H]1CCN[C@@H](c2ccc3c(c2)CCN3C)C1 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COc1cc(Cl)c(N2C[C@@H](O)C3(CC3)C2)c(OC)c1 2342418425 ZCIVQWLEEGHRPG-GFCCVEGCSA-N 283.755 2.318 10 10 CECE COc1ccc(CN2C[C@H]3CC[C@@H](OC)[C@H]3C2)c(O)c1 2353934759 MXYFRKASTOIGOO-DIOULYMOSA-N 277.364 2.258 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2C[C@@H]3OCC[C@@H]3O2)cc1 2354620036 FGGHKNSOIDGKEA-MWNCTCPHSA-N 277.364 2.123 10 10 CECE CO[C@@]1(C)C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(O)cc1O 2356193225 UZAWYRYETIWHNE-DUPGQFARSA-N 277.364 2.391 10 10 CECE CN(C)c1nnc(SCc2ccc(N)cc2)s1 111890758 HRLGGRHFIMNRRE-UHFFFAOYSA-N 266.395 2.479 10 10 CECE COc1ccc(CN(C)C2C[C@@H]3CC[C@@H](C2)N3)c(O)c1 104145499 RGQJSUBKELMJRG-STQMWFEESA-N 276.380 2.116 10 10 CECE CCCNc1cc(Sc2nccs2)nc(N)n1 122112359 RXBCWPSGLFKTBZ-UHFFFAOYSA-N 267.383 2.488 10 10 CECE C[C@@H]1SCCN([C@@H](C)C(=O)Nc2ccc(N)cc2)[C@H]1C 132281708 HGZLPUYFGBDTCG-SRVKXCTJSA-N 293.436 2.422 10 10 CECE COc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1F 182510690 VMGHLUJVMGVRAA-UHFFFAOYSA-N 291.278 2.176 10 10 CECE O=C(Nc1ccccc1)Nc1cc(O)c(O)c(O)c1 217278784 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10 10 CECE Cc1nc2n(c1C(=O)c1cccc3c1NCC3)CCC2 2163942743 HCLIGGMWPRHVTA-UHFFFAOYSA-N 267.332 2.337 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCCN2C)[C@@H]1CCCN1 2164107268 JSKVZFLDVQOILY-RDJZCZTQSA-N 273.424 2.472 10 10 CECE Cc1ccc([C@H](C)N[C@@H]2CNCCC2(F)F)c(O)c1 817979438 BBGMKUDDHHZALO-GXFFZTMASA-N 270.323 2.348 10 10 CECE CN(C)c1ccc(CNC(=O)NC2C[C@@H]3C[C@H]3C2)cc1 818105765 NJUCHGIEZMJXPW-STQMWFEESA-N 273.380 2.350 10 10 CECE CCOc1ccc(CN2CC[C@H](CO)[C@H]2CC)c(O)c1 824637173 WKMGHIIEXAMRLA-UKRRQHHQSA-N 279.380 2.384 10 10 CECE CCNCc1ccc(N2CC[C@H]3OCC[C@@H]3C2)cc1 724829827 OUQISAGREIVNOI-GDBMZVCRSA-N 260.381 2.411 10 10 CECE c1cc2c(cc1CN[C@]13CCC[C@H]1NCC3)CCCO2 904383739 CZHJMRKMGWJXPR-SJORKVTESA-N 272.392 2.386 10 10 CECE Nc1ccc(NC[C@H]2CCOC23CCOCC3)cc1 2134018417 WULDHWHIBZWVNJ-GFCCVEGCSA-N 262.353 2.266 10 10 CECE COc1cc(CN2C[C@@H]3C[C@H]2CS3)c(O)cc1C 840168848 NXTCTCXNUIZGLE-RYUDHWBXSA-N 265.378 2.399 10 10 CECE C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C(=O)O 843040101 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CC1(C)C[C@@H](O)CN(Cc2cc(F)cc(F)c2O)C1 895460657 QLRNHDVXEUOTTB-LLVKDONJSA-N 271.307 2.263 10 10 CECE COc1c([N+](=O)[O-])ccc(CN[C@H](C)C(F)F)c1O 895725667 RTKPUPXPFSAMGY-ZCFIWIBFSA-N 276.239 2.052 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](C)[C@H](O)C2)c(F)c1 1880478267 DKVCFQFMUGKGDJ-MWODSPESSA-N 271.307 2.225 10 10 CECE CN[C@H](C)c1cc(F)c(N(C)[C@H](C)CCO)c(F)c1 1880971562 ZBENBPHIYXLCLG-NXEZZACHSA-N 272.339 2.452 10 10 CECE CC[C@H]1CN(c2c(F)cc([C@@H](C)N)cc2F)C[C@@H]1O 1880927326 JXEQASFGMVQWRN-ZDMBXUJBSA-N 270.323 2.192 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H](C2)O3)c(C(F)(F)F)c1 1899781640 PUQXKAJZSUAOPL-AOOOYVTPSA-N 272.270 2.142 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC[C@H]3CC[C@H]2OC3)c1 898212784 BGSSMCWXSRLBND-SGIREYDYSA-N 277.364 2.448 10 10 CECE O=C(c1ccccc1)[C@@H]1NCCc2c1ccc(O)c2O 75793584 DJSDYHCEVARGKT-CQSZACIVSA-N 269.300 2.168 10 10 CECE C[C@@H]1CN(C)CC[C@H]1NCc1ccc2c(c1)CCCO2 1964042268 GBWCDFULNSEEKX-CZUORRHYSA-N 274.408 2.441 10 10 CECE COc1ccc(CN[C@@H](C)Cc2nccn2C)cc1C 1964057358 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COc1ccc([C@@H](NN)c2ccc3c(c2)CCN3C)s1 2163142327 DVBUFEDAOYQDOB-HNNXBMFYSA-N 289.404 2.302 10 10 CECE Cc1cnc([C@H](O)c2ccc3c(c2)CCCN3C)n1C 2163101950 GMMBFWJSXODTRK-OAHLLOKOSA-N 271.364 2.193 10 10 CECE C[C@@H](N)c1ccc2c(c1)CCN2Cc1nccn1C 689358859 GQOWEVHSSLVGGS-LLVKDONJSA-N 256.353 2.003 10 10 CECE CNCc1ccc(N2CC[C@@H]3COC[C@@H]3C2)c(F)c1 690286785 URWCYDVNRZACPN-OLZOCXBDSA-N 264.344 2.018 10 10 CECE CC(C)(C)c1cc(=NCc2cc(N)ccc2O)[nH]cn1 379962345 GLGCTOOKDKEEKM-UHFFFAOYSA-N 272.352 2.096 10 10 CECE CN(C)c1ccc([C@]2(C)C(=O)CCN2C2CC2)cc1 712092091 PEESHAUIDGUEHB-MRXNPFEDSA-N 258.365 2.405 10 10 CECE CCN1CC[C@H]1CNCc1ccc(N2CCCC2)cc1 712593695 GWEHNGNESVKPJH-KRWDZBQOSA-N 273.424 2.471 10 10 CECE CCCN(Cc1ccc(N)cc1)c1ccnc(C#N)n1 380991684 HGASMCMFYLIENH-UHFFFAOYSA-N 267.336 2.347 10 10 CECE C[C@@H]1[C@@H](N(C)C)CCN1c1ccc(CNC2CC2)cc1 381241957 ZUVJJEINCBQDLU-DYVFJYSZSA-N 273.424 2.467 10 10 CECE CC1(C)CN(C(=O)Nc2ccc(N)cc2)[C@H]2COC[C@H]21 384617429 RAUYUQKMECDIKK-OLZOCXBDSA-N 275.352 2.158 10 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GOFWHGQVBUFLEH-NXEZZACHSA-N 277.320 2.066 10 10 CECE Nc1ccc(CCC(=O)c2ncnc3scnc23)cc1 2189134485 HCSXXHDMRLIPMR-UHFFFAOYSA-N 284.344 2.484 10 10 CECE C[C@@H]1[C@@H](C)N(C)CC[C@H]1N(C)c1ccc(CN)c(F)c1 2193645935 NACODYLWGFPHQD-XHBSWPGZSA-N 279.403 2.449 10 10 CECE CCNCc1ccc(N2CC(C)(C)[C@@H]2CO)cc1C 2092549035 LTRAFKYOXPHQPS-HNNXBMFYSA-N 262.397 2.312 10 10 CECE COc1ccc(CN2CC[C@@H]3CCC[C@@]32CN)c(O)c1 2197338971 HJVGELARROLLHI-XJKSGUPXSA-N 276.380 2.104 10 10 CECE CC(C)CNCc1ccc(N2CC[C@@]2(C)CO)cc1 2097236577 GBLKPFJNRAFBQH-INIZCTEOSA-N 262.397 2.393 10 10 CECE N[C@H]1CCCc2cc(N3[C@H](CO)[C@H]4CC[C@@H]3C4)ccc21 2184687759 UPGINLCOFVYXPC-UWWPHRKUSA-N 272.392 2.372 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@H]1C[C@@H]2CC[C@@H]2C1 2190427308 KZVIDDJKPWPPEQ-HOZXKAFVSA-N 272.348 2.297 10 10 CECE Cc1ccc(CN(C)c2ccc3c(c2)CC[C@@H]3O)nn1 2184733548 IZRVIWGRKPIMNB-INIZCTEOSA-N 269.348 2.401 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@H]4CC[C@H](O)[C@H]3C4)ccc21 2184727476 PKKFYGLTLHMMOU-AHBIMHKDSA-N 272.392 2.372 10 10 CECE CCCN(Cc1c(O)cccc1F)[C@H]1CCNC1 2042632653 JHOREOYABSICSJ-NSHDSACASA-N 252.333 2.105 10 10 CECE CCc1cccc(CN[C@](C)(CO)C(F)F)c1O 2043176890 PAOVOSHMKHDSOZ-CYBMUJFWSA-N 259.296 2.060 10 10 CECE COc1ccc(N2C[C@H]3CC[C@H]2[C@H](N)C3)cc1F 2044340882 QDZQXXCBMVOHNW-BIMULSAOSA-N 250.317 2.150 10 10 CECE CC[C@H](O)CN(c1ccc(CN)cc1F)C1CC1 2045281868 PBFPTYKPCMIFCF-LBPRGKRZSA-N 252.333 2.024 10 10 CECE CC[C@H](O)CN(c1ccc(CN)c(F)c1)C1CC1 2045281430 IYSFGBSSNALOFQ-ZDUSSCGKSA-N 252.333 2.024 10 10 CECE CO[C@H]1CN(c2ccc3c(c2)CC[C@H]3N)CC(F)(F)C1 2185153011 ZIRKHLXLEFGMBG-TZMCWYRMSA-N 282.334 2.493 10 10 CECE N[C@@H]1CCCc2cc(N3C[C@H]4C[C@@H](O)C[C@H]4C3)ccc21 2185193759 KSGRTKUXQZTLOA-IARIHHJXSA-N 272.392 2.230 10 10 CECE C[C@H](O)c1cc(F)c(N2C[C@@H]3C(N(C)C)[C@H]3C2)c(F)c1 2194518744 PMTYCGUBJOQFGF-LSJOCFKGSA-N 282.334 2.014 10 10 CECE COC[C@@](C)(CN(C)c1ccc([C@H](C)O)cc1F)OC 2198208397 SARSFQJVAAMXOA-XHDPSFHLSA-N 285.359 2.367 10 10 CECE COC1CC(CC(=O)N2CCC(N=[N+]=[N-])CC2)C1 2048668406 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CECE CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc([C@H](C)N)cc1Cl 2192285206 BWFKXDZQCMPSDE-XDTLVQLUSA-N 293.798 2.169 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)[C@@H]2CC23CC(F)(F)C3)C1 2069079298 JQLXCJIQTWWJRU-SFYZADRCSA-N 256.256 2.333 10 10 CECE CC[C@@H](COC(F)F)NC(=O)CCc1ccc(N)cc1 2187466644 UXOYOZANJZBVKM-LBPRGKRZSA-N 286.322 2.335 10 10 CECE C[C@H](c1ccccc1O)N(C)CC(F)(F)C(=O)O 2072461009 MEWUUYWIMKJUTA-MRVPVSSYSA-N 259.252 2.105 10 10 CECE CC(C)c1c[nH]nc1C(=O)N1CCC(N=[N+]=[N-])CC1 2100933772 YGZKQHYGDTWNHS-UHFFFAOYSA-N 262.317 2.448 10 10 CECE Nc1cccc(C(=O)O)c1N[C@@H]1CC[C@H]2[C@H]1C2(F)F 2102155089 BDFHQNOZIGPHPQ-FXBDTBDDSA-N 268.263 2.423 10 10 CECE CCN(CCCCO)c1c(F)cc(CNC)cc1F 2102860711 BRPQPWGZSZPGLD-UHFFFAOYSA-N 272.339 2.283 10 10 CECE O=[S@]1CC[C@]2(CCCN2Cc2c(O)cccc2F)C1 2104478651 VXYMTIZKQAOPJI-KUHUBIRLSA-N 283.368 2.018 10 10 CECE CC(C)Oc1ccc(N2CCCO[C@@H](CN)C2)cc1 2106365029 RDOOOVIBKWWSKK-HNNXBMFYSA-N 264.369 2.028 10 10 CECE CN1CCc2cc([C@@H](O)COCC(F)(F)F)ccc21 2106790692 KTLQCEAFPJNVGK-LBPRGKRZSA-N 275.270 2.291 10 10 CECE CCN1CCc2cc([C@@H](O)C[C@H](N)C(C)C)ccc21 2106793994 SCXMSZBCAOSGCA-HOCLYGCPSA-N 262.397 2.476 10 10 CECE CN1CCc2cc([C@H](O)CCOCC(F)F)ccc21 2106791044 ONEMVDWOVIPMKU-CYBMUJFWSA-N 271.307 2.384 10 10 CECE Cc1nc(C)c([C@@H](N)c2ccc3c(c2)CCN3C)o1 2106854071 YKKZGXQIQIONQT-AWEZNQCLSA-N 257.337 2.332 10 10 CECE O[C@@H](c1ccc(N2CCCC2)cc1)[C@H]1CCCCN1 2106826620 VFAWSHWULMCOEO-CVEARBPZSA-N 260.381 2.462 10 10 CECE CC[C@H](CCOC)[C@H](NN)c1ccc(N(C)C)cc1 2106830610 IHEBTFHHOQVHHA-DOMZBBRYSA-N 265.401 2.320 10 10 CECE C[C@H]1C[C@@H](C)NCCN1[C@H](C)c1ccc(O)cc1O 2108183583 XMVOJMLOYHZAOK-GRYCIOLGSA-N 264.369 2.231 10 10 CECE C[C@H](O)c1ccc(N2CCOC[C@H]2C2CC2)c(F)c1 2088415074 QURVNNGIOJSPGD-BONVTDFDSA-N 265.328 2.494 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](O)C3(CCC3)C2)c(F)c1 2108768752 MDXMBMZYWPZODF-HZMBPMFUSA-N 265.328 2.230 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@]3(CCCO3)C2)cc1O 2088785795 AYGRXVRNMGYZDQ-IAQYHMDHSA-N 263.337 2.205 10 10 CECE CN(CCOc1ccc(N)cc1)[C@H]1CCCOCC1 2089234547 PZCWKBHFVVAJCS-AWEZNQCLSA-N 264.369 2.149 10 10 CECE CCN(C[C@@H]1COCC(C)(C)O1)c1ccc(N)cc1 2089463786 BMJXNXKATHRPCE-CQSZACIVSA-N 264.369 2.289 10 10 CECE Nc1ccc(CCCNC[C@H]2CC3(CC3)CO2)cc1 2110095019 AWMVHDKFIOEGAM-OAHLLOKOSA-N 260.381 2.360 10 10 CECE CCCN[C@H](c1ccccc1O)[C@@H]1CCCS1(=O)=O 2090035331 QHXKXLOLORBTNA-UONOGXRCSA-N 283.393 2.010 10 10 CECE CC[C@H](NS(=O)(=O)Cc1ccc(N)cc1)[C@@H]1C[C@@H]1C 2090356537 QPJQCAYKZLBMJJ-GDLCADMTSA-N 282.409 2.123 10 10 CECE C[C@@H]1CC[C@H](CO)N(c2ccc([C@@H](C)O)c(O)c2)C1 2110593344 AQJDSGWEYTYCLP-NQBHXWOUSA-N 265.353 2.043 10 10 CECE NCc1ccc(N2CCCC[C@@]23CCOC3)cc1F 2093596174 CQYVMNZGGAIRSC-HNNXBMFYSA-N 264.344 2.434 10 10 CECE Nc1ccc(C[C@H](O)c2cnc3n2CCCC3)cc1 2094778175 IFKTWLKDMMZAHY-AWEZNQCLSA-N 257.337 2.078 10 10 CECE C[C@@H]1CC[C@@H](CNCc2cc(F)cc(F)c2O)N1C 2095273106 BEDJXOROCBRXKR-SKDRFNHKSA-N 270.323 2.243 10 10 CECE CC[C@@]1(C)CN(c2ccc([C@@H](C)O)c(O)c2)CCO1 2096395531 JDSFVLCZCQSOFM-ABAIWWIYSA-N 265.353 2.451 10 10 CECE C[C@H]1[C@H](C)[C@H](N)CCN1c1ccc2c(c1)COCC2 2096487500 HBQVEISWPRJWFS-MQIPJXDCSA-N 260.381 2.321 10 10 CECE Cc1cc(CO)ccc1N1C2CCC1([C@H](C)O)CC2 2097059005 FZDCPYRGRUKGQJ-YGONEPDPSA-N 261.365 2.370 10 10 CECE CNCc1ccc(N2CC3(CC3)C[C@H]2CO)c(C)c1 2099118764 RLZYUWRMYXHJMW-AWEZNQCLSA-N 260.381 2.066 10 10 CECE COc1ccc(N2CCCO[C@@H]3CCC[C@@H]32)c(N)c1 2113804275 MABVMEJPNNQRLE-LSDHHAIUSA-N 262.353 2.425 10 10 CECE Cc1cc(N2C[C@H]3C[C@H]2[C@H]3CO)ccc1CNC1CC1 2203130260 FVGJNFZDEDTASH-COXVUDFISA-N 272.392 2.064 10 10 CECE COc1cc(N2CCCC[C@H]2C2(O)CC2)ccc1CN 2204550880 YUDBQZBSEXKFIP-HNNXBMFYSA-N 276.380 2.038 10 10 CECE CCc1cccc(CN[C@@H]2CCC[C@H]2S(C)(=O)=O)c1O 2205997726 PALDHWKFBOMDPA-ZIAGYGMSSA-N 297.420 2.010 10 10 CECE CN1CCCc2cc(C3(O)[C@@H]4[C@@H]5C[C@@H]6[C@H]([C@@H]54)[C@@H]63)ccc21 2208404800 HDFRXDHOKFHDSU-LJFFPRQNSA-N 267.372 2.398 10 10 CECE COc1ccc(N2CC[C@@H](C)[C@H](F)C2)c(CO)c1 2220425818 BVVZTCIAFGYCNF-ZWNOBZJWSA-N 253.317 2.372 10 10 CECE NCc1ccc(N2CC[C@H](OC(F)(F)CF)C2)cc1 2230599196 DKUKRZCLMWJUPH-LBPRGKRZSA-N 274.286 2.303 10 10 CECE Cc1cc(CNC2CCC2)ccc1N(C)CCCO 2231479028 VUJCBNFFXVJARN-UHFFFAOYSA-N 262.397 2.456 10 10 CECE CC[C@H](C)NCc1ccc(N2CC[C@H](O)C2)c(F)c1 2231467248 JONSWOXIXOUWML-AAEUAGOBSA-N 266.360 2.285 10 10 CECE CN[C@@H](C)c1ccc(N2CCN(C)[C@@H](C)C2)c(C)c1 2232027554 JLPGYOILFDERJW-KBPBESRZSA-N 261.413 2.416 10 10 CECE CN[C@H](C)c1ccc(N2CC=C[C@]2(C)CO)c(C)c1 2232094076 ODYPSMFWXSAENV-CZUORRHYSA-N 260.381 2.403 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1cccn2nccc12 2234177808 VZAYHALCWNWTRA-MNOVXSKESA-N 270.296 2.296 10 10 CECE CCO[C@@H]1C[C@@H]2CN(c3ccc(CN)c(OC)c3)C[C@H]21 2234338819 USXOVIUDEAQXRE-XNRPHZJLSA-N 276.380 2.015 10 10 CECE O[C@@H]1CCN(c2ccc3c(c2)OC(F)(F)O3)[C@@H]2CC[C@H]12 2235067286 OGMRZZNEXMPIDD-HBNTYKKESA-N 283.274 2.358 10 10 CECE C[C@H](c1ccccc1O)N(C)c1ncncc1[N+](=O)[O-] 2235287778 QOTVUKHULRMJGG-SECBINFHSA-N 274.280 2.288 10 10 CECE COc1ccc(N(C)[C@@H]2C[C@H](C)O[C@H]2C)c(CCN)c1 2235974643 MIFMYQKORZGKOH-MQIPJXDCSA-N 278.396 2.199 10 10 CECE OC[C@H]1CCN(c2ccc3c(c2)CCO3)CC1(F)F 2226755339 RUPRCAQPYPPQPW-LLVKDONJSA-N 269.291 2.075 10 10 CECE OCC[C@@H]1CCCN1c1ccc2c(c1)OC(F)(F)O2 2226701378 PSCJXIPTTOETOM-VIFPVBQESA-N 271.263 2.359 10 10 CECE C[C@H](O)[C@H]1CCCN(c2ccc3c(c2)COCC3)C1 2226708959 QVOYVICIEYVKKB-JSGCOSHPSA-N 261.365 2.357 10 10 CECE CC(C)N(CCCO)c1ccc2c(c1)OCCCO2 2226811502 OOKRPAMTLBIELC-UHFFFAOYSA-N 265.353 2.445 10 10 CECE COc1ccc(N2CC[C@@H]2C(F)(F)F)c(CCN)c1 2227683740 YPYIGTXNVVMZMM-GFCCVEGCSA-N 274.286 2.337 10 10 CECE CO[C@@H]1CC[C@@H]1[C@H](N)c1ccc2c(c1)CCCN2C 2227868477 MFJHQEDJJKCBNN-NUEKZKHPSA-N 260.381 2.494 10 10 CECE NCc1ccc2c(c1)CCCN2CC1(C(=O)O)CCC1 2238522167 UBQHZBMJKVZRRR-UHFFFAOYSA-N 274.364 2.153 10 10 CECE CCS(=O)(=O)[C@@H]1CCN(c2ccc([C@H](C)O)cc2C)C1 2240829828 KLPKLLUHATXVJK-GXTWGEPZSA-N 297.420 2.062 10 10 CECE Cc1cc(N(C)CC2COCCOC2)ccc1[C@H](C)O 2285165522 QWNBDJZGNQEGLW-ZDUSSCGKSA-N 279.380 2.148 10 10 CECE C[C@@H](N[C@@H]1CC[C@H]2C[C@H]1CO2)c1ccc(O)cc1O 2265668032 DKPZBPREACNWHY-IUCKATPISA-N 263.337 2.316 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC(F)(F)C[C@H]1CN 2278913897 OAYPFDHKAULSEG-SCZZXKLOSA-N 274.286 2.261 10 10 CECE Nc1ccc(OCCNc2cncn2C(F)F)cc1 2269401618 MAEUUQPLKOLASC-UHFFFAOYSA-N 268.267 2.351 10 10 CECE COC(=O)[C@](C)(NCCN=[N+]=[N-])c1sc(C)nc1C 2269534645 QBXNFNDHPJDBAN-LLVKDONJSA-N 283.357 2.048 10 10 CECE CCCCN(CC(N)=O)c1ccc([C@@H](C)O)c(C)c1 2269689576 PEXFZDCJCXWPSQ-GFCCVEGCSA-N 264.369 2.140 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]3[C@@H](O)C[C@@H]3C2)cc1C 2285127548 KODRLSRMWHMIQT-OMNBBPDLSA-N 274.408 2.483 10 10 CECE Cc1cc(N(C)C[C@@]2(C)COCCO2)ccc1[C@@H](C)O 2285157222 HCUQYJJGTHWAPM-CJNGLKHVSA-N 279.380 2.290 10 10 CECE COc1cccc(O)c1CN1C[C@H](CC(=O)O)C[C@@H]1C 2285673746 GXWJYXJVXLWHQW-QWRGUYRKSA-N 279.336 2.086 10 10 CECE CN1CCCc2cc(CNCCCC3(O)CC3)ccc21 2285707183 MJOUDEGZYRARCN-UHFFFAOYSA-N 274.408 2.464 10 10 CECE COC[C@@H]1C[C@@H](CN)N(c2ccc(OC(F)F)cc2)C1 2295933418 SAEGXPFKOCWHAH-PWSUYJOCSA-N 286.322 2.088 10 10 CECE c1cc(N2CCNCC2)ccc1CN1CCC[C@H]2C[C@H]21 2286067628 CXLSNPMYPOLKLC-DOTOQJQBSA-N 271.408 2.081 10 10 CECE OCc1ccc(N2CCOC[C@H](F)C2)cc1Cl 2299881674 WOSZDIUPZJAIKV-SNVBAGLBSA-N 259.708 2.007 10 10 CECE COc1ccc(N2CCOC[C@@H](O)C2)cc1C(C)C 1145075994 HYYZLIOJXDIGIL-ZDUSSCGKSA-N 265.353 2.016 10 10 CECE Cc1cc(NS(=O)(=O)c2cc(N)ccc2C)ccc1O 1209976303 JOIFFCKJDKDCLM-UHFFFAOYSA-N 292.360 2.392 10 10 CECE Oc1cc2c(cc1O)CN(Cc1ccns1)CC2 2318674631 FGVNXIOMZCRCAH-UHFFFAOYSA-N 262.334 2.113 10 10 CECE CN1CCc2cc([C@H](N)[C@H]3[C@@H]4CCCO[C@@H]43)ccc21 2330693541 FYIAEALIPSYUBA-UKMLZYKCSA-N 258.365 2.104 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)cc1 2330781017 YTSCWLJKQDHTPK-NOXHYTERSA-N 260.381 2.317 10 10 CECE C[C@H](NC[C@H]1[C@@H]2CCCO[C@@H]21)c1c(O)cccc1O 2330703988 HDRIOFJWIOXLRT-VEABSNGSSA-N 263.337 2.173 10 10 CECE CCN(CC)c1ccc([C@H](O)C2(SC)CNC2)cc1 2337057897 BDGOBRIMCXIMPS-AWEZNQCLSA-N 280.437 2.271 10 10 CECE CSCCCC(=O)N1CCc2cc(O)c(O)cc2C1 2341202829 WCIMYHMTZJFRJA-UHFFFAOYSA-N 281.377 2.126 10 10 CECE CSc1cc(N2CCN(C)C[C@@H](C)C2)ccc1CN 2353850803 GWNLRKODDSJBNA-GFCCVEGCSA-N 279.453 2.255 10 10 CECE CN(C)c1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@]3(C)O)cc1 2355719396 IUCARQWQBIGLAQ-NXNVCVFFSA-N 274.408 2.392 10 10 CECE CN(CCc1ccccc1)c1ccc2c(c1)NC(=O)[C@@H]2N 115914149 COQJBJDWXVSORT-MRXNPFEDSA-N 281.359 2.317 10 10 CECE COc1ccc(N2CCN(Cc3cc(C)on3)CC2)cc1 60993042 AZHNFTWATCHHMZ-UHFFFAOYSA-N 287.363 2.314 10 10 CECE CCCN(Cc1c(O)cccc1Cl)C1CNC1 128342921 SIQONZGQRBLNSL-UHFFFAOYSA-N 254.761 2.229 10 10 CECE C[C@H]1SCCN(CCC(=O)Nc2ccc(N)cc2)[C@@H]1C 132206680 OVTGRTLKUFGAAK-VXGBXAGGSA-N 293.436 2.423 10 10 CECE COc1cc(C(=O)N(C)Cc2ccccc2O)sn1 1149872165 RESZTFONAHHYNT-UHFFFAOYSA-N 278.333 2.130 10 10 CECE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(O)c1 186418319 NTNJDVHTYXMPGT-JTQLQIEISA-N 287.315 2.164 10 10 CECE COc1cccc(OC)c1C(=O)NCc1ccc(N)cc1 32133216 AAJTWYRTITVXPN-UHFFFAOYSA-N 286.331 2.216 10 10 CECE C[C@@H]1[C@H](N)CC[C@@H](C(=O)NCc2ccccc2O)C1(C)C 219864427 XNWQNFBYRAJIHK-KWCYVHTRSA-N 290.407 2.408 10 10 CECE CCN(CC)C(=O)[C@H](C)OC(=O)CCc1ccc(N)cc1 41101816 CHISVSKVFKAZDS-LBPRGKRZSA-N 292.379 2.002 10 10 CECE COc1ccc(N2CC[C@@H](CCC(=O)O)C2)c([N+](=O)[O-])c1 134446856 XTSDAKYKLRIDJN-SNVBAGLBSA-N 294.307 2.295 10 10 CECE Cc1ncsc1C(=O)Nc1ccc(O)cc1C(=O)O 48847005 HAEGLOVCXFZTGM-UHFFFAOYSA-N 278.289 2.108 10 10 CECE CC(=O)N[C@H]1CCN([C@H](C)c2cc(Cl)ccc2O)C1 228357071 DEJILRBSVGFVOC-SKDRFNHKSA-N 282.771 2.317 10 10 CECE C[C@H]1CCC[C@](O)(CNCc2cc3c(cc2O)OCO3)C1 96480093 FFZVJRNCOSQXKY-MEDUHNTESA-N 293.363 2.152 10 10 CECE OC[C@H](Cc1ccc(O)cc1)NCc1ccc2c(c1)CCO2 190500074 MDDZCKORQBBLPI-INIZCTEOSA-N 299.370 2.020 10 10 CECE CN1CCc2cc(CNC[C@H]3CCCOC3)ccc21 50286744 GTZWGPVDMKKUMD-CQSZACIVSA-N 260.381 2.195 10 10 CECE O=C(O)/C=C/c1ccc(N2C[C@@H]3CC[C@H](C2)O3)cc1 90906804 FTPCERZMBBKYJE-KYVOKBGTSA-N 259.305 2.152 10 10 CECE Cc1cc(C)c([C@H](NCCN=[N+]=[N-])C(N)=O)cc1C 235802986 HUSWWIKSVVQVRN-LBPRGKRZSA-N 261.329 2.038 10 10 CECE Oc1ccc(-c2nc(CC(F)(F)F)no2)cc1O 236603255 FCRUYPXCTXHLDL-UHFFFAOYSA-N 260.171 2.253 10 10 CECE CONCc1c(C)c(Br)cc(F)c1O 258531519 URZWIMZSBKYJTH-UHFFFAOYSA-N 264.094 2.253 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CCOC2)c(F)c1 251779729 SIOPKPSHQLRXQU-PWSUYJOCSA-N 252.333 2.331 10 10 CECE CC1CC(CN(C)c2ccc3c(c2)NC(=O)[C@@H]3N)C1 700877952 CQSSRFYKSARVAV-RPFQZYLTSA-N 259.353 2.121 10 10 CECE Nc1ccc(CC(=O)OC[C@H]2COCCC2(F)F)cc1 2170261237 IOPREXWLVXQYOW-LLVKDONJSA-N 285.290 2.026 10 10 CECE Cc1cc(N2CC3(CC(N(C)C)C3)C2)ccc1CCN 2164400807 IXCCBTMSLPKSTN-UHFFFAOYSA-N 273.424 2.027 10 10 CECE CC(C)NC[C@H]1CN(c2ccc3c(c2)OCO3)C[C@H]1C 2169420204 FOXSXOZJCZFIDR-OLZOCXBDSA-N 276.380 2.486 10 10 CECE CC(=O)C(=O)COC(=O)COc1cc(C(C)C)ccc1C 808486437 BKCXEWUTICZHME-UHFFFAOYSA-N 292.331 2.199 10 10 CECE COc1ccc(N2CCC[C@@H]2[C@@H]2CCCN2C)c(N)c1 2171436334 GGPZUXYVQJBAGL-JKSUJKDBSA-N 275.396 2.340 10 10 CECE CN1[C@H]2CC[C@@H]1CN([C@H]1CCc3cccc(O)c31)C2 723703314 BHQBCKSBIUGUSF-MJBXVCDLSA-N 258.365 2.158 10 10 CECE N[C@@H]1CCC[C@@H]1NCc1ccc(N2CCCC2)cc1 817897881 CXUXBGIUCJHDMD-CVEARBPZSA-N 259.397 2.256 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2C[C@H]3COC[C@@H]3O2)c1 724586642 PQRUIKKWDGNGMO-QCQGSNGOSA-N 277.364 2.155 10 10 CECE C[C@H](c1noc(-c2ccc(O)c(O)c2)n1)[C@@H]1CCCO1 720270978 BOIPYRNEGYRXDQ-UFBFGSQYSA-N 276.292 2.430 10 10 CECE CO[C@H](C(=O)NCc1ccc(N(C)C)cc1C)C1CCC1 827955977 LXRKBAPOWHCXHX-INIZCTEOSA-N 290.407 2.492 10 10 CECE Cc1ccc(C(=O)OCCC[C@@H]2CCOC2)c(O)c1O 828807949 VLASPKFXKKNCBY-LLVKDONJSA-N 280.320 2.380 10 10 CECE CCc1nc[nH]c1C(=O)NCc1ccc2c(c1)CCCN2C 906455983 WDSMUWZDBRIXFN-UHFFFAOYSA-N 298.390 2.285 10 10 CECE COC(=O)C1(CNC/C=C\c2ccc(N(C)C)cc2)CC1 835045915 LOWFARQQKHWQBW-PLNGDYQASA-N 288.391 2.309 10 10 CECE Nc1ccc(Cc2noc(-c3cnn4c3CCCC4)n2)cc1 843159527 SCHFLQPIFNDZCU-UHFFFAOYSA-N 295.346 2.442 10 10 CECE CNC(=O)C(C)(C)CNCc1c(O)cc(C)cc1Cl 840908118 UGKMXUALJLNAKC-UHFFFAOYSA-N 284.787 2.216 10 10 CECE [N-]=[N+]=NCCOCCNC(=O)OCc1ccccc1 687828065 CFLKZSWSHFUVQQ-UHFFFAOYSA-N 264.285 2.240 10 10 CECE CO[C@@H]1C[C@H]1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 929934209 NHABLJCZXJOTGF-HZPDHXFCSA-N 288.391 2.279 10 10 CECE c1cc2c(cc1N1CC[C@@H]1CNC1CC1)CCCO2 696284760 QSUUTLBDRVXYAY-OAHLLOKOSA-N 258.365 2.342 10 10 CECE COC(=O)c1cc(OCCC(C)(C)O)ccc1N(C)C 865395051 HFAOJTKRVANURZ-UHFFFAOYSA-N 281.352 2.079 10 10 CECE COc1ccc(O)c([C@@H](C)NC(=O)c2n[nH]c(C)c2C)c1 761973580 RSDAMFITVPVWSY-SNVBAGLBSA-N 289.335 2.232 10 10 CECE COc1nn(C)cc1NCc1ccc(F)c(F)c1O 877469802 ZQDVZDXTFKKGAA-UHFFFAOYSA-N 269.251 2.025 10 10 CECE Cc1cc(Cl)cc(CN(C)CC(=O)N2CCCC2)c1O 775644489 JHGPMSCMERFJTN-UHFFFAOYSA-N 296.798 2.408 10 10 CECE CN(Cc1ccc[nH]1)C(=O)/C=C/c1ccc(O)c(O)c1 779532312 RZPNSXQAHHTZOE-FNORWQNLSA-N 272.304 2.098 10 10 CECE C[C@@H](NC(=O)/C=C\c1ccncn1)c1ccc(N(C)C)cc1 775408703 BFQBASQMEWWVFI-OYVUYXNMSA-N 296.374 2.433 10 10 CECE C[C@@H](N[C@H](C)c1ccc(O)cc1O)c1ccn(C)n1 1876949070 ZDIHWUBNZDQBAR-NXEZZACHSA-N 261.325 2.243 10 10 CECE CC[C@@H](OC1CCCC1)C(=O)NCc1cccc(O)c1O 1123889299 OGSNEMGFPWHFFK-CQSZACIVSA-N 293.363 2.452 10 10 CECE Cc1sccc1CC(=O)NCCc1ccc(O)c(O)c1 787131488 NLXPQOPKYJHVBL-UHFFFAOYSA-N 291.372 2.369 10 10 CECE COCCN(Cc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 787335038 PIUHDXDZYLSMNP-CQSZACIVSA-N 296.386 2.129 10 10 CECE CN(C[C@]12C[C@H](CO1)C2)c1ccc2c(c1)CC[C@@H]2N 1879888803 NZRXETVMCHFAPH-KNXALSJPSA-N 258.365 2.248 10 10 CECE CC[C@@H](C[C@H](C)O)NCc1cc(C)cc(OC)c1O 895463763 CSEBLSVMWYKGSP-AAEUAGOBSA-N 267.369 2.348 10 10 CECE C[C@@H](C1CC1)N(C(=O)Cc1ccc(O)c(O)c1)C1CC1 1136488634 RVXSNASNUUOUKV-JTQLQIEISA-N 275.348 2.430 10 10 CECE Cc1cc(N(C)C[C@]23CCOC[C@H]2C3)ccc1CN 1880556512 NOJDEUQGSDEEQL-GDBMZVCRSA-N 260.381 2.317 10 10 CECE C[C@@H](N)c1cc(F)c(N2CC3(C=CCO3)C2)c(F)c1 1880927048 KPJGFSBXHMABAD-SECBINFHSA-N 266.291 2.130 10 10 CECE C[C@H](N)c1cc(F)c(N2CCC[C@](C)(O)C2)c(F)c1 1880929254 VZNAABHDKQFEMD-XPTSAGLGSA-N 270.323 2.336 10 10 CECE C[C@H](N)c1cc(F)c(N(CCO)C2CCC2)c(F)c1 1880929018 RMBFTYRTHVLDOL-VIFPVBQESA-N 270.323 2.336 10 10 CECE C[C@@H]1C[C@@]1(NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1885562982 NMFJYTSRJGPFMV-RNCFNFMXSA-N 297.359 2.106 10 10 CECE C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 1885562234 CLWMJHILPUREKL-NXEZZACHSA-N 297.359 2.201 10 10 CECE CCN(Cc1ccc(O)c(O)c1)[C@@H]1CCCC[C@H]1CN 249714035 QTDZIDCBWAJLQR-UONOGXRCSA-N 278.396 2.437 10 10 CECE Oc1ccc([C@H]2NCCc3c(F)cccc32)cc1O 83596525 GYHHEFKUSBELHU-OAHLLOKOSA-N 259.280 2.472 10 10 CECE C[C@H](Nc1ccc(C(N)=O)cc1)c1ccc(O)cc1O 19911457 FZXBLWNFFCVIOA-VIFPVBQESA-N 272.304 2.370 10 10 CECE COc1ccc(N2CCNC[C@@H]2c2ccncc2)cc1 57557261 XRZDUENTTRSNOE-MRXNPFEDSA-N 269.348 2.241 10 10 CECE Oc1ccc([C@H]2NCCc3cc(F)c(O)cc32)c(O)c1 83623174 LGYDGTPDORKKES-OAHLLOKOSA-N 275.279 2.178 10 10 CECE Nc1ccc(-n2ccnc2C(=O)NC2CCCC2)cc1 75911212 XKSZIWLOCPCXPW-UHFFFAOYSA-N 270.336 2.127 10 10 CECE 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2.156 10 10 CECE Cc1cc(N(C)C2C[C@H]3C=C[C@@H](C2)O3)ccc1CO 2118460744 GKXAOMKFYGEVJT-MQVJKMGUSA-N 259.349 2.410 10 10 CECE O=C(O)[C@H](NCc1ccncc1)c1cc(Cl)ccc1O 211830481 RKXYGUYPGFTFCL-CYBMUJFWSA-N 292.722 2.356 10 10 CECE CC(C)[C@@H](NC(=O)OC(C)(C)C)[C@H](CO)N=[N+]=[N-] 1535937701 YAQXUYKDFASGJW-DTWKUNHWSA-N 258.322 2.207 10 10 CECE c1cc(N2CCCC2)ccc1CN[C@@H]1[C@@H]2CCO[C@H]21 2119894809 LZOQLTPTNSOWNK-ARFHVFGLSA-N 258.365 2.164 10 10 CECE CC1(C)CO[C@H](CN2CCC[C@H](CN=[N+]=[N-])C2)CO1 2120212870 HIGNKVUQAOLLSF-VXGBXAGGSA-N 268.361 2.203 10 10 CECE CN(Cc1cnn(C(F)F)c1)c1ccc(CO)cc1 2120839345 MVEKUVVWFHMULM-UHFFFAOYSA-N 267.279 2.407 10 10 CECE CN(Cc1cc(N)ccc1O)[C@@H]1COC2(CCC2)C1 2122470334 BIFXZPRFUQKWSM-ZDUSSCGKSA-N 262.353 2.118 10 10 CECE CO[C@H](C)c1noc(CN2CCC[C@H]2CN=[N+]=[N-])n1 2123010134 VHESRXVUYPKWEJ-BDAKNGLRSA-N 266.305 2.052 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C[C@@H]1COC2(CCCC2)O1 2123019909 SOLRZBPYHVHAAD-VXGBXAGGSA-N 266.345 2.447 10 10 CECE O=C(c1cc(O)cs1)N1CCCc2ccnc(O)c21 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2.302 10 10 CECE O=C1Nc2cc(N3CC(C4CCC4)C3)c(F)cc2[C@@H]1O 2172067071 HTDVBDNBERLBLX-AWEZNQCLSA-N 276.311 2.048 10 10 CECE COC(=O)[C@@](NCCCN=[N+]=[N-])(C(C)C)C1CC1 705314496 QKTRJXSRHDNNSS-GFCCVEGCSA-N 254.334 2.254 10 10 CECE Oc1c(F)cccc1CN[C@@H]1C[C@H]2OCCC[C@H]12 363972857 IIBGMXNEWKISGD-RAIGVLPGSA-N 251.301 2.188 10 10 CECE C[C@H](N[C@@H]1CCc2nccn2C1)c1ccccc1O 367819848 GKQVHQLGYLQGQP-NWDGAFQWSA-N 257.337 2.254 10 10 CECE CN(C)c1ccc([C@]2(N)CCC[C@@]34C[C@@H](CO3)[C@H]42)cc1 2163062665 MITAAUDFSDKDBV-NKKGCODLSA-N 272.392 2.496 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H](NC)C(F)F)ccc21 2163065109 XNLJHNIYBNUFLP-TZMCWYRMSA-N 284.350 2.346 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H]1CN2CCC1CC2 2163071145 LYRVIUZCAUGYJU-IAGOWNOFSA-N 273.424 2.355 10 10 CECE NC(=O)c1ccc(NCc2cc(F)cc(F)c2O)cc1 708453473 GYYIPUQKUUGOKR-UHFFFAOYSA-N 278.258 2.381 10 10 CECE CNCc1ccc(N(C)[C@H]2CCC[C@H]2O)cc1Cl 709297111 MTFSZZQBCXNYOT-UONOGXRCSA-N 268.788 2.409 10 10 CECE C[C@@H]1COC[C@@H]1N(C)c1ccc(CNC2CC2)cc1 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10 CECE CC[C@@H]1CCOCCN1Cc1ccc(OC)cc1O 1913696891 KYXLGSCVPRSBTD-CYBMUJFWSA-N 265.353 2.402 10 10 CECE CC1(O)CC2(CN(CCCc3ccc(N)cc3)C2)C1 2126885837 WDBHDCLRHMDVFO-UHFFFAOYSA-N 260.381 2.048 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H]1CCCNC1=O 250976794 INGWFJMLYFRJCK-GRYCIOLGSA-N 274.364 2.117 10 10 CECE C[C@@H]1CC[C@@H](CO)CN1c1ccc2c(c1)CC[C@@H]2O 2128315836 XAFYVNIQPPBUOU-HSMVNMDESA-N 261.365 2.263 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2CC(=O)N1CCCCC1 162107524 QLPDOVOLNVNQGH-ZDUSSCGKSA-N 287.407 2.081 10 10 CECE CC(=O)N[C@@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 164138025 UWGAGLLJCDCJOX-OAHLLOKOSA-N 276.380 2.110 10 10 CECE CS[C@H](C)CCNC(=O)Cc1ccc(N)cc1 156932864 JRXNWODQCRGJEW-SNVBAGLBSA-N 252.383 2.069 10 10 CECE COc1ccc(O)c([C@@H](C)NCCc2ccno2)c1 2129905055 BPZPDRGGLWMHAE-SNVBAGLBSA-N 262.309 2.282 10 10 CECE CO[C@@H]1C[C@H]1CNCc1ccc(N2CCCC2)cc1 2131657612 NQKVDNIZSFVQSE-GOEBONIOSA-N 260.381 2.411 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1C[C@H]2CC[C@H]1CN2C 2130116368 XMQFXIHWVZYKCT-UHTWSYAYSA-N 264.344 2.371 10 10 CECE COCC(COC)C[C@H](O)c1ccc(N(C)C)cc1 2130900664 OIBXCCOTGMEHPR-HNNXBMFYSA-N 267.369 2.085 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H]3CCC[C@H](C2)N3C)cc1 2131080010 ZNXBICQAIWKITM-VBNZEHGJSA-N 260.381 2.413 10 10 CECE Cc1cccc(-c2nnnn2-c2ccc(N)cc2)c1 1857876790 QZAMWPROXQIMQB-UHFFFAOYSA-N 251.293 2.220 10 10 CECE Cc1cc(N2CC[C@@H](O)[C@H]2C)ccc1CNC(C)C 1914256852 QQIOLTJLRDKJJV-CZUORRHYSA-N 262.397 2.453 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@@H]2C)c(F)c1 1914305987 QJPQSFZWQJKMRI-BFVZDQMLSA-N 252.333 2.066 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(COC)C2)cc1O 1916897297 UOVBUFUNOFEWLP-NSHDSACASA-N 264.369 2.145 10 10 CECE CCN(CCCC(=O)N1CCCC1)CCN=[N+]=[N-] 2315986306 BVUWLLYCPATOBG-UHFFFAOYSA-N 253.350 2.021 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@H]1C[C@H]1C1CCOCC1 2135422916 FVRCJKGOZRBWFG-NWDGAFQWSA-N 266.345 2.208 10 10 CECE CC[C@@H](c1ccccc1O)N(C)C(C)(C)C(N)=O 1915534337 GLWKZERCWGQESI-NSHDSACASA-N 250.342 2.039 10 10 CECE CC[C@]1(C(=O)O)CCCN1[C@H](C)c1cc(O)ccc1O 251303909 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1974201009 GZXQTKFZQFPOPK-SMDDNHRTSA-N 251.301 2.048 10 10 CECE CO[C@H]1C[C@@H](CCNCc2ccc(F)cc2O)C1 1974339212 QWRLCTASVUMCSX-GSJFWJNXSA-N 253.317 2.436 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CCc2cc(F)ccc21 2148158858 BXTMBBHLWNTXLO-HZPDHXFCSA-N 273.307 2.365 10 10 CECE CNCc1cc(F)c(N2CC[C@H]3COCC[C@@H]32)c(F)c1 2145011400 UBLPZFZNZGARMI-FZMZJTMJSA-N 282.334 2.299 10 10 CECE CCOC(=O)[C@@H](N)c1c(O)ccc(Br)c1C 260338746 LFSDZMMSSLAQKI-JTQLQIEISA-N 288.141 2.026 10 10 CECE CCCN(Cc1ccc(N)cc1)[C@@H](C)C(=O)NC1CC1 35364850 QQKXWNDBTXTATM-LBPRGKRZSA-N 275.396 2.148 10 10 CECE CN(Cc1ccc(Cl)cc1O)c1ccnn1C 2005140769 LTRYYSCLDQPWES-UHFFFAOYSA-N 251.717 2.416 10 10 CECE COCCNCc1ccc(N2CC3(CSC3)C2)c(F)c1 2146382361 ZSKKAZOSWMGPLA-UHFFFAOYSA-N 296.411 2.115 10 10 CECE CN(C)C[C@H]1CCN1c1ccc(CN)cc1Br 1998013354 YVOVFBISMJHNSK-LLVKDONJSA-N 298.228 2.048 10 10 CECE Oc1c(F)cccc1CNCCCOC[C@@H]1CCCO1 164939163 CNHRDCUNTOETFQ-ZDUSSCGKSA-N 283.343 2.207 10 10 CECE COc1cccc(O)c1CN(C)[C@H]1C[C@@H]2CC[C@H](C1)N2 2160734140 RJENIDAHUGYZLX-CLLJXQQHSA-N 276.380 2.116 10 10 CECE Nc1ccc(OCCOc2cccc(CO)c2)cc1 43474865 GGDSTQARCJHCQJ-UHFFFAOYSA-N 259.305 2.219 10 10 CECE Cc1cnn(C)c1CN1CCc2cc([C@H](C)N)ccc21 2154340061 REJLBYNUIUTDHE-LBPRGKRZSA-N 270.380 2.311 10 10 CECE Nc1cccc(Cl)c1N[C@@H]1CC[C@H]2C[C@]21CO 2014962362 KOGBVAWVADFJQI-KDDOJWQBSA-N 252.745 2.495 10 10 CECE CNCc1ccc(N(C)C2(C)COC2)cc1Cl 2026720150 HYBJOGOUKRGDTF-UHFFFAOYSA-N 254.761 2.285 10 10 CECE C[C@H](N[C@@H]1CC[C@H](CO)C1)c1ccc(F)cc1O 2029538967 YGXGQQFJQOJEOM-JBLDHEPKSA-N 253.317 2.343 10 10 CECE C[C@@H]1C[C@H](CN)CCN1Cc1cc(F)ccc1O 2031136370 RONSMILZAJVJNZ-GHMZBOCLSA-N 252.333 2.091 10 10 CECE CN[C@H](C)c1ccc(N(C)CC(F)(F)CO)cc1 2033568552 JUJMIQRFKSHUSR-SNVBAGLBSA-N 258.312 2.031 10 10 CECE CCCNC(=O)[C@@H](C)N[C@H](C)c1ccc(F)cc1O 62746520 PGAUYQIAYKYCTL-NXEZZACHSA-N 268.332 2.097 10 10 CECE Nc1ccc(CCC(=O)N[C@@H]2C[C@H]3C[C@H]2C[C@@H]3F)cc1 2157650216 NEIFIOHCVKQEJX-PAPYEOQZSA-N 276.355 2.454 10 10 CECE CCOCCCC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2038001383 BAYAOFSWRKPXDG-NSHDSACASA-N 254.334 2.495 10 10 CECE CN[C@H](c1ccccc1O)[C@@](C)(O)c1cscn1 2038229426 LQTDDDHHRDULNP-OLZOCXBDSA-N 264.350 2.017 10 10 CECE CCNCc1ccc(N(C)CCCO)c(Cl)c1 310059464 JCGSCIQPBSDHOM-UHFFFAOYSA-N 256.777 2.268 10 10 CECE CC[C@@H](CN[C@@H](C)c1ccc(OC)cc1O)OC 310882515 WWITXTARLSVMKU-QWRGUYRKSA-N 253.342 2.476 10 10 CECE Cc1cc(N2CC[C@H]3CCN(C)[C@@H]3C2)ccc1CCN 2158543040 VGCBYINUQLLMCW-NVXWUHKLSA-N 273.424 2.027 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@H](C(F)(F)F)C2)cc1 312773341 CNCPMBRSDXVLMK-VIFPVBQESA-N 287.285 2.092 10 10 CECE CC(C)c1ncc(CNCc2ccc(O)c(O)c2O)o1 2160634118 KWDKZUXYOVAILJ-UHFFFAOYSA-N 278.308 2.205 10 10 CECE Nc1ccc(CCNc2ncnc3scnc23)cc1 320755563 PBOAAKHDHVALJZ-UHFFFAOYSA-N 271.349 2.323 10 10 CECE CCOC(=O)[C@](CC)(NCCN=[N+]=[N-])[C@@H]1C[C@@H]1C 321736494 JWVRMXMMJWRRER-HOSYDEDBSA-N 254.334 2.254 10 10 CECE COc1cccc(O)c1CNc1ccc2nncn2c1 2160733132 COLUVDAMTUAALL-UHFFFAOYSA-N 270.292 2.056 10 10 CECE CNCc1ccc(N2CCC[C@H]2CCN(C)C)c(F)c1 701435293 VTZSFFIZHNQWLE-AWEZNQCLSA-N 279.403 2.466 10 10 CECE Nc1ccc(O)c(CN2CCO[C@@H](c3nccs3)C2)c1 2171859926 PHBGZSRQHPHUKE-CYBMUJFWSA-N 291.376 2.004 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)CCC(C)(F)F)ccc21 2171902045 XFJHXOXAPWAXDJ-LBPRGKRZSA-N 283.322 2.381 10 10 CECE CCn1nc(C)cc1C(=O)N(C)c1ccc(N)cc1 90122554 JNEZQZBQPPBXLI-UHFFFAOYSA-N 258.325 2.070 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N1C[C@@H]2CNC[C@@H]2C1 90320135 IEGXMJZEFSFBOD-MQYQWHSLSA-N 272.392 2.400 10 10 CECE OCc1ccc(N2CCC[C@H]3COC[C@@H]32)cc1Cl 702086214 WZEDUJDJEVGBFJ-FZMZJTMJSA-N 267.756 2.448 10 10 CECE COc1ccc(N2CC[C@H](CSC)C2)c(N)c1 706668773 ZYTBSAHRKMPIGH-JTQLQIEISA-N 252.383 2.467 10 10 CECE C[C@H]1CN(CCCC(=O)Nc2ccc(N)cc2)[C@@H]1C 706765305 XBGUVRIOYLMXBI-NWDGAFQWSA-N 261.369 2.328 10 10 CECE COCCNCc1cc(F)c(N2CC[C@H]3C[C@@H]32)c(F)c1 706970486 IXGHRYVWXYQWIY-FZMZJTMJSA-N 282.334 2.299 10 10 CECE CCOC1CC(C[C@H](NN)c2ccc(N(C)C)cc2)C1 2163108581 UBPNNTCCCLHAQA-MOQPWLNLSA-N 277.412 2.462 10 10 CECE CCCOCC[C@H](NN)c1ccc2c(c1)CCN2CC 2163130766 KPQJGSSYRDZMSD-HNNXBMFYSA-N 277.412 2.390 10 10 CECE C[C@]1(C2CC2)CN(C(=O)Nc2ccc(N)cc2)CCO1 709924698 PBWXOYZDIFGCKB-OAHLLOKOSA-N 275.352 2.302 10 10 CECE CN[C@H](C)c1ccc(N2CC(N(C)C3CC3)C2)c(F)c1 2172999499 KNQBTQVCFZQNGE-LLVKDONJSA-N 277.387 2.389 10 10 CECE CN(C)CCONCc1cc(Cl)cc(Cl)c1O 379010260 LEXVCRIXEUFNPM-UHFFFAOYSA-N 279.167 2.282 10 10 CECE C[C@H](O)c1ccc(N(CCCO)C(C)(C)C)cc1O 690908608 QKRMEFAMWPJMHU-NSHDSACASA-N 267.369 2.433 10 10 CECE C[C@@H](O)C[C@H]1CCCCN1CCOc1ccc(N)cc1 380258253 RNJOYKIOPCLNNI-UKRRQHHQSA-N 278.396 2.273 10 10 CECE COc1ccc(N2CCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 380265870 UZKRAOFYRMNCIZ-GHMZBOCLSA-N 280.324 2.343 10 10 CECE CCN1CC[C@@H]1CN[C@@H](C)c1ccc(F)cc1O 712540479 BOZUYZOJLNXXSK-CMPLNLGQSA-N 252.333 2.276 10 10 CECE C[C@H]1CCN(C(=O)CCOc2ccc(N)cc2)[C@H]1C 380582836 JMXQVFFBEAPMSZ-RYUDHWBXSA-N 262.353 2.295 10 10 CECE C[C@@H]1CCN([C@H](CN)c2ccc3c(c2)CCN3C)[C@@H]1C 380765905 QZUQMMOIOYMBOV-PBFPGSCMSA-N 273.424 2.409 10 10 CECE Nc1ccc(CCC(=O)NCCCn2cccc2)cc1 383301132 NLPMVNCEKHHEJZ-UHFFFAOYSA-N 271.364 2.209 10 10 CECE CCNCc1cc(F)c(N2CC(O)(C3CC3)C2)c(F)c1 383948763 BBSDTPLYSPHOQB-UHFFFAOYSA-N 282.334 2.035 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H]2CN(C)C[C@@H](C)O2)c1 697318992 DGQCUROVAUMSKY-RDBSUJKOSA-N 278.396 2.070 10 10 CECE CCNCc1ccc(N2C[C@H](C)[C@H](O)C2)cc1Cl 388139156 FWRSBBHWNXLLKH-IINYFYTJSA-N 268.788 2.267 10 10 CECE COC[C@H](N[C@H](C)c1ccc(OC)cc1O)C1CC1 397361719 MANPRRADQPLROI-YGRLFVJLSA-N 265.353 2.476 10 10 CECE CCOc1cccc(CN[C@H](C)c2csnn2)c1O 398271022 HCNSTNBSULGFFF-SECBINFHSA-N 279.365 2.493 10 10 CECE CC[C@H](c1ccccc1O)N(C)CC[S@@](C)=O 399838360 DYUBVYIOJZZKLJ-SJKOYZFVSA-N 255.383 2.154 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2ncn(C)n2)cc1Cl 2178355543 YJFWIISJGGWPNG-SNVBAGLBSA-N 293.802 2.385 10 10 CECE [N-]=[N+]=NCC1CCN(C(=O)[C@H]2CC3(CCC3)CO2)CC1 2166464940 URSLCKZPGVPSSO-GFCCVEGCSA-N 278.356 2.495 10 10 CECE CC(C)c1cc(C(=O)Nc2ccc(O)c(O)c2)nn1C 2062989882 CUPUEVBXGKIZAE-UHFFFAOYSA-N 275.308 2.207 10 10 CECE CN(C)c1ccc(CN2C[C@@H](CN)CC23CCC3)cc1 2174633460 KDUGLVKKAFBSPM-OAHLLOKOSA-N 273.424 2.456 10 10 CECE CN(c1cc2c(cc1N)OCCO2)C1(C)CCOCC1 2175018587 IEABPBFZUJNEOA-UHFFFAOYSA-N 278.352 2.045 10 10 CECE C[C@H]1[C@@H](C)[C@@H]1Cn1cc(COc2ccc(N)cc2)nn1 2179348670 WSDDPZQWDLVSRN-HBYGRHMLSA-N 272.352 2.341 10 10 CECE C[C@H](c1ccccn1)N(C)C(=O)c1ccc(O)c(O)c1 2169992738 DOHJKVXCEYVJOX-SNVBAGLBSA-N 272.304 2.326 10 10 CECE CCN(Cc1ccnn1C)c1ccc([C@H](C)O)c(O)c1 2170064803 SBRACJZDZSECJO-NSHDSACASA-N 275.352 2.206 10 10 CECE CN[C@@H](C)c1ccc(N2CCn3ncnc3C2)cc1Cl 2170405147 AQSCQVDVOGYHMQ-JTQLQIEISA-N 291.786 2.232 10 10 CECE CCCS(=O)(=O)C[C@H](C)N[C@@H]1CCc2cccc(O)c21 2170592241 UWUBNYLSCNWHCC-WCQYABFASA-N 297.420 2.182 10 10 CECE CC[C@H]1CN(c2ccc(CN)c(F)c2F)C[C@H]1N(C)C 2170526668 DUOZXXTXPBHMQP-GXFFZTMASA-N 283.366 2.200 10 10 CECE CCc1c(C)nn(Cc2cccc(OC)c2O)c1N 2080127518 FXMAFQOIWRLAHP-UHFFFAOYSA-N 261.325 2.099 10 10 CECE CCCNCc1ccc(N2CC3(CC[C@H]3O)C2)c(F)c1 2179702956 HMKSSWIJFBSJBT-OAHLLOKOSA-N 278.371 2.286 10 10 CECE C[C@H](N[C@H]1C[C@H](c2ncc[nH]2)C1)c1cc(O)ccc1O 2181598636 IDTLALJPIFDBDH-DCAQKATOSA-N 273.336 2.418 10 10 CECE CC1CCC(CNC(=O)c2cc(O)c(O)c(O)c2)CC1 2188874566 IHNLGXDDSIIZRX-UHFFFAOYSA-N 279.336 2.360 10 10 CECE N[C@H]1CCCc2cc(N3C[C@H](C4CC4)[C@@H](O)C3)ccc21 2184692071 WWZFZTHDRMQWDF-IKGGRYGDSA-N 272.392 2.230 10 10 CECE CC1(O)CC2(CN(c3ccc4c(c3)CCC[C@@H]4O)C2)C1 2184688936 JLLNLSNDVQBQRC-HNNXBMFYSA-N 273.376 2.408 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](O)[C@H]3CC[C@H]32)c(F)c1 2194523686 NUXFUPFRKLHYPS-HUJUBCJISA-N 283.318 2.368 10 10 CECE CN(CCCn1ccnc1)c1ccc2c(c1)CC[C@@H]2N 2184744312 UEPYQFCFOUEXIT-INIZCTEOSA-N 270.380 2.356 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H]4C[C@H](O)CC[C@H]43)ccc21 2184730110 RGRNCLKCUMCARY-WNOSKKOXSA-N 273.376 2.406 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@@H]3C[C@H]3[C@@H]2CO)cc1 2198997423 SCUNRSWHYOBUQX-IMJJTQAJSA-N 274.408 2.392 10 10 CECE Oc1cccc(F)c1CN[C@H]1CCCCC[C@@H]1O 2042627659 TYDVACRHYAAHNV-JSGCOSHPSA-N 253.317 2.315 10 10 CECE COc1ccc(CN[C@H]2C[C@H]2C(F)(F)F)c(O)c1 2043497696 ZTOARQNHXDPLFZ-ZJUUUORDSA-N 261.243 2.441 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@@H]2C(F)(F)F)c1 2043495994 NIQYGTNIEXVOPY-VHSXEESVSA-N 261.243 2.441 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@H]2C(C)(C)O)c1O 2191152699 DOPLQMNXZDGTCZ-ZDUSSCGKSA-N 281.327 2.079 10 10 CECE CCOC1(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)CC1 2047759744 YUGBWZMRVZVEIQ-JTQLQIEISA-N 252.318 2.104 10 10 CECE CN1CCc2cc([C@H](O)C(=O)C[C@@H]3C[C@@H]3CF)ccc21 2191451847 YESQFQIAIWWIKC-ZENOOKHLSA-N 277.339 2.277 10 10 CECE CC1(C)CSCCN1C(=O)Cc1ccc(N)cc1 2051327883 GXJJNLFKZWUFKK-UHFFFAOYSA-N 264.394 2.165 10 10 CECE [N-]=[N+]=NCCCCNS(=O)(=O)[C@@H]1CCCC[C@@H]1F 2055325111 MDVMAXRGLWIAKI-VHSXEESVSA-N 278.353 2.277 10 10 CECE C[C@@]1(O)CCCN(c2cc(Cl)c(CN)cc2F)C1 2057248627 IFEFFGBCTJIGKD-CYBMUJFWSA-N 272.751 2.289 10 10 CECE CN1CCc2cc([C@H](O)c3ccn(C4CC4)n3)ccc21 2186780947 ONHBBDMWBOYGTB-INIZCTEOSA-N 269.348 2.292 10 10 CECE CNCc1ccc(N2CCC(C3(O)CC3)CC2)c(F)c1 2187039732 NLCPOXDKDVSITJ-UHFFFAOYSA-N 278.371 2.286 10 10 CECE CN1C[C@H]2C[C@H]1CN2Cc1c(O)ccc2ccccc12 2187561117 XFPZJSVGZAMVHB-UONOGXRCSA-N 268.360 2.434 10 10 CECE COc1cccc(CNC[C@H]2CC(C)(C)O2)c1O 2069136279 RRCRCVHWNYDJNN-LLVKDONJSA-N 251.326 2.058 10 10 CECE C[C@H](c1ccccc1O)N(C)[C@@H]1[C@H]2C[C@@H]3CN[C@@H]1[C@H]3C2 2192603757 GHPYRTKTRFJJIW-DVMXTWATSA-N 272.392 2.381 10 10 CECE Nc1ccc(CCC(=O)OC[C@@H]2C[C@@H]2CF)cc1 2071455365 CCMOPISGFHGLHS-NEPJUHHUSA-N 251.301 2.350 10 10 CECE Cc1[nH]c(=N)sc1CN(C)Cc1ccccc1O 2072449657 AVAFGCZZIRCZEY-UHFFFAOYSA-N 263.366 2.202 10 10 CECE C[C@H](N[C@H](C)c1ccc(O)cc1O)c1nncs1 2077145630 VCKLYDUGIHBPNL-SFYZADRCSA-N 265.338 2.361 10 10 CECE C[C@]12CC[C@H]1CCN2c1ccc2c(c1)NC(=O)[C@@H]2N 2101051182 SUBGXGYLGVSRDX-RJIBLYRGSA-N 257.337 2.017 10 10 CECE CCC[C@@H](NC)c1nc(-c2ccc(O)c(O)c2)no1 2102208502 OEALWOKDUVAJOI-SECBINFHSA-N 263.297 2.208 10 10 CECE CCCc1ocnc1CNCc1ccc(O)cc1O 2104107063 BMUBYVHOQSMZRI-UHFFFAOYSA-N 262.309 2.328 10 10 CECE C[C@@H]1CC[C@@H](CN)CN1Cc1ccc(F)cc1O 2084078643 GVJWIHRELJTWCO-MNOVXSKESA-N 252.333 2.091 10 10 CECE COc1cc(N(C)CC[C@H](C)OC)ccc1CO 2084017977 XKQSENGLVJVSRH-NSHDSACASA-N 253.342 2.049 10 10 CECE CCCc1ncc(CNCc2ccc(O)c(O)c2)o1 2104331277 VDMDDZIIVDUTGT-UHFFFAOYSA-N 262.309 2.328 10 10 CECE CC(C)(C)c1nc([C@@H](NN)c2ccccc2O)co1 2104319837 PUWOWUVTOVDRQC-LBPRGKRZSA-N 261.325 2.230 10 10 CECE CN[C@@H]1CN(c2ccc(OC)c(F)c2)CC12CC2 2085072145 ZMMKXQMVSADWBC-CYBMUJFWSA-N 250.317 2.023 10 10 CECE Cc1cccc(O)c1CNC[C@]12COC[C@H]1C2(F)F 2105576629 IGWCLJXZHMRYNC-OLZOCXBDSA-N 269.291 2.072 10 10 CECE CC[C@@H]1[C@H]2CNC[C@H]2CN1c1ccc(OC)c(F)c1 2106336725 MERSVQWVLNTHSD-VHRBIJSZSA-N 264.344 2.269 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)C1CCOCC1 2106798931 QEHLNZJOUJTHBF-INIZCTEOSA-N 260.381 2.366 10 10 CECE O[C@H](c1ccc(N2CCCC2)cc1)[C@H]1C[C@H](F)CN1 2106821085 QSYSFXJVVGHHLX-NWANDNLSSA-N 264.344 2.020 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@]1(O)CCS[C@@H]1C 2106851744 XMXFNKMPRKMIQR-KCPJHIHWSA-N 280.437 2.270 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)Cc1cc(F)ccc1O 2107340492 FTTINIFZUDMLJY-FZMZJTMJSA-N 266.360 2.351 10 10 CECE CO[C@H]1C[C@@H](OC)CN(c2ccc(CN)cc2Cl)C1 2109200825 LAZPBKXZPUBOIK-TXEJJXNPSA-N 284.787 2.039 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)[C@@H]1CC[C@@H]2C[C@@H]21 2109227852 DOBJQTZZSQUTTC-ADEWGFFLSA-N 261.321 2.011 10 10 CECE CC(C)N(Cc1ccc(N)cc1)Cc1ccncn1 2089616668 GUOVVEWTNNBNNV-UHFFFAOYSA-N 256.353 2.469 10 10 CECE CCN[C@@H](c1ccccc1O)c1cn(C)nc1CC 2090037821 QONZMKWDRUMOJI-HNNXBMFYSA-N 259.353 2.387 10 10 CECE CO[C@H](Cn1ccc2cc(N)ccc21)[C@@H]1CCOC1 2093866191 QQJRXYVOHANEJV-IUODEOHRSA-N 260.337 2.275 10 10 CECE C[C@]12C[C@@H]1CN(c1cc3c(cc1Cl)[C@H](O)C(=O)N3)C2 2096032048 NEOCFJCAVTVLBR-FDHQVAJDSA-N 278.739 2.172 10 10 CECE C[C@H](O)c1ccc(N(C)[C@H]2COCC[C@@H]2C)cc1O 2096238446 JHLQTCHWYALBIW-MJVIPROJSA-N 265.353 2.307 10 10 CECE C[C@@H]1CN(c2cc3c(cc2Cl)[C@H](N)C(=O)N3)C[C@@H]1F 2096484057 DSVJOYZXFIUKDL-ZIGWGHGNSA-N 283.734 2.086 10 10 CECE CCN[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 2096691702 HAQWTBXMXBTWCF-LBPRGKRZSA-N 270.323 2.244 10 10 CECE CCSC1CN(CCC(=O)Nc2ccc(N)cc2)C1 2097635651 INCVMPFDTJJKNP-UHFFFAOYSA-N 279.409 2.035 10 10 CECE CC1(C)CCCO[C@@H]1C[C@@H](NN)c1ccccc1O 2098524469 GBBLWBIVQARGLW-TZMCWYRMSA-N 264.369 2.492 10 10 CECE CCC[C@@H]1COCCN1C(=O)Nc1ccc(N)cc1 2113872468 IPMRZZXCFKXKDE-CYBMUJFWSA-N 263.341 2.302 10 10 CECE Cc1cnn(C2CN(c3ccc([C@H](C)N)cc3)C2)c1 2113928460 IEIDDYXHTBDWML-LBPRGKRZSA-N 256.353 2.273 10 10 CECE Cc1cnn(C2CN(c3ccc([C@@H](C)N)cc3)C2)c1 2113928459 IEIDDYXHTBDWML-GFCCVEGCSA-N 256.353 2.273 10 10 CECE CCN(C)C1CCN(c2ccc(CNC)cc2)CC1 2114835484 MXCCTAVZACJTOL-UHFFFAOYSA-N 261.413 2.327 10 10 CECE COc1cccc(O)c1CN1C[C@@H](C)CC[C@@H]1C(=O)O 2201058301 ARCBVRJQMGBHSC-CMPLNLGQSA-N 279.336 2.086 10 10 CECE CCO[C@H]1CCCN(c2ccc(CNC)c(OC)c2)C1 2204557536 QRFZVCWXZSHGOH-HNNXBMFYSA-N 278.396 2.420 10 10 CECE COc1cc(N(C)[C@H]2CCCN(C)CC2)ccc1CN 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10 10 CECE C[C@]12CC[C@@H]1CCN2CC(=O)c1ccc(O)c(O)c1 2101063116 BWIZYFCHUFGCCF-ABAIWWIYSA-N 261.321 2.155 10 10 CECE CC[C@H]1[C@@H](C(=O)O)CCN1Cc1c(C)cccc1O 2104507463 NIKNTZWGBICLNN-AAEUAGOBSA-N 263.337 2.386 10 10 CECE COC(=O)[C@@H](NCCN=[N+]=[N-])C1CC(C(F)(F)F)C1 2105187898 IZFNQMSGHQGJSF-RRQHEKLDSA-N 280.250 2.016 10 10 CECE C[C@@H]1C[C@@]1(F)CN(C)C(=O)Cc1ccc(N)cc1 2085434148 AMQNPQYOHZUUAF-QMTHXVAHSA-N 250.317 2.018 10 10 CECE C[C@@H]1CC[C@@H](N)CN1c1ccc2c(c1)OC(F)(F)O2 2106387508 DWSGZYBNPWPYLJ-RKDXNWHRSA-N 270.279 2.324 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H](OC)C3CC3)ccc21 2106793555 OFXPXMFJTGITGS-HZPDHXFCSA-N 260.381 2.494 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@]3(C)CCNC3)ccc21 2106826431 SUNLPSHRAMGLJI-CVEARBPZSA-N 260.381 2.102 10 10 CECE C[C@H]1C[C@@](O)(c2ccc3c(c2)CCCN3C)CCO1 2106831249 ONEOMKVHHYMVBZ-BLLLJJGKSA-N 261.365 2.456 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@@H](CN)C1(C)C 2106889322 VZZYIDAOJFUGNS-MNOVXSKESA-N 264.369 2.218 10 10 CECE [N-]=[N+]=NCCCCN1CCC[C@]2(CCCNC2=O)C1 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268.744 2.415 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cc(O)cc(O)c2)C1 403714836 YHPXNIBPVMEFKN-VIFPVBQESA-N 262.269 2.013 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)O)c(Cl)c2)[C@@H]2COC[C@@H]12 2158352673 IGLQMBHREAUKNJ-ZEQHWRKHSA-N 297.782 2.243 10 10 CECE CCCN(CCCCC(N)=O)c1ccc(CN)cc1 311417153 BZIZRHDMKSIYEL-UHFFFAOYSA-N 263.385 2.017 10 10 CECE Cc1ccc([C@H](C)NCCc2cn(C)cn2)c(O)c1 313268397 LVEURHFYIRZCSW-LBPRGKRZSA-N 259.353 2.327 10 10 CECE CC(C)(C)N1CC[C@H](NCCc2ccc(O)c(O)c2)C1 2160017224 GIVQUTSTDGLWFI-ZDUSSCGKSA-N 278.396 2.103 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@]2(C)COCCO2)c(F)c1 2174263549 JCZQGRPQFGOVIB-XHDPSFHLSA-N 282.359 2.087 10 10 CECE Cc1cc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)nc(Cl)n1 701316628 MNTJKVJCNAIJPV-MRVPVSSYSA-N 280.719 2.353 10 10 CECE CN1CCc2cc([C@H](O)C3(C(=O)O)CC=CC3)ccc21 2164812688 VSJMZIRHTIQATC-AWEZNQCLSA-N 273.332 2.133 10 10 CECE Cc1csc([C@](C)(NCCCN=[N+]=[N-])C(=O)O)n1 701995422 DMJPLNZXKZWYHX-JTQLQIEISA-N 269.330 2.041 10 10 CECE Nc1ccc(CCCN2CCC(CC(=O)O)CC2)cc1 2179661445 GUSUFDIAWJAAQW-UHFFFAOYSA-N 276.380 2.388 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@H]2C[C@@H](O)C2)c(F)c1 703693631 HIAYZRDRCKLAAZ-JBLDHEPKSA-N 253.317 2.086 10 10 CECE C[C@H](N)[C@H]1CCCCN1Cc1cc(F)cc(F)c1O 708494628 NBAAYWCUVPMOLI-TVQRCGJNSA-N 270.323 2.372 10 10 CECE NCc1ccc(N2CCC[C@H]3COC[C@@H]32)c(Cl)c1 690293314 LGHYVNRCGHMVQC-FZMZJTMJSA-N 266.772 2.414 10 10 CECE Nc1ccc(OCC(=O)N2[C@H]3CCC[C@H]2CC3)cc1 380547049 HLGXNGVSQJCXLY-STQMWFEESA-N 260.337 2.191 10 10 CECE CCC[C@@]1(NCc2ccc(OC)cc2O)CCOC1 381229473 PKXMMNJMECBUFB-OAHLLOKOSA-N 265.353 2.450 10 10 CECE C[C@H](NCc1ccnc(O)c1)c1cc(F)ccc1O 392937895 GPNFGRKTRQEWJY-VIFPVBQESA-N 262.284 2.483 10 10 CECE CN1CCc2cc([C@@H]3N[C@@H](c4cscn4)CO3)ccc21 2175644708 YZMCURWQBSOVIZ-IUODEOHRSA-N 287.388 2.495 10 10 CECE C[C@H](N[C@@H]1CCN2CCC[C@H]1C2)c1ccc(O)cc1O 383566563 SXBUSXUBMWPOJS-SLEUVZQESA-N 276.380 2.233 10 10 CECE Cc1cc(CNC(C)C)ccc1N1C[C@H](O)C[C@@H]1C 384823070 SEXIBNJOGBTSIW-DZGCQCFKSA-N 262.397 2.453 10 10 CECE CCOc1ccncc1[C@@H](O)Cc1ccc(N)cc1 696580537 SGBKDMRXQGZSLH-AWEZNQCLSA-N 258.321 2.339 10 10 CECE COc1ccc([C@H](C)NCC[C@H](C)OC)c(O)c1 386573669 YBMGSMZUXZJSGT-QWRGUYRKSA-N 253.342 2.476 10 10 CECE COc1ccc(N(C)CCc2csc(CN)n2)cc1 719000391 OSIODBMFAMCJKF-UHFFFAOYSA-N 277.393 2.289 10 10 CECE COCC(COC)N[C@H]1C[C@H](C)c2c(C)ccc(O)c21 388437767 QTNZTBHCCIHDKH-AAEUAGOBSA-N 279.380 2.500 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3C[C@@H](O)CC[C@H]3C2)cc1 398890363 ZFKHWJMDLFJIQB-ZIEJDFEHSA-N 260.381 2.304 10 10 CECE CCN[C@H](c1ccccc1O)c1cccn2cnnc12 2177066578 NFDDFBHUMSHBDE-CQSZACIVSA-N 268.320 2.134 10 10 CECE NCc1ccc(N2C[C@H](F)[C@@H](CO)C2)c2ccccc12 2177131085 QSQKDJKLIJLEDO-DOMZBBRYSA-N 274.339 2.065 10 10 CECE Cc1cnn(C2CN(c3ccc([C@@H](C)O)c(O)c3)C2)c1 2170298282 PEEABBDGMJDPKQ-LLVKDONJSA-N 273.336 2.012 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCCN2C[C@H](O)C(F)F 2177536113 OJXALKXZRUSPGC-HZMBPMFUSA-N 284.350 2.346 10 10 CECE O=C(N[C@@H]1[C@@H]2CCCC(F)(F)[C@H]21)c1cccc(O)c1O 2170820884 RLAHSFVOTUSOSV-AVPPRXQKSA-N 283.274 2.261 10 10 CECE COC[C@H]1CN(Cc2ccc(C)cc2O)CC(C)(C)O1 877509775 LWKOKJQNYFTBMH-CQSZACIVSA-N 279.380 2.326 10 10 CECE CCn1cccc1CN(C)C(=O)c1ccc(O)c(O)c1 2171001092 RUNUXQYJCJXCEU-UHFFFAOYSA-N 274.320 2.191 10 10 CECE CCCNCc1ccc(N2CC[S@@](=O)C[C@H]2C)c(C)c1 2171970560 YVOXTINRIIVAES-JLTOFOAXSA-N 294.464 2.452 10 10 CECE O=C1Nc2cc(N3CC4(CC(F)C4)C3)c(Cl)cc2[C@H]1O 2171937565 KLLZPLUPVTXGDL-GFCCVEGCSA-N 296.729 2.264 10 10 CECE Oc1ccc(F)cc1CN1CC[C@H]2NCCC[C@@H]2C1 1237391712 LUYXKIMTKJMWIB-BXUZGUMPSA-N 264.344 2.105 10 10 CECE NCc1cnn(Cc2c(O)cccc2F)c1C(F)F 2079061027 QTOFBZHTHHMLIW-UHFFFAOYSA-N 271.242 2.172 10 10 CECE CCCOc1ccc(N2CC[C@@H]3OCCN[C@@H]3C2)cc1 2162654892 FGNGZSPJVMTSGY-CVEARBPZSA-N 276.380 2.043 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@]12COC[C@@H]1C2(F)F 2163068348 GZESYLPLEFXXIL-BFHYXJOUSA-N 282.334 2.295 10 10 CECE CO[C@]1([C@@H](O)c2ccc(N3CCCC3)cc2)CCOC1 2163093013 YCBQJRFUEVSBSD-JKSUJKDBSA-N 277.364 2.126 10 10 CECE CN1CCc2cc([C@@H](N)C3(O)CC(C(F)F)C3)ccc21 2163141596 WECUARJEYPUMOS-GLWUULTISA-N 282.334 2.085 10 10 CECE NN[C@H](c1ccc(N2CCCC2)cc1)[C@H]1CCCOC1 2163104677 FYYPETBXMDWTPP-GOEBONIOSA-N 275.396 2.218 10 10 CECE O=C(O)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1c(O)cccc1F 2181743880 VTXIRYPYNSBJKE-JGPRNRPPSA-N 279.311 2.359 10 10 CECE CCCN(C[C@]1(C)COCCO1)c1ccc(CN)cc1 2174174233 DPRNSILEDSFIFF-MRXNPFEDSA-N 278.396 2.167 10 10 CECE CC[C@H](N[C@H]1C[C@H](n2ccnn2)C1)c1ccccc1O 2184108273 UXGXAHPFDZKCRD-OBJOEFQTSA-N 272.352 2.428 10 10 CECE N[C@H]1CCCc2cc(N3CCS[C@H](CCO)C3)ccc21 2184681459 DQCXBTPDRQJEJU-ZBFHGGJFSA-N 292.448 2.327 10 10 CECE C[Si]1(C)CCN(CCNCc2cccc(O)c2O)CC1 2184618720 HKEUHOPQAFEJRX-UHFFFAOYSA-N 294.471 2.211 10 10 CECE Cc1cccc(O)c1CN[C@H]1C[C@@H](Cn2cccn2)C1 2184781160 MWJAOPMKMULCQQ-OKILXGFUSA-N 271.364 2.466 10 10 CECE CCCN[C@@H]1CCc2cc(N3CC=C[C@@H](O)C3)ccc21 2184728979 DJHSAPVPGPALMQ-NVXWUHKLSA-N 272.392 2.411 10 10 CECE CN[C@H](C)c1cc(F)c(N(CCO)CC(F)F)c(F)c1 2194714627 OOSILAQVMDOHHD-MRVPVSSYSA-N 294.292 2.309 10 10 CECE NC[C@@H](NC(=O)Nc1ccc(N)cc1)c1ccccc1 2191531755 WZIPHCRYLICKNA-CQSZACIVSA-N 270.336 2.090 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H]1CCNC(=O)C1 2186333230 UFDQJAWWNAQRDA-WOPDTQHZSA-N 274.364 2.117 10 10 CECE CN(Cc1ccc(Cl)nn1)c1ccc(CN)cc1 2043038338 DYTIAEBUJSKXOZ-UHFFFAOYSA-N 262.744 2.225 10 10 CECE CO[C@H](C)CC[C@@H](NN)c1ccc(N(C)C)cc1 2044734307 VGJFEZQUOLPIRN-BXUZGUMPSA-N 251.374 2.072 10 10 CECE FC(F)(F)[C@H]1CN(c2ccc3c(c2)CCCO3)CCN1 2186679050 FLXGVXXRRURASP-CYBMUJFWSA-N 286.297 2.352 10 10 CECE COC1(CN(C)c2ccc([C@@H](C)N)c(O)c2)CC1 2048922866 LXKWJQBXRAMBKT-SNVBAGLBSA-N 250.342 2.027 10 10 CECE Cn1cnc(Cl)c1CNCc1cccc(F)c1O 2049171120 SDVAOSPQROBEKY-UHFFFAOYSA-N 269.707 2.208 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@H]1CCCOC1(C)C 2187195903 PNVPORGVDVXHAR-YUELXQCFSA-N 279.380 2.219 10 10 CECE Oc1cc(-c2nc(C3C[C@@H]4C[C@H]4C3)no2)cc(O)c1O 2199666883 BSTWNFORFUIZHY-BQBZGAKWSA-N 274.276 2.367 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCCN(C)CC2)c(F)c1 2192758423 XEKJCLDRHYDSOS-CQSZACIVSA-N 279.403 2.466 10 10 CECE COC(=O)c1cnc(Sc2n[nH]c(C(C)C)n2)s1 2062458314 FADFVNYXCMBNIU-UHFFFAOYSA-N 284.366 2.322 10 10 CECE NC1CCN(c2ccc(OC[C@H]3C[C@@H]3F)cc2F)CC1 2188355031 CHOJJUQRHLCNGR-MFKMUULPSA-N 282.334 2.490 10 10 CECE CN1C[C@@H](N(C)Cc2cc(Cl)ccc2O)CCCC1=O 2188461340 UXLJPAOZWYJOSH-ZDUSSCGKSA-N 296.798 2.488 10 10 CECE CN(Cc1cc(Cl)ccc1O)[C@@H]1CC(=O)N2CCC[C@H]12 2188463061 DYFZRNICADUCME-CHWSQXEVSA-N 294.782 2.241 10 10 CECE NC[C@]12CCC[C@@H]1CCN2Cc1cc(F)cc(F)c1O 2197354358 ZDPZNKCLOPCBAY-IAQYHMDHSA-N 282.334 2.374 10 10 CECE CS[C@H]1CCC[C@H](NC(=O)c2cc(O)c(O)c(O)c2)C1 2188874078 CUSSJCWYBGBYBS-UWVGGRQHSA-N 297.376 2.207 10 10 CECE CNCc1ccc(N2C[C@]3(C)C[C@]3(COC)C2)cc1 2109178644 UQXNGLPBUDBLKQ-JKSUJKDBSA-N 260.381 2.269 10 10 CECE C[C@@H](NC(=O)c1nnc(Cl)s1)c1ccccc1O 2072481100 DFDBVPCIXDWDBD-ZCFIWIBFSA-N 283.740 2.388 10 10 CECE CO[C@]1(c2noc(-c3sccc3O)n2)CCCOC1 2109873805 FZKHADSEDPVUMG-GFCCVEGCSA-N 282.321 2.156 10 10 CECE C[C@H](O)c1cc(F)c(N(C)CCN(C)C)c(F)c1 2074084478 WJCIMVSUIJPQNK-VIFPVBQESA-N 258.312 2.016 10 10 CECE C[C@]1(C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)CCCCO1 2078492054 IZOLXHPKVSKMFY-CMPLNLGQSA-N 252.318 2.104 10 10 CECE CCN(C(=O)[C@@H]1C[C@]12CCOC2)c1ccc(N)cc1 2100497912 UHFCMEQAENNGDO-ZFWWWQNUSA-N 260.337 2.048 10 10 CECE Oc1ccc(CN[C@H]2CCCOC23CCC3)cc1O 2102342373 QHRLEIGZGPQHPH-AWEZNQCLSA-N 263.337 2.289 10 10 CECE O=C(NC[C@@H]1C[C@@H]1C(F)(F)F)c1cccc(O)c1O 2103538659 XEOLMQZSZYHSCA-XPUUQOCRSA-N 275.226 2.026 10 10 CECE Cn1ncc2c1C[C@@H](Nc1c(N)cccc1F)CC2 2103712431 UIYXSAJFUBFQFB-JTQLQIEISA-N 260.316 2.111 10 10 CECE C[C@@H]1C[C@H](F)CN1CCC(=O)Nc1ccc(N)cc1 2104017181 GRQXEDLKIUDLTJ-MNOVXSKESA-N 265.332 2.030 10 10 CECE COc1cc(N(C)C2CC(CF)C2)ccc1CO 2084015721 HEJIABCAOOFTOV-UHFFFAOYSA-N 253.317 2.372 10 10 CECE CN(C(=O)c1cccc(O)c1O)[C@H]1CCCC1(F)F 2104227072 PJISBTYMXVTHOU-JTQLQIEISA-N 271.263 2.358 10 10 CECE NCCCN(Cc1c(O)cccc1F)CC(F)(F)F 2104490465 IWWJBIVJYYOUOL-UHFFFAOYSA-N 280.265 2.244 10 10 CECE C[C@@H]1CN2CCC[C@H]2CN1Cc1c(O)cccc1F 2104473308 WHJFBSHLMWYAKT-NEPJUHHUSA-N 264.344 2.200 10 10 CECE Oc1cccc(F)c1CN1CC[C@H]([C@H]2CCCN2)C1 2104483362 DOLRIAFAFRGTEB-SMDDNHRTSA-N 264.344 2.105 10 10 CECE Oc1cccc(Cl)c1CN[C@H]1CC2(CCC2)[C@H]1O 2084789760 DVFQVAGPWVDLEB-AAEUAGOBSA-N 267.756 2.439 10 10 CECE CN(c1ccc2c(c1)CCO2)[C@H]1CCNCC1(C)C 2106591313 NZGVWJSEGQJRQF-HNNXBMFYSA-N 260.381 2.446 10 10 CECE CCOC(=O)[C@](N)(CSc1nccs1)C1CCC1 2086618668 AIQUVLLIFCYZGC-LBPRGKRZSA-N 286.422 2.296 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@@H](C)O[C@@H]3C)ccc21 2106789581 ZLOMWDSUCAOYFP-HSMVNMDESA-N 260.381 2.420 10 10 CECE CN1CCc2cc([C@H](N)c3ncccc3F)ccc21 2106797238 YOENKAWFVUWSDS-AWEZNQCLSA-N 257.312 2.261 10 10 CECE CC[C@@H](C)[C@H](N)[C@H](O)c1ccc2c(c1)CCN2CC 2106805636 PJJWQGGEUQKGAG-XFBWCDHKSA-N 262.397 2.476 10 10 CECE Cn1nccc1[C@@H](O)c1ccc(N2CCCC2)cc1 2106830231 DSKADURUMCZJRS-HNNXBMFYSA-N 257.337 2.102 10 10 CECE CC1(C)C[C@@](O)(c2ccc(N3CCCC3)cc2)CN1 2106827208 AMDMZLPTJLMZKE-INIZCTEOSA-N 260.381 2.246 10 10 CECE Oc1nc(CNCc2ccc3c(c2)CCCO3)cs1 2087531062 FGAPTMITMUYRDA-UHFFFAOYSA-N 276.361 2.464 10 10 CECE C[C@H](NCC1(n2cccn2)CC1)c1ccccc1O 2088402944 NLVVVHFZDQWBPN-LBPRGKRZSA-N 257.337 2.429 10 10 CECE Nc1ccc(OCC(=O)N2CC[C@@H]2C2CCC2)cc1 2088659760 OFANBNPLCBQGHZ-CQSZACIVSA-N 260.337 2.049 10 10 CECE O=C(NC1CC[C@@H]2C[C@H]2CC1)c1ccc(O)c(O)c1 2089427621 DVWXEAFEJKSPHR-NXEZZACHSA-N 261.321 2.406 10 10 CECE CCCOC1(CNCc2cccc(OC)c2O)CC1 2110294631 XTLHNNSAMYWLBV-UHFFFAOYSA-N 265.353 2.450 10 10 CECE COc1ccc([C@@H](C)NCCCC[S@](C)=O)c(O)c1 2110340479 REANFUOTTYAEFN-WYRIXSBYSA-N 285.409 2.210 10 10 CECE NCc1ccc(N2C[C@@H]3CCC[C@H](C2)C3O)cc1Cl 2111490287 VCMGMYDVPWJJMU-ODOQXGPZSA-N 280.799 2.396 10 10 CECE CCc1nc([C@H](O)[C@H](NC)c2ccccc2O)cs1 2091861580 BRTXTQKUSWIKQK-KGLIPLIRSA-N 278.377 2.405 10 10 CECE CN1[C@H]2CCC[C@H]1CC(NCc1ccc(N)cc1)C2 2092534991 NBANLEOXDLTQCP-HOTGVXAUSA-N 259.397 2.374 10 10 CECE C[C@H](O)c1ccc(N2C[C@@H](C)[C@@H](O)C[C@H]2C)c(F)c1 2093109756 WYULBIVQKSDDSL-OZWUEAAUSA-N 267.344 2.475 10 10 CECE CNCc1ccc(N2CC[C@@H](O)C3(CC3)C2)cc1C 2093181852 AGMNCEXFDNBOAB-OAHLLOKOSA-N 260.381 2.066 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1[C@H]2C=CC[C@H]1CC2 2095960233 AHVQADDXSQGWPJ-RYUDHWBXSA-N 260.293 2.384 10 10 CECE CC[C@H]1CCOC[C@@H]1NC(=O)Nc1ccc(N)cc1 2096240949 ZCNRITFEWKRXSG-GWCFXTLKSA-N 263.341 2.205 10 10 CECE Cc1cc(N2CC[C@@]3(CCO3)C2)ccc1C[C@@H](C)N 2097005467 ZCBCWRBWQDHZBL-CZUORRHYSA-N 260.381 2.254 10 10 CECE O=C1Nc2cc(N3CC(C4CC4)C3)c(Cl)cc2[C@@H]1O 2097246597 CKQPFWRFCQPYHZ-ZDUSSCGKSA-N 278.739 2.172 10 10 CECE Cc1cc(N2CCS[C@@H]3COCC[C@@H]32)ccc1CO 2114093357 WEXSTDKAGWPXFD-LSDHHAIUSA-N 279.405 2.198 10 10 CECE CC[C@H]1CN(Cc2cc(C)ccc2O)C[C@H]1N(C)C 2114073364 XYGKAPPYIUHFMH-DZGCQCFKSA-N 262.397 2.473 10 10 CECE CC(C)c1nnc2n1CCN(c1ccc(N)cc1)C2 2114226841 FPQHXQGYSLDMTQ-UHFFFAOYSA-N 257.341 2.004 10 10 CECE CSCCN1CCN(c2ccc([C@@H](C)O)cc2)CC1 2114988094 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277.411 2.342 10 10 CECE CC(C)[C@H](CO)N(C)c1ccc(CN)cc1Cl 2302500312 ZKHMUQMUJKVIKV-ZDUSSCGKSA-N 256.777 2.252 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(SC)c2)C1 2308070196 OWJOEWYIYCYPJD-LBPRGKRZSA-N 252.383 2.092 10 10 CECE CNCc1ccc(N2C[C@@H]3C[C@H](O)[C@H]2C3)c(Cl)c1 2309934548 FHIJQGVTCNDCJV-GDLCADMTSA-N 266.772 2.019 10 10 CECE C[C@H]1C[C@](O)([C@H](N)c2ccccc2O)C[C@@H](C)S1 2317626555 KHYBXJWMSFPJEO-QOBDMFJFSA-N 267.394 2.427 10 10 CECE CC1=NN(c2ccccn2)C(=O)C1=Cc1ccc(O)c(O)c1 2332094626 ZLYURPIGMGKQMW-UHFFFAOYSA-N 295.298 2.299 10 10 CECE COc1ccc([C@@H](C)NC[C@@]23COC[C@@H]2C3)c(O)c1 2329460037 ISIRYCGVWADCKX-ZETOZRRWSA-N 263.337 2.088 10 10 CECE O[C@H]1C[C@@H]2CN(c3ccc(OCC(F)F)cc3)C[C@H]12 2333688718 MMFHOSZWFHYUAG-ICCXJUOJSA-N 269.291 2.148 10 10 CECE O[C@H]1C[C@@H]2CC[C@@H]1CN2c1ccc2c(c1)CC[C@H]2O 2337137551 KIMCTSGNAXLKML-JMGFVUJMSA-N 259.349 2.016 10 10 CECE C[C@H]1C[C@@H](C)[C@@H]1[C@H](N)[C@@H](O)c1ccc(N(C)C)cc1 2339096507 KKYKIETWUREFGG-YICITSRQSA-N 262.397 2.405 10 10 CECE 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258.321 2.399 10 10 CECE CO[C@H]1[C@H](NCc2cccc(F)c2O)CC1(C)C 1974253218 RPQAPTPTSANEPZ-YPMHNXCESA-N 253.317 2.434 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1CC[C@]12CCCO2 1974348639 YVJSKGKSDYLOMA-TZMCWYRMSA-N 269.291 2.472 10 10 CECE OCc1ccc(N2C[C@@H]3CCO[C@H]3C2)cc1Cl 2004624086 GCBHMNVULFIXCW-ZANVPECISA-N 253.729 2.057 10 10 CECE Cc1cc(C)nc(CNCc2ccc(F)c(F)c2O)n1 2149964405 AIFZGHVFOUQRBV-UHFFFAOYSA-N 279.290 2.367 10 10 CECE Nc1ccc(CCCN2C[C@@H](O)CC3(CCC3)C2)cc1 2151349166 VJTFURJBWNIJSA-INIZCTEOSA-N 274.408 2.438 10 10 CECE C[S@@](=O)(=NCCCN=[N+]=[N-])c1ccc(N)cc1 2006177073 MMIZUSDBMHOKNS-KRWDZBQOSA-N 253.331 2.426 10 10 CECE CO[C@H](CN[C@H](C)c1ccccc1O)[C@@H]1CCCOC1 2150212886 BMEJBASDHXYTIG-XJKCOSOUSA-N 279.380 2.484 10 10 CECE C[C@@H](C(=O)Nc1ccc(N)cc1)N1C[C@H]2CC[C@@]1(C)C2 2145902079 MAOSRCJCCRVIJE-MKBNYLNASA-N 273.380 2.470 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2CC1CCOCC1 162115607 DSUHTWMUNVWYBD-LBPRGKRZSA-N 260.381 2.495 10 10 CECE CCN(CC)C(=O)CCN[C@@H](C)c1ccccc1O 37752399 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311808530 CIWKTTXJLMYWEU-CYBMUJFWSA-N 261.413 2.497 10 10 CECE Cc1cc(N2C(=O)Cc3occ(C)c3C2=O)ccc1N 312368145 AHNOZJJZCMLPSL-UHFFFAOYSA-N 270.288 2.208 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@H](OCCOC)C2)cc1 2158687927 CPNGOOPEFVJSPC-BBRMVZONSA-N 278.396 2.209 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1Cl 78901507 XOAJNSBZGXEQCP-UWVGGRQHSA-N 281.787 2.061 10 10 CECE CN(C[C@@]12COC[C@@H]1C2(F)F)c1ccc(CN)cc1F 2161869120 FSJVHWJOPDEFNS-QWHCGFSZSA-N 286.297 2.002 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CC(F)(F)C[C@H]3C)ccc21 2172040809 HUWYMEPLKCKDOV-PELKAZGASA-N 281.306 2.133 10 10 CECE CCNCc1ccc(N(C)Cc2cnn(CC)n2)cc1 2172424537 RRBSLANSKPYRPT-UHFFFAOYSA-N 273.384 2.044 10 10 CECE COC[C@@H]1CN(c2ccc(CN)cc2C)CC(C)(C)O1 2177734984 AWALLHMYFCSHRI-AWEZNQCLSA-N 278.396 2.084 10 10 CECE CC(C)(O)[C@@H]1CCCN1c1ccc(CN)c(F)c1 706926569 BKQXABGGWQPYGH-ZDUSSCGKSA-N 252.333 2.024 10 10 CECE Nc1ccc(OCC(=O)N2C[C@@H]3CCCCC[C@H]32)cc1 707285892 MRKDLBSOFQMSCM-SWLSCSKDSA-N 274.364 2.439 10 10 CECE CCN1CCc2cc([C@H](NN)c3cnc(C)s3)ccc21 2163154755 BNMVICDENZQZDW-HNNXBMFYSA-N 288.420 2.387 10 10 CECE Cc1cc(N(C)[C@H](C)C(N)=O)ccc1CNCC(C)C 711089175 GAWJAUYULVJBHF-CYBMUJFWSA-N 277.412 2.051 10 10 CECE Oc1c(F)cc(F)cc1CNCCn1cc(Cl)cn1 708558828 LDIHQULIISABAN-UHFFFAOYSA-N 287.697 2.310 10 10 CECE Nc1ccc(CCCN2CCC[C@]23CCOC3)cc1 381713575 JSBJBFIRFVIBFX-MRXNPFEDSA-N 260.381 2.456 10 10 CECE CN(CC1CCSCC1)C(=O)c1cccc(O)c1O 718117927 KEILIMCXDDLBRP-UHFFFAOYSA-N 281.377 2.313 10 10 CECE CC(C)N(CC(F)F)C(=O)[C@H]1CNc2ccccc2N1 386383174 IOYBXLIKDFMXFY-GFCCVEGCSA-N 283.322 2.395 10 10 CECE CNCc1ccc(N2C[C@H]3C[C@H]2CO3)cc1Br 387353499 YTPFZSUITDQEDX-NWDGAFQWSA-N 297.196 2.146 10 10 CECE CSC[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 388958537 SAHBKTXFSDYKFD-ZDUSSCGKSA-N 278.421 2.413 10 10 CECE C[C@H](CNCc1cccc(O)c1O)[C@@H]1CCCO1 720593094 VXFWJUPYZPSLKF-MFKMUULPSA-N 251.326 2.003 10 10 CECE C[C@H]1C[C@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])C[C@@H](C)O1 724374769 JEORIXVQCVLHPM-USZNOCQGSA-N 266.345 2.491 10 10 CECE 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251.301 2.384 10 10 CECE CN(Cc1cc(F)cc(F)c1O)[C@]1(C)CCOC1 2055449420 SGMDSHZAGZDSPK-CYBMUJFWSA-N 257.280 2.281 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C(=O)[C@H]1C[C@H]1F 2055522315 SXDIHPVIKNQLFZ-QWHCGFSZSA-N 250.317 2.364 10 10 CECE C[C@@H](N=c1[nH]ccnc1Cl)c1ccc(O)cc1O 2057936317 ZKGYVASSFQVJBK-SSDOTTSWSA-N 265.700 2.136 10 10 CECE CN(C[C@@H]1OCC[C@H]1F)c1ccc(CO)cc1Cl 2058685357 WBWKNVYOLNJSTC-YPMHNXCESA-N 273.735 2.396 10 10 CECE CCC(CC)NC(=O)CN1CCC[C@@H]1CN=[N+]=[N-] 2059057952 FNJGQYCKDOTJEG-LLVKDONJSA-N 253.350 2.066 10 10 CECE CNCc1ccc(OC[C@@H]2OCCOC2(C)C)c(C)c1 2186966225 ZKDQNDGYRQXRAY-HNNXBMFYSA-N 279.380 2.287 10 10 CECE CNCc1cc(F)c(N2CC[C@@H](O)[C@@H]2C2CC2)c(F)c1 2187154510 LPGQJMFAOOJBNU-KGLIPLIRSA-N 282.334 2.034 10 10 CECE C[C@@H]1CC[C@H](CN(C)Cc2cc3c(cc2O)OCO3)O1 2196193242 DJIIVXHQFVINHA-ZYHUDNBSSA-N 279.336 2.120 10 10 CECE CN(Cc1ccccc1O)C[C@@]1(F)CC[C@@H](C(=O)O)C1 2192598211 NBWARIZHERLAJQ-IAQYHMDHSA-N 281.327 2.417 10 10 CECE CN[C@H]1CCCc2cc(N3[C@H]4C[C@@H]3CN(C)C4)ccc21 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270.323 2.448 10 10 CECE CCOCc1cc(CN[C@H]2C[C@@](C)(O)C2)ccc1OC 841892460 ZFXYWPWYWFRYTI-FZNQNYSPSA-N 279.380 2.235 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)/C(C)=C\CN 692431491 MYNRZOLTLKUXKD-RAXLEYEMSA-N 275.396 2.006 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC2(COC2)C1 697099780 XXDVRMGZIRMLLE-UHFFFAOYSA-N 260.381 2.330 10 10 CECE Cc1ccc(O)c(CNc2ncc3c(n2)CCOC3)c1 865294805 UIKGTPLHOQANHX-UHFFFAOYSA-N 271.320 2.175 10 10 CECE C[C@@H]1O[C@H](C)[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1C 863003478 UKLJYUCDDHFTJD-OQWKHYAHSA-N 291.347 2.039 10 10 CECE O=C(c1ccn(CC(F)F)n1)N1Cc2cccc(O)c2C1 871204828 PPUTVJQKSAVQEE-UHFFFAOYSA-N 293.273 2.010 10 10 CECE Cc1ccc(CN[C@@H]2CCCCC23OCCO3)c(O)c1 1561046607 RXNGRHZMZRGNOH-OAHLLOKOSA-N 277.364 2.476 10 10 CECE CN(Cc1ncc[nH]1)Cc1ccc(F)c(F)c1O 894587072 OXROEDWURHHGJF-UHFFFAOYSA-N 253.252 2.026 10 10 CECE C[C@H]1[C@@H](C)N(C)CC[C@]1(O)c1ccc(N(C)C)cc1 1879334191 RBUDBRAABYFVAZ-WOSRLPQWSA-N 262.397 2.300 10 10 CECE C[C@@H](N)c1cc(F)c(N(CCO)CC2CC2)c(F)c1 1880927990 OOYAKOJTCGDPPM-SECBINFHSA-N 270.323 2.193 10 10 CECE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@H](O)C(C)(C)O 1307423189 CVEHHIDZUJGSLH-INIZCTEOSA-N 294.439 2.095 10 10 CECE C[C@H](N[C@H](C)[C@@H](O)C(F)(F)F)c1c(O)cccc1O 1889505561 PSQUMYKGRCHURW-MVKOHCKWSA-N 279.258 2.060 10 10 CECE Cc1cccc(CNC[C@]2(O)C[C@H]3CCC[C@H]32)c1O 1890983199 DCNJUNIYLBVFSN-XNRPHZJLSA-N 261.365 2.341 10 10 CECE CC[C@H](N)c1ccc(N(CC)CC2CN(C)C2)cc1 692203881 VBMBIMYHBLBWIN-INIZCTEOSA-N 261.413 2.484 10 10 CECE COc1cccc(CNCc2cccc(O)c2O)c1 41117683 ZLZJUETVIDOVLM-UHFFFAOYSA-N 259.305 2.396 10 10 CECE COc1ccc(N2CCN[C@H](C(C)C)C2)cc1F 83393298 VTPGHGWPKMBIIP-ZDUSSCGKSA-N 252.333 2.269 10 10 CECE C/C=C/C=C/c1nnc([C@@H](N)c2ccc(O)c(O)c2)o1 83537668 GSVWSNWRMAKAMJ-VGOFJFCRSA-N 273.292 2.118 10 10 CECE c1ccc(CNCc2ccc(N3CCCNCC3)cc2)nc1 84846295 YMQVBAAORXWROI-UHFFFAOYSA-N 296.418 2.171 10 10 CECE CN(C)c1ccc([C@@H](N)[C@](O)(C(F)F)C2CC2)cc1 1893272080 AUBURPIVOYSILC-OCCSQVGLSA-N 270.323 2.159 10 10 CECE O=C(NCc1c(O)cccc1O)c1ccc(Cl)cc1O 1178911066 KDUXHYDLLDMCCL-UHFFFAOYSA-N 293.706 2.387 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@H]3CNC[C@@]3(C)C2)c1 703613089 AGTUUTKKYPRHLG-ZENOOKHLSA-N 260.381 2.303 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])C1(C(C)C)CC1 687553641 DPGAKYJTOCFKDV-JTQLQIEISA-N 254.334 2.254 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2COC[C@H]2C)c(F)c1 688230293 YAMPJOAVVYGJAY-BFVZDQMLSA-N 252.333 2.317 10 10 CECE C[C@H]1CC[C@H](N(C)C(=O)c2ccc(O)c(O)c2)CS1 689540237 DSNJZVAWVGDCTB-ONGXEEELSA-N 281.377 2.454 10 10 CECE NCc1ccc(N2CC[C@@H]3COC[C@H]3C2)c(Cl)c1 690278813 BZZOUQKRGGJCSE-VXGBXAGGSA-N 266.772 2.271 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)COc1ccccc1 691689327 MFRXVYZXDUKPGB-NSHDSACASA-N 260.297 2.367 10 10 CECE Cc1cc(N2CCS[C@H](CO)C2)ccc1CNC1CC1 719991623 GAOGSQQVFHWRRG-INIZCTEOSA-N 292.448 2.161 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)NC1CC2(C1)CC2(F)F 1331264969 OERNPTSMOOWIJR-DUXPYHPUSA-N 295.285 2.415 10 10 CECE O=C(NCc1c(O)cccc1F)N[C@H]1C=CCCC1 1333498288 PDCYWAQJRNNOED-JTQLQIEISA-N 264.300 2.439 10 10 CECE CN1CCc2cc([C@@H](CN)N(C)[C@H]3CCSC3)ccc21 250375638 KLBPPNQYPLCDBY-GOEBONIOSA-N 291.464 2.116 10 10 CECE C[C@H](NCC1(N(C)C)CCC1)c1ccc(O)cc1O 97928356 UCBPSBAQGRDUQX-NSHDSACASA-N 264.369 2.233 10 10 CECE Cc1cc(NC(=O)c2ccc(N=NC(N)=O)cc2)n[nH]1 1291729776 NRWLAAPEOOQOKN-UHFFFAOYSA-N 272.268 2.133 10 10 CECE O[C@@H](c1ccc(N2CCCCC2)cc1)[C@@H]1C=CCN1 2120520603 LWWJFFIGHUVUDM-HOTGVXAUSA-N 258.365 2.238 10 10 CECE COc1cc(Cl)cc(CNC[C@@H]2OCC[C@@H]2F)c1O 2122526397 RVQTVAPBQIKZCY-JQWIXIFHSA-N 289.734 2.271 10 10 CECE CO[C@H](C)c1noc(CN2CCC[C@@H]2CN=[N+]=[N-])n1 2123021524 VHESRXVUYPKWEJ-RKDXNWHRSA-N 266.305 2.052 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCCCN1CCCC1=O 2123020368 VCZHQCKPFWYLMS-LBPRGKRZSA-N 265.361 2.164 10 10 CECE COC(=O)c1cnc(SCC(=O)c2ccoc2)s1 1559416663 RWDUUDYLZPTSPY-UHFFFAOYSA-N 283.330 2.498 10 10 CECE CC(C)c1ncc(NC(=O)Cc2ccc(O)c(O)c2)cn1 1556372381 CLFBCKRIJSNKML-UHFFFAOYSA-N 287.319 2.192 10 10 CECE CN(C(=O)C=Cc1cccnc1)c1cccc(O)c1 1911994922 ZTXROLCEFZGELH-UHFFFAOYSA-N 254.289 2.463 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccc(Cl)o1 1643101144 WPCFXIUPUGSCCU-UHFFFAOYSA-N 267.668 2.274 10 10 CECE C[C@@H](C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1)n1cccn1 1912148146 PVJCMSJUYZWBMQ-RYUDHWBXSA-N 276.344 2.383 10 10 CECE Cc1nc(C)c(C(=O)N2CCC(CN=[N+]=[N-])CC2)o1 1912173787 QSLWYQPTBSWYDI-UHFFFAOYSA-N 263.301 2.454 10 10 CECE CCN(C)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1 1642532327 ZZVCCVOKNMHKRO-CZUORRHYSA-N 262.397 2.345 10 10 CECE Nc1ccc(CCC(=O)N[C@H]2C(F)(F)C23CC3)cc1 2125995534 QRJFOCYCENFUFX-GFCCVEGCSA-N 266.291 2.115 10 10 CECE O=C(NCc1cc(Cl)ccc1O)c1csc(O)n1 1583820531 FTVCDIPBFDSDJO-UHFFFAOYSA-N 284.724 2.138 10 10 CECE NCc1ccc(N2CCN3CCCC[C@H]3C2)c(Cl)c1 250893950 OBLYPAWGVRXAQZ-ZDUSSCGKSA-N 279.815 2.473 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@@H]3O)C[C@H]1O 2128275782 WRFXFYWCGJXLFY-XFBWCDHKSA-N 261.365 2.263 10 10 CECE CN[C@@H]1CCCc2cc(N(CCO)C(C)C)ccc21 2128279225 NCCSXJAAEGYKKH-MRXNPFEDSA-N 262.397 2.491 10 10 CECE CC(=O)NC1=NC(=O)/C(=C\c2ccc(O)c(Cl)c2)S1 5850905 IXGRVDBNCNWQQF-BJMVGYQFSA-N 296.735 2.152 10 10 CECE C[C@@H]1CC[C@@H](CO)CN1c1ccc2c(c1)CC[C@H]2N 2128314798 KNWWSWNXBTZKDH-XHBSWPGZSA-N 260.381 2.230 10 10 CECE OCCCN(c1ccc2c(c1)CC[C@@H]2O)C1CCC1 2128321703 MIYCFQROOKUSGB-INIZCTEOSA-N 261.365 2.408 10 10 CECE CC(=O)N1CCN(/N=N/c2cc([N+](=O)[O-])ccc2C)CC1 1860483798 JTIJMJQSIQUYOR-CCEZHUSRSA-N 291.311 2.066 10 10 CECE CC[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@H](C)O[C@@H](C)C1 251224196 OCTHTOQSPNNKRW-SLEUVZQESA-N 291.395 2.095 10 10 CECE COc1ccc(OC)c(CC(=O)C(=O)C(C)(C)C)c1 258575034 LQXHSHHBWNRFDS-UHFFFAOYSA-N 264.321 2.431 10 10 CECE COCc1nc([C@H](O)c2ccc(N(C)C)cc2)cs1 2132264898 LLSJCASZBQBYPB-CQSZACIVSA-N 278.377 2.437 10 10 CECE C[C@H](NC(=O)[C@H]1C[C@@H](C)O[C@@H]1C)c1ccccc1O 827957695 XOXZRQJIBFEUGV-XZUYRWCXSA-N 263.337 2.383 10 10 CECE CO[C@H]1CC[C@H](C(=O)N(C)Cc2ccccc2O)C1 830141458 ULRSRQHKPAEBDZ-AAEUAGOBSA-N 263.337 2.166 10 10 CECE CO[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1(C)C 1914327797 PMDWRDOSBZBXQK-CQSZACIVSA-N 279.336 2.120 10 10 CECE Nc1ccc(-n2nnnc2/C=C/c2ccccc2)cc1 1857876728 OVKGGNBYIBNLEO-IZZDOVSWSA-N 263.304 2.415 10 10 CECE NCc1ccc2c(c1)CCN2CC1(CO)CCCC1 2133390059 QAWZCPSMZSYJLF-UHFFFAOYSA-N 260.381 2.061 10 10 CECE CCCOc1cc(N2CCN(CC)CC2)ccc1N 111045755 KJERPUJDPKSBOR-UHFFFAOYSA-N 263.385 2.200 10 10 CECE Nc1cc2c(cc1N1CCCCC13CC3)NC(=O)CO2 1915789905 QAURTJGWGHNCCA-UHFFFAOYSA-N 273.336 2.123 10 10 CECE CN[C@H](C)c1cnc(SCCC2(O)CC2)s1 1902781387 YFYZJDLTRWGAOH-MRVPVSSYSA-N 258.412 2.431 10 10 CECE CCNC(=N)NCc1ccc(C)c(Br)c1O 1905127262 WUFGESTUPBOMLC-UHFFFAOYSA-N 286.173 2.097 10 10 CECE COC[C@@H]1CCCCN1c1ccc(CN)c(OC)c1 2139701117 SBQOFWFADDNPFT-AWEZNQCLSA-N 264.369 2.159 10 10 CECE CC(=O)NCC1CCN(c2ccc(CN)c(Cl)c2)CC1 226299773 BCHRBEWTYVQSDP-UHFFFAOYSA-N 295.814 2.151 10 10 CECE Cc1ccc(O)c(CN2C[C@H](C(=O)O)C3(CCC3)C2)c1 1968122223 STAMZBGZAXWYNW-CYBMUJFWSA-N 275.348 2.387 10 10 CECE CCC[C@H](C(=O)O)[C@H](N)c1ccc2c(c1)CCN2C 1927629595 QCAHYCGZFOSHPS-GXTWGEPZSA-N 262.353 2.180 10 10 CECE C[C@H](NC(=O)[C@H]1CNc2ccccc2N1)C(C)(C)C 229884785 PWWZAIHKLSHIBC-GXFFZTMASA-N 261.369 2.443 10 10 CECE COc1cccc(O)c1CNCC1C[C@@H]2CC[C@H](C1)O2 1970029430 PHLOAHHLZKBECK-YHWZYXNKSA-N 277.364 2.448 10 10 CECE CNC(=O)CN(Cc1ccccc1)c1ccc(CO)c(C)c1 1932042563 VHCADSFMNAYJKP-UHFFFAOYSA-N 298.386 2.240 10 10 CECE CCC[C@@H]1C[C@@H]1NC(=O)CCOc1ccc(N)cc1 233302386 KTZVGYXOWAQASA-RISCZKNCSA-N 262.353 2.343 10 10 CECE CCCc1nc(-c2ccc(O)c(O)c2)ncc1C(=O)O 233368860 PFWUCPWIFMTBEZ-UHFFFAOYSA-N 274.276 2.206 10 10 CECE CC1([C@H]2CCCCN2c2ccc(N)cc2)OCCO1 1936660168 FRNYFIIFIHUJEF-CQSZACIVSA-N 262.353 2.391 10 10 CECE Cc1cnc(CNCc2ccc(Cl)cc2O)[nH]1 1942495206 RXDLTYGTVJZYRQ-UHFFFAOYSA-N 251.717 2.367 10 10 CECE C[C@@H]1C(S(=O)(=O)Nc2ccc(O)cc2Cl)[C@H]1C 1945737820 INYCIPGZMZNAOU-BQBZGAKWSA-N 275.757 2.442 10 10 CECE CCN[C@H](CSc1nccs1)c1ccnn1C 1946096434 WHKIVZPIXUEOOP-SECBINFHSA-N 268.411 2.320 10 10 CECE CCN(CC)c1ccc([C@@H](O)CC(=O)OC)cc1 1951590881 OMAACVDNIXLYFF-ZDUSSCGKSA-N 251.326 2.129 10 10 CECE CC(C)(C)OC(=O)N[C@@](C)(C(=O)O)c1cccc(F)c1O 1951726755 CTHPPLWOQUXEPI-CQSZACIVSA-N 299.298 2.356 10 10 CECE CN(C)c1ccc([C@@H]2NCCCC[C@@H]2O)cc1F 1952044844 RDIZQDJMCUMGDT-KBPBESRZSA-N 252.333 2.067 10 10 CECE COc1ccc(O)c(CNCC[C@H]2CCO[C@@H]2C)c1 1972154952 GJSRMBZONOPSBL-NEPJUHHUSA-N 265.353 2.306 10 10 CECE CCc1cccc(CNC[C@H]2C[C@]23CCOC3)c1O 1974223837 LIPOWQAIWNGHKJ-ZBFHGGJFSA-N 261.365 2.471 10 10 CECE CO[C@@H]1C[C@@H]1CNCc1c(O)cccc1Br 1987749577 GGLLGSVSYWCANX-PRHODGIISA-N 286.169 2.279 10 10 CECE COC(=O)CCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 36891727 KZPKLNKXIDJKMV-WDEREUQCSA-N 263.337 2.402 10 10 CECE Nc1ccc(NS(=O)(=O)c2cc(F)ccc2F)cc1 37377222 JEGGMTBJZDUYLJ-UHFFFAOYSA-N 284.287 2.348 10 10 CECE NN[C@@H](c1ccccc1O)c1cccc2cccnc12 2146239595 GTBVWVSGQDWENX-INIZCTEOSA-N 265.316 2.493 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC[C@H](C(=O)O)CC1 2146580609 SFZMZOWWXVWJHI-MNOVXSKESA-N 279.336 2.346 10 10 CECE CN(C)c1ncc(COC(=O)Cc2ccc(N)cc2)s1 2149537375 ZRCWMAAGXOXMIS-UHFFFAOYSA-N 291.376 2.077 10 10 CECE CCN[C@@H](c1ccccc1O)C1(O)CC(CCOC)C1 2152403251 KKIGSODLYCPENC-NRAUKZCXSA-N 279.380 2.220 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[C@H]2NCCC[C@@H]2C1 2153083769 YRRXDXBRLGGCLE-JHJVBQTASA-N 276.380 2.233 10 10 CECE CCn1cncc1CN(C)c1c(F)cc(CO)cc1F 2153015504 SHPHKILEDHVAHQ-UHFFFAOYSA-N 281.306 2.310 10 10 CECE C[C@@H]1[C@@H](CN(C)c2ccc([N+](=O)[O-])c(CO)c2)C1(F)F 2153622721 BFRMLVAOXRQVCE-LDYMZIIASA-N 286.278 2.425 10 10 CECE C[C@H](O)c1cnc(Sc2ncc3n2CCC3)s1 2007883211 FMCKZRKBLBYHFK-ZETCQYMHSA-N 267.379 2.490 10 10 CECE Oc1c(CN2CCN3CCCC[C@H]2C3)ccc(F)c1F 2154255306 XADHMEAWMKJFIT-LBPRGKRZSA-N 282.334 2.341 10 10 CECE CCc1cccc(CNC[C@@H]2C[C@@H](OC)CCO2)c1O 2154202190 VUGIDJYVLQAVTM-GJZGRUSLSA-N 279.380 2.238 10 10 CECE CN(CCc1ccc(N)cc1)CC12CCCN1CCC2 2154958125 HTXYJZUCRNUXTP-UHFFFAOYSA-N 273.424 2.372 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H](C)C(N)[C@@H](C)C2)c1 2155547671 FLGNVGQDDUMJBB-SRVKXCTJSA-N 278.396 2.377 10 10 CECE Oc1cccc(CN[C@H](CF)C(F)(F)F)c1O 2012902732 PAILGAXASOAVNU-MRVPVSSYSA-N 253.195 2.088 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H](N)C[C@@]12CCCOC2 2156302860 XOVJDESFXAVVGI-DVOMOZLQSA-N 276.380 2.035 10 10 CECE COc1ccc([C@H](C)NC2CCC(N)CC2)c(O)c1 51693084 QGFPAWJEXKKTLH-UNXYVOJBSA-N 264.369 2.321 10 10 CECE CN(C[C@@]1(C)CSCCO1)c1ccc(N)cc1 2023101651 CLKUCAGSZAIKCR-ZDUSSCGKSA-N 252.383 2.227 10 10 CECE CC(C)NCc1cc(F)c(N2CC(C)(CO)C2)c(F)c1 2157295239 HUXGIBJQPKSQAU-UHFFFAOYSA-N 284.350 2.281 10 10 CECE O=S(=O)(Nc1ccc(O)cc1)[C@@H]1[C@H]2CCCC[C@H]21 2033545134 CDQVEKLODVEVOQ-ITGUQSILSA-N 267.350 2.323 10 10 CECE CN(C)C[C@@H]1CCCN1CCCOc1ccc(N)cc1 61641796 UJXMMLUFMUANFJ-HNNXBMFYSA-N 277.412 2.064 10 10 CECE C[C@H](NC[C@@H]1CCO[C@H]1C)c1ccc(O)cc1O 300613027 SIGCHEJCMIOYBM-DCAQKATOSA-N 251.326 2.173 10 10 CECE CC1(C)CC[C@@H](O)CN1c1ccc(CN)c(F)c1 2038526430 XZMMEHSBICIETE-GFCCVEGCSA-N 252.333 2.024 10 10 CECE CCOC(=O)c1cnc(SC(C)(C)CO)s1 311081789 ONQJLUINEYTTIE-UHFFFAOYSA-N 261.368 2.183 10 10 CECE NC(=O)Cc1ccc(NCc2c(O)cccc2F)cc1 2160785936 JGGTUVKFTFUSQE-UHFFFAOYSA-N 274.295 2.171 10 10 CECE CCNCc1ccc(N(C)[C@H]2CN3CC[C@H]2C3)c(F)c1 2158738203 XRJAXZLHTMLYSF-BBRMVZONSA-N 277.387 2.076 10 10 CECE Cn1ccc(-c2cc(F)cc(Cl)c2N)cc1=O 314867238 CLRVNWPCPKTPJB-UHFFFAOYSA-N 252.676 2.427 10 10 CECE OC[C@@H]1CC(F)(F)CN1c1ccc(CNC2CC2)cc1 2159051992 MSXLXJSCSFQCKZ-AWEZNQCLSA-N 282.334 2.145 10 10 CECE CC[C@H]1CNCCCN1c1ccc(OC)cc1[N+](=O)[O-] 2159119913 ZXKAEEQZIUTCDC-NSHDSACASA-N 279.340 2.182 10 10 CECE C[C@@H]1CN[C@H]([C@@H](O)c2ccc3c(c2)CCN3C)[C@@H](C)C1 2163069003 OCAATBPPZVRXQF-SYWGBEHUSA-N 274.408 2.346 10 10 CECE COC[C@@H]1CN([C@@H](C)c2cc(Cl)ccc2O)CCO1 705842628 LCUOYESWXBCQAF-JQWIXIFHSA-N 285.771 2.454 10 10 CECE CN1C[C@]2(C)CN(Cc3cc(F)ccc3O)C[C@@]2(C)C1 707149971 KDUQRPOKXQELGX-HZPDHXFCSA-N 278.371 2.305 10 10 CECE CCC1(O)CCN(c2ccc([C@@H](C)N)c(O)c2)CC1 707228558 SHPCFWQWDPVSLN-LLVKDONJSA-N 264.369 2.153 10 10 CECE C[C@@]1(C(=O)O)CCCCN1Cc1cc(F)cc(F)c1O 708089436 MGFOVLWSFQWUOD-AWEZNQCLSA-N 285.290 2.500 10 10 CECE CNC1(c2cncn2Cc2ccc(N(C)C)cc2)CC1 2163958111 CTMSBXIHNHJHQI-UHFFFAOYSA-N 270.380 2.206 10 10 CECE C[C@@H](NCCO[C@H]1CC1(F)F)c1cc(O)ccc1O 709236262 NRSMEKGGSLJSBF-PELKAZGASA-N 273.279 2.173 10 10 CECE C[C@]1(CO)CCCN(c2ccc(CO)c(Cl)c2)C1 688045652 XGMCDWMPPZMYHG-AWEZNQCLSA-N 269.772 2.431 10 10 CECE CC[C@H](O)c1ccc(N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1 710170536 GFHGJIIJCXBSLT-FWYOQMDTSA-N 261.365 2.480 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2C[C@H]1CCN(C)C1 691405787 ZWFLUNFQMOCQPU-KBPBESRZSA-N 273.424 2.281 10 10 CECE C[C@@H]1O[C@H](C)[C@H](C(=O)N2CCC[C@H]2CN=[N+]=[N-])[C@@H]1C 692822155 IPMVDICFVDQWNF-CSYMLDBXSA-N 266.345 2.347 10 10 CECE CCc1cccc(CN[C@@H]2CCCC[C@@H]2C(N)=O)c1O 2174106845 KDWJLXNNBMDVOP-UONOGXRCSA-N 276.380 2.088 10 10 CECE Cc1cccc(O)c1CN(C)[C@@H]1CO[C@]2(CCOC2)C1 2179005503 NYXODTUBGAOVEU-XJKSGUPXSA-N 277.364 2.080 10 10 CECE COc1cc(Cl)cc(CNC[C@H](C)CN(C)C)c1O 388905779 MAYJFJDGZXLTOG-JTQLQIEISA-N 286.803 2.342 10 10 CECE C[C@@H](NCc1ncc(Cl)n1C)c1c(O)cccc1O 393317992 YHDCNQJAEPNVSS-MRVPVSSYSA-N 281.743 2.336 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H]2OCC[C@H]2F)cc1O 2179111878 UVPDYWHELWDPFM-WDBKCZKBSA-N 282.359 2.236 10 10 CECE CC[C@H](N)c1ccc(N(C)[C@H](C)C[S@](C)=O)cc1 398880351 HFLLBIGCIOFLGM-VZSAFFHGSA-N 268.426 2.300 10 10 CECE Cn1cc(-c2cc(COc3ccc(N)cc3)on2)cn1 2179342249 YOPFXMHUNYXTRI-UHFFFAOYSA-N 270.292 2.236 10 10 CECE CC[C@]12C[C@H]1CN([C@H](CN)c1ccc(N(C)C)cc1)C2 2167531409 HYSIROXWEBKHHZ-USXIJHARSA-N 273.424 2.484 10 10 CECE CCOC(=O)[C@](C)(NCCCN=[N+]=[N-])[C@@H]1CCCOC1 2168405934 SEBGASXZNARNIR-DGCLKSJQSA-N 284.360 2.025 10 10 CECE COc1ccc(N2CCN(Cc3ccsn3)CC2)cc1 2169108228 JQVOFNLPPCIGQU-UHFFFAOYSA-N 289.404 2.474 10 10 CECE CC(C)NCc1ccc(N2CC[C@H]3C[C@@]3(O)C2)c(F)c1 2171005348 PTUUKDUHDPYRKK-XJKSGUPXSA-N 278.371 2.285 10 10 CECE CCOC(=O)c1c(C(C)C)nn2c(O)cc(C)nc12 2080849898 FAPUCSABBXFDDS-UHFFFAOYSA-N 263.297 2.043 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H]3[C@H]2C(C)(C)[C@@H]3O)c(F)c1 2178162011 YAVVOGCUMBEGOS-PBUVFVDJSA-N 279.355 2.475 10 10 CECE Nc1ccc(NC(=O)O[C@H]2C[C@H](n3ccnc3)C2)cc1 2183688669 FPKLHKUNJDJQDX-JOCQHMNTSA-N 272.308 2.418 10 10 CECE FC(F)(F)COc1ccc(N2C[C@@H]3CNC[C@@H]3C2)cc1 2194303173 SZKWHROQRBLBQR-PHIMTYICSA-N 286.297 2.283 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@H]3C[C@H](O)C[C@H]3C2)c(F)c1 2194515178 YUEUTWZKASPQJC-YJQGPUDQSA-N 283.318 2.225 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](O)[C@H]3CC[C@H]32)cc1O 2190253299 SEYHZLRJGCPSOQ-KAOXEZKKSA-N 276.380 2.022 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CC(CF)(OC)C2)c(F)c1 2194690950 PNYVQNHGJZZSJZ-VIFPVBQESA-N 288.313 2.420 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@H](OC)[C@H](F)C2)c(F)c1 2194699667 JXEDZKAEMTUURR-WQHBLYJGSA-N 288.313 2.418 10 10 CECE CN(Cc1cncnc1)c1ccc2c(c1)CCC[C@@H]2N 2184686620 JCGBMCVICQZNPM-INIZCTEOSA-N 268.364 2.449 10 10 CECE CN1CC[C@]2(CCN(c3ccc4c(c3)CC[C@H]4N)C2)C1 2184724671 CMQRIUKGPABCLB-SJORKVTESA-N 271.408 2.165 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](CO)C[C@@H]3C)ccc21 2184711377 QQNVPZAHNDQBPY-GDZNZVCISA-N 274.408 2.491 10 10 CECE CO[C@@H]1CCN(c2ccc([C@@H](C)N)c(O)c2)[C@H]1C1CC1 2195394837 IVAZYRHHXNLNJT-GTTSAUCSSA-N 276.380 2.416 10 10 CECE CCCCNC(=O)CN(C)Cc1ccc(N(C)C)cc1 2195483966 BRKKKHTZYJXZLN-UHFFFAOYSA-N 277.412 2.101 10 10 CECE C[C@H](N)c1ccc(N2CCCC(C)(C)[C@H]2CO)cc1O 2185811237 LBYHCBASKYHFKR-XHDPSFHLSA-N 278.396 2.399 10 10 CECE CCOC(=O)[C@@H](NC(C)C)c1c(O)cccc1F 2042596786 GFRUDEHXZKLVAN-LBPRGKRZSA-N 255.289 2.134 10 10 CECE CC[C@H](CNCc1c(O)cccc1OC)COC 2042580762 HFIJVUFQRRQSJC-LLVKDONJSA-N 253.342 2.163 10 10 CECE CCCC[C@H](C(=O)O)N(C)c1ccc(CN)cc1 2044358628 DBHGXVSWFBGCGI-CYBMUJFWSA-N 250.342 2.225 10 10 CECE COC(=O)NC[C@H]1CCN1c1ccc([C@@H](C)O)cc1Cl 2187289342 QLINIBCOIOILFM-MWLCHTKSSA-N 298.770 2.328 10 10 CECE Cc1cccc(O)c1CNC[C@H]1C[C@](O)(C(F)(F)F)C1 2188163482 JQHODWIXINBIAF-GSJFWJNXSA-N 289.297 2.494 10 10 CECE CN[C@H](C)c1ccc(N2CCN(C)C3(CC3)C2)c(F)c1 2188418506 LJOFUKIZEIUSAW-GFCCVEGCSA-N 277.387 2.391 10 10 CECE C[C@@H](O)c1ccc(N2C[C@H]3COCC[C@H]32)c(F)c1 2073008496 MJGGSFKUVSHIKC-SUZMYJTESA-N 251.301 2.104 10 10 CECE COC[C@H](C)N(C)c1c(F)cc([C@@H](C)N)cc1F 2074207840 GYRUKCVPPQZKAM-DTWKUNHWSA-N 258.312 2.456 10 10 CECE CN(CCCC(F)F)C(=O)COc1ccc(N)cc1 2110268979 WNDJXEWXSATYDG-UHFFFAOYSA-N 272.295 2.151 10 10 CECE CCCOC[C@@H]1CCCN1Cc1cc(N)ccc1O 2102730044 YYCAKMVJVFNRAI-AWEZNQCLSA-N 264.369 2.365 10 10 CECE OCc1ccc(N2C[C@@H]3CCC[C@@]3(CO)C2)cc1Cl 2103171175 YCQNTZDAMOQJQZ-WFASDCNBSA-N 281.783 2.431 10 10 CECE CC(=O)c1ccc(O)c(CN2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1 2103204263 ZQZOJIYENDGXRK-NGFQHRJXSA-N 257.333 2.435 10 10 CECE Cc1nc([C@H]2CCN2c2ccc([C@@H](C)O)cc2)no1 2104173087 FLARVKNSDKFBIR-NOZJJQNGSA-N 259.309 2.383 10 10 CECE C[C@H](N)[C@@H]1CCCCN1Cc1ccc(F)cc1O 2084079034 IZFDFJRDDMYRJL-GWCFXTLKSA-N 252.333 2.233 10 10 CECE O=C1Nc2cc(N(C3CC3)C3CC3)c(Cl)cc2[C@@H]1O 2105015887 COZIGJATKYFIKW-ZDUSSCGKSA-N 278.739 2.457 10 10 CECE CCN[C@H](Cn1ccnc1)c1ccc(N(C)C)cc1 2106797794 DWMCWEGDHGTWPD-OAHLLOKOSA-N 258.369 2.300 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3[C@H](N)C3(C)C)ccc21 2106826477 SZDUJZHRXJYVEM-ILXRZTDVSA-N 260.381 2.086 10 10 CECE COC[C@H](C)N(C)c1ccc(OCCN(C)C)cc1 2087131662 JTEVTCSDIQLQOV-ZDUSSCGKSA-N 266.385 2.098 10 10 CECE CN(C)C(=O)CCCN(C)c1ccc(CN)c(Cl)c1 2087404686 IOHHZRYWLAGQER-UHFFFAOYSA-N 283.803 2.103 10 10 CECE CC(C)[C@H]1C[C@H]1NC(=O)CCOc1ccc(N)cc1 2088859749 YDMYCZTZZDPPBM-ZIAGYGMSSA-N 262.353 2.198 10 10 CECE CCCN(Cc1ccc(N)cc1)Cc1cccnn1 2089616472 CQSJYBHZEGWFEE-UHFFFAOYSA-N 256.353 2.471 10 10 CECE O=C(O)[C@@H]1[C@H]2CCN(Cc3ccc(Cl)cc3O)C[C@@H]21 2090123036 YTZKQAMKOXRNGN-GMXVVIOVSA-N 281.739 2.198 10 10 CECE C[C@H]1CC[C@@H](CO)N(c2ccc(CN)c(F)c2F)C1 2110600089 SCBLMESIYQCITR-ONGXEEELSA-N 270.323 2.021 10 10 CECE CN[C@H](c1ccccc1O)[C@](C)(O)C1CC(F)(F)C1 2091869641 ZOLRSTLQXDSEBT-CHWSQXEVSA-N 271.307 2.449 10 10 CECE CN(CCO[C@@H]1CCCCO1)Cc1ccc(N)cc1 2092477938 JTRWMNQXMLEKBD-OAHLLOKOSA-N 264.369 2.244 10 10 CECE CC(C)[C@@H](CCNCc1cccc(O)c1O)N(C)C 2092790769 YCMOJKVZZLCZRB-CYBMUJFWSA-N 266.385 2.164 10 10 CECE C[C@@H]1COCC[C@@H]1N(C)c1c(F)cc(CN)cc1F 2092816886 LIVOPEGFBAESCE-RNCFNFMXSA-N 270.323 2.285 10 10 CECE CCCNCc1ccc(N2C[C@@H](O)C3(CC3)C2)cc1 2093341377 NXSZFEQYDMKEPJ-OAHLLOKOSA-N 260.381 2.147 10 10 CECE NCc1ccc(N2CCc3ccncc3C2)c(F)c1 2094409512 MILRNLAJCCDPEY-UHFFFAOYSA-N 257.312 2.242 10 10 CECE CN1C[C@@H]2CC[C@@H](N(C)Cc3ccc(N)cc3)[C@H]2C1 2095506747 LEXOAZYAKPKJOM-CWRNSKLLSA-N 259.397 2.041 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)COCC3)[C@@H](C)CN1 2096487134 CCJRQNOSXUCNFY-WFASDCNBSA-N 260.381 2.336 10 10 CECE Cc1cc(N2CCOC[C@@H](C3CC3)C2)ccc1CO 2096561110 QMJCZKGOHVOXMB-HNNXBMFYSA-N 261.365 2.350 10 10 CECE Nc1ccc(OCCC(=O)OCc2ccsn2)cc1 2097022422 NXTLDRMQQTXNHU-UHFFFAOYSA-N 278.333 2.238 10 10 CECE CN(Cc1cc(Cl)ccc1O)C[C@H]1COCCCO1 2097707580 NUPAXYONZIOELV-ZDUSSCGKSA-N 285.771 2.283 10 10 CECE CN1CCC[C@]1(C)CNCc1ccc(F)c(F)c1O 2098731681 HDIJKJHLTJOGIF-CQSZACIVSA-N 270.323 2.244 10 10 CECE C[C@H]1C[C@H](N(C)c2ccc(CO)cc2F)CCN1C 2114001200 DVLGDRQAGYTCJO-WCQYABFASA-N 266.360 2.237 10 10 CECE Cc1cccc(CN2CC[C@@H]3CN(C)CC[C@H]32)c1O 2114505120 UYUHWVKLXIWBNF-UKRRQHHQSA-N 260.381 2.227 10 10 CECE COc1cc(N2CCC[C@@]3(C)COC[C@H]23)ccc1CN 2204537687 FSRGSZVIZRRWPD-HOTGVXAUSA-N 276.380 2.159 10 10 CECE Cc1cccc(CNC(=O)c2ccnc(F)c2F)c1O 2204626110 QFXTYVXRWQHHTC-UHFFFAOYSA-N 278.258 2.304 10 10 CECE COC(=O)c1occc1CNCc1cccc(C)c1O 2204621831 JPUPAXNZSJENEA-UHFFFAOYSA-N 275.304 2.370 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2CCC3(CC3)CO2)cc1 2205211540 MAVFFXWXBHVNLU-ZDUSSCGKSA-N 275.352 2.350 10 10 CECE Cc1cc(N2C[C@H](CO)C3(CC3)C2)ccc1[C@@H](C)O 2269672551 GJSRTMNQKWOWCJ-CHWSQXEVSA-N 261.365 2.257 10 10 CECE CNCc1ccc(N2CC[C@H](OCCCO)C2)cc1Cl 2207080440 NGJWXDALRIYWJE-AWEZNQCLSA-N 298.814 2.037 10 10 CECE Cc1cccc(CN2C(=O)[C@]34CCC[C@@]3(C4)C2=O)c1O 2207207467 CPVWHGHHWWKVEI-HZPDHXFCSA-N 271.316 2.130 10 10 CECE CC[C@H](C)C[C@@](N)(CO)CN(C)c1ccc(OC)cc1 2207687893 JVTJUNAMOWDLIV-BBRMVZONSA-N 280.412 2.257 10 10 CECE OC[C@@H]1CC[C@H]1NCc1ccc(N2CCCC2)cc1 2208454363 UJAJLDDSFQWWCE-GOEBONIOSA-N 260.381 2.147 10 10 CECE CC(C)=CC[C@H](O)c1ccc(N2CCNCC2)cc1 2270556130 BNZWHZBRQAZJDH-INIZCTEOSA-N 260.381 2.486 10 10 CECE C[C@H](CS(=O)(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-])C1CC1 2218746378 QBXGZVKJJLUHON-MIMYLULJSA-N 272.374 2.183 10 10 CECE Cc1nc(CC(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])cs1 2218745437 QECIJLWELUXGDP-ZJUUUORDSA-N 265.342 2.342 10 10 CECE COc1ccc(N2CCC[C@@]2(C)CO)cc1OC 2219638139 LQRKUTRDERLGGP-AWEZNQCLSA-N 251.326 2.055 10 10 CECE COc1ccc(N2CCCC[C@@H](CO)C2)c(F)c1 2219607866 FPSROGOIQCSYGF-LLVKDONJSA-N 253.317 2.433 10 10 CECE COc1ccc(N2CC[C@H](N)[C@H](C)[C@@H]2C)c(F)c1 2220322175 QJNWVPIGQWEDII-NRUUGDAUSA-N 252.333 2.396 10 10 CECE C[C@H](CO)CC1CN(c2ccc([C@@H](C)N)cc2F)C1 2230643564 WDCSDALIPRONHY-WDEREUQCSA-N 266.360 2.300 10 10 CECE COCC1CN(c2ccc(CNC3CCC3)cc2)C1 2231451712 RQOIEMKBRMLUIJ-UHFFFAOYSA-N 260.381 2.411 10 10 CECE CCn1ncc(NC(=O)Cc2ccc(N)cc2)c1Cl 2231881320 NZQRMSGSFJCVRC-UHFFFAOYSA-N 278.743 2.320 10 10 CECE Cc1cc([C@H](C)N)ccc1N1C[C@H](O)[C@H](C2CC2)C1 2232093766 KGEVBONKPSMHLU-PJODQICGSA-N 260.381 2.222 10 10 CECE CCN[C@H]1CCc2cc(N3C[C@@H](O)C[C@H](F)C3)ccc21 2234670516 JHQDGWSSWIRQSC-NOLJZWGESA-N 278.371 2.193 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](O)C[C@H]3C2)c(Cl)c1 2224661755 RZAKGJAMMQANQL-SLEUVZQESA-N 280.799 2.267 10 10 CECE CCN1CCc2cc(N3CC[C@@H]4[C@H](O)C[C@H]4C3)ccc21 2235037713 JDUDBTRNPBZQNF-JLJPHGGASA-N 272.392 2.276 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2[C@H]2CC[C@H]3O2)c(C=O)c1 2235984059 SCOANZDWVNDANQ-QKPAOTATSA-N 273.332 2.406 10 10 CECE CCN(Cc1ccnn1C)c1ccc(OC)cc1C=O 2235995181 QFZACQCSTYMINX-UHFFFAOYSA-N 273.336 2.268 10 10 CECE COc1ccc(N(C)[C@@H]2CC[C@H](C)OC2)c(C(=O)O)c1 2235954299 BKORKBZZNPRWGY-WDEREUQCSA-N 279.336 2.397 10 10 CECE COc1ccc(N2CCCO[C@H]3CCC[C@H]32)c(CN)c1 2235963850 PONAUCCIUIDTTH-CVEARBPZSA-N 276.380 2.302 10 10 CECE CCOC[C@H]1CCN(c2ccc(OC)cc2CCN)C1 2235971093 XQDPDPVWIYOTRH-ZDUSSCGKSA-N 278.396 2.059 10 10 CECE 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299.212 2.337 10 10 CECE C[C@H]1CCN(Cc2cc(F)cc(F)c2O)C[C@@H]1CN 708494795 PKCNFJXRFMBWKZ-ONGXEEELSA-N 270.323 2.087 10 10 CECE CC1(C)CN(c2cc3c(cc2F)[C@@H](O)C(=O)N3)C1(C)C 708514410 SWZKNBNBXJLWBP-GFCCVEGCSA-N 278.327 2.436 10 10 CECE O[C@]1(c2ccc(N3CCCCC3)cc2)C[C@@H]2NCC[C@@H]21 2163098502 VWDQIKWHADTGBQ-ULQDDVLXSA-N 272.392 2.246 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](C)[C@H]2CO)cc1O 688640052 TWJLREFFAJTDDS-UHIISALHSA-N 264.369 2.009 10 10 CECE O[C@]1(c2ccc(N3CCCC3)cc2)CCN2CCC[C@H]21 2163111318 QJCXMWLYLPBJMY-IRXDYDNUSA-N 272.392 2.343 10 10 CECE NCc1ccc(N2CCC[C@@H]3COC[C@H]32)c(F)c1F 690291739 GXPULXBALYBBCB-ZYHUDNBSSA-N 268.307 2.039 10 10 CECE C[C@@H]1OCCN(CCCOc2ccc(N)cc2)[C@@H]1C 380446711 UPQJBYNHNFLJFG-OLZOCXBDSA-N 264.369 2.147 10 10 CECE Cc1ccc(C#N)c(=O)n1CCCc1ccc(N)cc1 380550719 XPIMPHPCWJUIRF-UHFFFAOYSA-N 267.332 2.243 10 10 CECE C[C@@]1(C(F)(F)F)CN(CCc2ccc(N)cc2)CCO1 712808304 HRDSDNFMJVEGQM-ZDUSSCGKSA-N 288.313 2.465 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@@H]3CC[C@H](N)[C@H]3C2)c1 382023566 PXIPSBZZHDACGF-JURCDPSOSA-N 260.381 2.431 10 10 CECE Cc1ccc(O)c(CN2CCC[C@@H](C(=O)O)[C@@H]2C)c1 384248221 KEJQDXCVUSUYEG-WCQYABFASA-N 263.337 2.386 10 10 CECE CNCc1ccc(N(C)C[C@H](C)COC)c(C)c1 385724404 NODVKHSLNDZXRI-LBPRGKRZSA-N 250.386 2.433 10 10 CECE C[C@H](N[C@@H](CO)C1CCCC1)c1cc(O)ccc1O 386236068 XVGPWALDDRXORV-HZMBPMFUSA-N 265.353 2.300 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3COC[C@H]3C2)c(Cl)c1 718235351 ORCOVGTZZSLHAM-YUSALJHKSA-N 266.772 2.442 10 10 CECE CC(C)N(CC(F)F)c1ccc2c(c1)NC(=O)[C@H]2N 386965333 VXOHEJVCKNOHEN-LBPRGKRZSA-N 269.295 2.118 10 10 CECE CCNCc1ccc(N2CCS[C@@H](CCO)C2)c(F)c1 720037812 JYIHBYDLTRSGPH-ZDUSSCGKSA-N 298.427 2.239 10 10 CECE CC(C)N1CC[C@H](N[C@@H](C)c2cc(O)ccc2O)C1 389195374 XACHMJFMGWYCFK-RYUDHWBXSA-N 264.369 2.231 10 10 CECE CN(CC1(C)CCC1)c1ccc2c(c1)N(C)C(=O)[C@H]2N 720867290 WYIDHBSHRZSKPX-AWEZNQCLSA-N 273.380 2.289 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)c1ccc(CN)cc1Cl 724135088 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CC[C@@H](N)c1ccc(N(CCS(C)(=O)=O)C(C)C)cc1 2170176715 YTIKEVFEDVTIPU-OAHLLOKOSA-N 298.452 2.356 10 10 CECE COC(=O)c1ccc(CN(C)c2ccc(N)cc2)cn1 2176655543 QPCGCLQNKDBSNT-UHFFFAOYSA-N 271.320 2.087 10 10 CECE CCNCc1ccc(N2CC[C@H]3CN(C)CC[C@H]32)cc1 2170936094 FTULPTBUIZJZFS-DOTOQJQBSA-N 273.424 2.327 10 10 CECE CC(C)[C@H]1CNC(=O)CN1c1ccc([C@@H](C)N)c(Cl)c1 2181163861 UTZMSUOZZCYMSK-QMTHXVAHSA-N 295.814 2.321 10 10 CECE CCOc1ccc(N2C[C@@H]3CCN[C@H]3C2)cc1OCC 2188886681 AGMCELMYRNURNZ-JSGCOSHPSA-N 276.380 2.282 10 10 CECE Cc1ccccc1N(C)C(=O)c1cc(O)c(O)c(O)c1 2188868574 SZLWZHXTUXPJEH-UHFFFAOYSA-N 273.288 2.388 10 10 CECE COc1cccc(CNCc2ccc(F)c(F)c2O)n1 2181836865 KSUZZCJPSUKXJD-UHFFFAOYSA-N 280.274 2.364 10 10 CECE COc1ccc(CNCC[C@H]2CCNC(=O)C2)cc1C 2182200372 COXCNTFOXLWPTI-ZDUSSCGKSA-N 276.380 2.010 10 10 CECE COCCNCc1ccc(OCC2(C)COC2)c(C)c1 2198495665 FRRZNQADUNWNNN-UHFFFAOYSA-N 279.380 2.146 10 10 CECE CCN[C@@H]1CCc2cc(N(C)C[C@@H](O)C3CC3)ccc21 2184724187 WLILSRAVPWWGEZ-IAGOWNOFSA-N 274.408 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GFHGJIIJCXBSLT-MPESAESLSA-N 261.365 2.480 10 10 CECE CC[C@@]1(O)CCCN(CCCOc2ccc(N)cc2)C1 710298078 YYLAMADAVRKMLZ-MRXNPFEDSA-N 278.396 2.275 10 10 CECE CNCc1ccc(N2CC[C@@](O)(C(F)(F)F)C2)cc1C 380056849 TYPJDBDKVNPIKB-ZDUSSCGKSA-N 288.313 2.218 10 10 CECE Cc1cc(CNC(=O)Cc2ccc(N)cc2)cs1 381128051 GNVQGGPYGXMSFV-UHFFFAOYSA-N 260.362 2.498 10 10 CECE NCc1ccc(N2CCC[C@@H](CO)CC2)c(F)c1F 381237986 RFSPMJPHXQNYOU-SNVBAGLBSA-N 270.323 2.022 10 10 CECE CCN(Cc1ccc(N)cc1)Cc1nccc(C)n1 692636259 SFUUYCUSSKXPGB-UHFFFAOYSA-N 256.353 2.389 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1C(=O)NCC(F)(F)F 692888872 OKIRNIMIOGJJBR-LURJTMIESA-N 251.212 2.033 10 10 CECE CCOC[C@H](O)CN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 381866480 UZRVPLFNQKPFJZ-XQQFMLRXSA-N 279.380 2.236 10 10 CECE CC(C)[C@@](C)(CC(=O)Nc1ccc(N)cc1)C(=O)O 382509021 QFELVOLAKPZIPZ-CQSZACIVSA-N 264.325 2.344 10 10 CECE Oc1cc2c(cc1CN[C@@H]1CCC[C@H]3C[C@H]31)OCO2 694319093 HPNHETPASCCCKH-MVWJERBFSA-N 261.321 2.399 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H]3C(N(C)C)[C@H]3C2)cc1Cl 384925585 RRQBDHMPGUSBLE-ICCXJUOJSA-N 279.815 2.356 10 10 CECE CCN(CC(F)F)C(=O)[C@H]1CNc2ccccc2N1 386527552 GIQSWMRERCIJLX-LLVKDONJSA-N 269.295 2.006 10 10 CECE CO[C@@]1(CN[C@H](C)c2ccc(O)cc2O)CCSC1 719275650 JMSAQTJFZHHMLV-QMTHXVAHSA-N 283.393 2.271 10 10 CECE Cc1cc(C)c([C@H](NCCCN=[N+]=[N-])C(N)=O)s1 719400751 CVACRBQBMQPSEG-VIFPVBQESA-N 267.358 2.181 10 10 CECE C[C@@H]1CC[C@H](c2noc(-c3ccc(O)c(O)c3)n2)O1 398381307 SQKTXTSXNFEKPM-RDDDGLTNSA-N 262.265 2.388 10 10 CECE Cc1cc(O)n2ncc(C(=O)N3C[C@@H](C)CC3(C)C)c2n1 2062256741 HHVHEYAYUAZHNL-VIFPVBQESA-N 288.351 2.004 10 10 CECE C[C@@H](Nc1cnc2nccn2c1)c1ccc(O)cc1O 2167593211 XCISNEWMEAVMNZ-SECBINFHSA-N 270.292 2.314 10 10 CECE COc1ccc(O)c([C@@H](C)N[C@@H](CO)c2cscn2)c1 2175639621 TWKRNBFXBGSSRX-SKDRFNHKSA-N 294.376 2.242 10 10 CECE COc1ccc(CN2CC=C(CC(=O)O)CC2)c(O)c1 2181677520 IOJNMSQEIDMTRE-UHFFFAOYSA-N 277.320 2.008 10 10 CECE CCOC(=O)c1cc(C)nn1Cc1c(O)cccc1F 2069877111 KZGKZORRISIMEQ-UHFFFAOYSA-N 278.283 2.261 10 10 CECE CCc1cc(CNC)n([C@H](C)c2cc(OC)ccc2O)n1 2070171218 ZDWJFGFHIXGDOW-LLVKDONJSA-N 289.379 2.488 10 10 CECE Oc1cc(Br)n(Cc2c(O)cccc2F)n1 2070300287 WOZHNDKFEGPWAY-UHFFFAOYSA-N 287.088 2.244 10 10 CECE COc1ccc([C@@H](C)N[C@H](CO)CC(C)(F)F)c(O)c1 2169535537 LGPUIEAFDSOJPL-ZJUUUORDSA-N 289.322 2.458 10 10 CECE O=C1Nc2cc(N3C[C@@H]4CC=CC[C@H]43)c(Cl)cc2[C@H]1O 2177153381 QVTCNNLQCLVTFU-REAQECSSSA-N 290.750 2.480 10 10 CECE NCc1ccc(N2CC[C@@H]3OCCC[C@H]3C2)c(F)c1F 2170256059 HHHNCPSXXWUUPN-AAEUAGOBSA-N 282.334 2.429 10 10 CECE Cc1cc(N(C)[C@H]2CCN(C)[C@H](C)C2)ccc1CCN 2170394342 FSPXGKFZMJHVMS-PBHICJAKSA-N 275.440 2.415 10 10 CECE C[C@@H](N)c1ccc(N(C)CCN2CCCC2=O)cc1Cl 2171069382 BOFDHRJOSGUZFO-LLVKDONJSA-N 295.814 2.418 10 10 CECE CN(C)c1ccc([C@@H](CN)N2CCP(C)(=O)CC2)cc1 2171997515 HSJPSIAIUMNLLZ-OAHLLOKOSA-N 295.367 2.061 10 10 CECE CN1[C@H]2CCC[C@@H]1C[C@H](NCc1ccccc1O)C2 1172101607 GAIMXRSNNPSKAB-QDMKHBRRSA-N 260.381 2.497 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@@H](CCO)C(F)F)cc1O 2178500779 IZKMYPIMOGPENP-SKDRFNHKSA-N 288.338 2.125 10 10 CECE COC[C@](C)(CN(c1ccc(CN)cc1)C(C)C)OC 2198271060 MEYLXPKUZLTKTJ-INIZCTEOSA-N 280.412 2.412 10 10 CECE C[C@H](N[C@H]1C[C@@H](n2ccnc2)C1)c1cc(O)ccc1O 2184164213 DCWCDBOCUBNOGO-SDDRHHMPSA-N 273.336 2.349 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@]12CCOC[C@@H]1C2 2194357474 UOMKFBPHJQLINB-WQGACYEGSA-N 275.348 2.338 10 10 CECE CCN[C@H]1CCCc2cc(N3CC([C@@H](C)O)C3)ccc21 2184684844 QFHCEFBMVPFYSG-PXAZEXFGSA-N 274.408 2.491 10 10 CECE CN[C@@H]1CCCc2cc(N3CC(O)(C(C)C)C3)ccc21 2184689477 PHHAXQWPFLAQDN-MRXNPFEDSA-N 274.408 2.491 10 10 CECE CN[C@@H]1CCc2cc(N3CCN(C)C[C@H](C)C3)ccc21 2184721478 MISVHQZKBDIACY-SUMWQHHRSA-N 273.424 2.281 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2O)[C@H]1C[C@@H]2CC[C@@H]2C1 2190427310 KZVIDDJKPWPPEQ-KVQFHVITSA-N 272.348 2.297 10 10 CECE C[C@@H](O)c1cc(F)c(N2[C@H]3CC[C@@H](C3)[C@H]2CO)c(F)c1 2194518876 PTLYJHCGRZSIMP-OCYKMNHNSA-N 283.318 2.368 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CC=CC[C@H]2CO)c(F)c1 2194694640 MXFRNTGKUZTPDL-JQWIXIFHSA-N 282.334 2.372 10 10 CECE C[C@H]1CCN(c2c(F)cc([C@@H](C)N)cc2F)C[C@H]1CO 2194705150 VHORIBSGMDWEPJ-UMNHJUIQSA-N 284.350 2.439 10 10 CECE CN(C)c1ccc([C@H](CN)N(C)C[C@H]2C[C@H]2CF)cc1 2191369788 ACTJJURCHHUDCP-LZWOXQAQSA-N 279.403 2.290 10 10 CECE Cc1nccn1[C@@H](C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2185978323 LITKKRXREUHXDJ-CMPLNLGQSA-N 276.344 2.301 10 10 CECE NCc1ccc(N2CCC[C@@]3(CC[C@@H]3O)C2)c(F)c1F 2186078672 FNYHZPOMZOKXAB-SWLSCSKDSA-N 282.334 2.165 10 10 CECE C[C@H]1C[C@@H](CCNCc2c(O)cccc2F)CO1 2042606719 CMXCTLCHTOGPBQ-WDEREUQCSA-N 253.317 2.436 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CC[C@@H]1CC(C)C 2043638971 LSHKQQMTSBXJGA-ZYHUDNBSSA-N 254.334 2.254 10 10 CECE CN[C@H](c1ccccc1O)[C@@H]1COCCC1(F)F 2047864520 FAOSOMSQUXNCOJ-CMPLNLGQSA-N 257.280 2.325 10 10 CECE CNCc1ccc(N(CCO)[C@@H]2C[C@@H]2C)cc1Cl 2048216715 QPOLTKJQWZATGL-IINYFYTJSA-N 268.788 2.267 10 10 CECE CC(C)(CN)CC1CN(C(=O)Nc2ccc(N)cc2)C1 2199522317 IWJQBDLVABPQIL-UHFFFAOYSA-N 276.384 2.108 10 10 CECE CO[C@H]1CC[C@@H]1CCOC(=O)COc1ccc(N)cc1 2186892987 JVKHWZRZBFGDQO-RISCZKNCSA-N 279.336 2.006 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@@H]1OCCOC1(C)C 2186974727 IWJKCGCYCUMNGN-HNNXBMFYSA-N 278.396 2.285 10 10 CECE CCOC(=O)C(F)(F)CCN(C)CCCN=[N+]=[N-] 2058207663 PXFKHDQGVZEUFB-UHFFFAOYSA-N 264.276 2.207 10 10 CECE CN(C)c1nc(CN2CCC[C@H]2CN=[N+]=[N-])cs1 2059053067 IYRITANLQJFPLK-JTQLQIEISA-N 266.374 2.484 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@H]1C[C@@H]2CC[C@H](C1)O2 2060986787 KCXSPAPZNIPMTN-RTCCRHLQSA-N 252.318 2.103 10 10 CECE C[C@H](NC(=O)[C@@H]1CC[C@](F)(CN)C1)c1ccccc1O 2192626511 QGMCZMLZTAZBLX-FIXISWKDSA-N 280.343 2.037 10 10 CECE C[C@@H](NC(=O)C1(CN)CCCCC1)c1ccccc1O 2192626052 YRTVAVUUYAGCIQ-GFCCVEGCSA-N 276.380 2.479 10 10 CECE CN(c1ccc(CN)cc1Cl)[C@@H]1CO[C@H]2C[C@@H]1C2 2063077630 JBLLOEMXJANNCL-UHIISALHSA-N 266.772 2.412 10 10 CECE CCO[C@H](CNC(=O)c1cccc(O)c1O)C1CCC1 2188375544 STBMAYZQZRQMJA-CYBMUJFWSA-N 279.336 2.033 10 10 CECE OCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)c(F)c1 2072211281 QQEVFNDCCNUQOX-GDGBQDQQSA-N 257.255 2.265 10 10 CECE O=C(c1ccc(O)c(O)c1)N1CCC[C@@]12CCSC2 2102291536 NTICGLUQHMFAAH-AWEZNQCLSA-N 279.361 2.210 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)c2ncoc2C2CC2)C1 2104137356 BVBPZPFEENQULN-MRVPVSSYSA-N 261.285 2.324 10 10 CECE O=C(N[C@H]1[C@H]2C=CC[C@H]1CC2)c1cccc(O)c1O 2104390450 MZIVETRXFJFJBD-KWBADKCTSA-N 259.305 2.182 10 10 CECE Cc1cccc(O)c1CN1CCN2CCCC[C@H]1C2 2104480078 OHWZXIQRXHBUHV-AWEZNQCLSA-N 260.381 2.371 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2C[C@H]1OCC1(C)C 2105052013 OBIUZYKBDBUEFO-XHDPSFHLSA-N 260.381 2.494 10 10 CECE Nc1ccc(OCCNc2ccc(C(=O)O)o2)cc1 2105955030 NNRANZFWUAUCBW-UHFFFAOYSA-N 262.265 2.051 10 10 CECE C[C@@H]1CC[C@@H](CN)CN1c1ccc2c(c1)OCCO2 2106334002 KKGJLDMTLUBAON-NEPJUHHUSA-N 262.353 2.021 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)c1cnccc1Cl 2106478861 PHSGJKKPYBAZGF-UHFFFAOYSA-N 297.767 2.142 10 10 CECE CCNCc1cc(F)c(N(C)C[C@@H](O)CC)c(F)c1 2106619122 AHQSMQSUZQEWJQ-NSHDSACASA-N 272.339 2.281 10 10 CECE CN(C)c1ccc([C@@]2(N)CCN3CCC[C@H]3C2)cc1 2106791403 RLNWPCAMHXFUKI-JKSUJKDBSA-N 259.397 2.165 10 10 CECE CN(C)c1ccc([C@@H](N)[C@](C)(O)c2cncs2)cc1 2106857178 HXLBEXLKVZVPCY-ZIAGYGMSSA-N 277.393 2.117 10 10 CECE C[C@@H]1CNC[C@H]1[C@@H](O)c1ccc(N2CCCC2)cc1 2106831834 UPJBNHLXDGTPJR-WQVCFCJDSA-N 260.381 2.176 10 10 CECE C[C@@H]1C[C@@](O)(c2ccc(N3CCCC3)cc2)CN1C 2106829878 AWQRHZSPAPMKKW-CJNGLKHVSA-N 260.381 2.198 10 10 CECE CN1CCCc2cc([C@H](N)[C@H]3CCCCN3)ccc21 2107768747 YSKJEKWMSBUIOF-ZBFHGGJFSA-N 259.397 2.211 10 10 CECE CN(C[C@@H]1C[C@@H]2C[C@@H]2C1)C(=O)Cc1ccc(N)cc1 2107765469 REPFZHFAMMIRCX-ZSOGYDGISA-N 258.365 2.316 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1C[C@H]2C[C@H](N)C[C@H]1C2 2088297506 SDYKCPNQWDOHHK-XRRVDJEJSA-N 264.344 2.404 10 10 CECE C[C@H](N[C@@H]1COC[C@H]1C1CC1)c1cc(O)ccc1O 2088403936 VCCNTXRKGOWRPH-QCZZGDTMSA-N 263.337 2.173 10 10 CECE CCOC(C)(C)CS(=O)(=O)Nc1ccc(O)cc1F 2088706934 NZNVBWLWSRRJTF-UHFFFAOYSA-N 291.344 2.088 10 10 CECE CCCOCC1CN(c2c(F)cc(CN)cc2F)C1 2109584893 YYNBYFURTIOLIA-UHFFFAOYSA-N 270.323 2.286 10 10 CECE COCC[C@@H](COC)N(C)c1ccc([C@@H](C)N)cc1 2109704382 AGQDSFBDDMBOHS-DOMZBBRYSA-N 266.385 2.194 10 10 CECE Nc1ccc(CCNC[C@@H]2CC3(CCC3)CO2)cc1 2110091871 RKJUYBXMBVOXEC-HNNXBMFYSA-N 260.381 2.360 10 10 CECE CC[C@@H](CS(C)(=O)=O)N[C@H](C)c1ccc(F)cc1O 2090093967 IGIWCVLJVRFLFB-KOLCDFICSA-N 289.372 2.005 10 10 CECE CCCOC1(C(=O)N2CCC[C@@H](CN=[N+]=[N-])C2)CC1 2110252441 AVYISDFXAAKBRY-NSHDSACASA-N 266.345 2.495 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C)[C@@H]2C(N)=O)c(Cl)c1 2090254936 ZMZLOEOBVRDIAM-JRKPZEMJSA-N 281.787 2.060 10 10 CECE C[C@@H]([C@H]1CCCOC1)N(C)Cc1cc(N)ccc1O 2112139074 GWKSFMQQBZUWSL-RYUDHWBXSA-N 264.369 2.221 10 10 CECE COc1ccc(N2CCCC[C@]23CCOC3)c(N)c1 2093606309 OIPMJVGGTZCBHV-OAHLLOKOSA-N 262.353 2.427 10 10 CECE Nc1ccc(OCC(=O)N2CCCC23CCC3)cc1 2095962546 FYUBEVMXUPNQOE-UHFFFAOYSA-N 260.337 2.193 10 10 CECE COCCNCc1ccc(N2CC[C@@](C)(F)C2)cc1 2096014563 CGVWNJUKIGXMTI-OAHLLOKOSA-N 266.360 2.361 10 10 CECE C[C@@H](NCC12CC(CCO1)C2)c1ccc(O)cc1O 2097682898 ZLSWRYDHVMAWGJ-RWWNRMGGSA-N 263.337 2.318 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H]2COCCCO2)c1 2097717485 HZKBQLFRTXWGDY-STQMWFEESA-N 265.353 2.157 10 10 CECE CN(C)CC(C)(C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2099334378 VSDYFSNSJGZANB-NSHDSACASA-N 267.377 2.266 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1 2114009553 XEJWANKDHBGOPD-XJKSGUPXSA-N 261.413 2.325 10 10 CECE NCc1ccc(N2CCC[C@@H]([C@H]3CCOC3)C2)cc1 2115011873 PITCTLVIHGXRPQ-CABCVRRESA-N 260.381 2.398 10 10 CECE COc1cc(N2C[C@](C)(CO)CC2(C)C)ccc1CO 2204554963 VHLXNPRKDQIKFA-MRXNPFEDSA-N 279.380 2.175 10 10 CECE COc1cc(N2C[C@@H](OC)CC(F)(F)C2)ccc1CN 2204544783 GYKWFNJBFHKKQT-LBPRGKRZSA-N 286.322 2.014 10 10 CECE COc1cc(N2CCCC[C@H]2CN(C)C)ccc1CO 2204554761 UKUWKVJMDBQYJZ-HNNXBMFYSA-N 278.396 2.108 10 10 CECE COc1cccc(CNC[C@H]2CCC3(CC3)CO2)c1O 2205212937 ZRLPFRKRDXYMGN-CYBMUJFWSA-N 277.364 2.450 10 10 CECE C[C@H]1C[C@]1(F)C(=O)Nc1ccnn1-c1ccc(N)cc1 2206335308 VYMRFBKZZIVBJS-LKFCYVNXSA-N 274.299 2.141 10 10 CECE O[C@H]1CCCN(c2ccc(OCC(F)F)cc2)C1 2219566921 LAPXMSKIHDJUBC-NSHDSACASA-N 257.280 2.292 10 10 CECE COc1ccc(N2C[C@H](O)[C@H](F)C2)cc1C(C)C 2219675491 FOFRVJNVOOJJER-OLZOCXBDSA-N 253.317 2.338 10 10 CECE COc1ccc(N2CC[C@H](CO)C[C@H]2C)c(F)c1 2219615210 RATGDTJSADTGTJ-MNOVXSKESA-N 253.317 2.432 10 10 CECE COc1ccc(N2C[C@@H](C)CC[C@@H]2CO)c(F)c1 2219620693 CHRREQPFAPCCAO-WDEREUQCSA-N 253.317 2.432 10 10 CECE CN(C(=O)COC1C[C@H]2C[C@@H]2C1)c1ccc(N)cc1 2230322624 SJGISZCKLKPZFT-GHMZBOCLSA-N 260.337 2.047 10 10 CECE COc1ccc(N2CCP(C)(=O)CC2)c(CO)c1 2220425751 BDRBPNQECVIART-UHFFFAOYSA-N 269.281 2.000 10 10 CECE COC(C)(C)CS(=O)(=O)Nc1c(C)cc(O)cc1C 2231215426 OQTCUNAICPWYIM-UHFFFAOYSA-N 287.381 2.176 10 10 CECE CCN[C@@H](C)c1ccc(N2CC(CCO)C2)c(C)c1 2232011991 JMZYCYOYKNUTIQ-ZDUSSCGKSA-N 262.397 2.484 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CC[S@](=O)C(C)(C)C1 2232106460 MOKABOCOYAWRJF-BLVKFPJESA-N 280.437 2.362 10 10 CECE Cc1cc([C@H](C)O)ccc1N1C[C@H]2CC[C@@]1(CO)C2 2232103103 UQZIVUCNNBHBCD-XEZPLFJOSA-N 261.365 2.400 10 10 CECE CC(C)n1nccc1C(=O)N[C@@H]1CCC[C@H]1N=[N+]=[N-] 2225792248 LKHCUCCJPBUOHN-NXEZZACHSA-N 262.317 2.425 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)CCCCCC(=O)O)CC1 2225794083 CINDMTNBDGIKJZ-UHFFFAOYSA-N 268.317 2.323 10 10 CECE COc1ccc(N2CCC(C)(N(C)C)CC2)c(C=O)c1 2235993428 XTZDIEARFWFZRD-UHFFFAOYSA-N 276.380 2.428 10 10 CECE CNCc1cc(OC)ccc1N1CC[C@@H]2CCO[C@@H]2C1 2235961148 FPQKTDKVGKGKMP-MLGOLLRUSA-N 276.380 2.030 10 10 CECE CNCc1cc(OC)ccc1N(C)C[C@@H]1CC[C@H](C)O1 2235955710 UUYCALOYBOGQAF-WFASDCNBSA-N 278.396 2.418 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H](N(C)C)C(C)(C)C1 2236254570 MXEJNMDTHXJLBW-RISCZKNCSA-N 278.396 2.431 10 10 CECE CN(C)[C@@H]1CN(Cc2ccc(F)c(F)c2O)CC1(C)C 2236250875 BIIUMLBEGXHUQY-GFCCVEGCSA-N 284.350 2.442 10 10 CECE C[C@@H]1C[C@@H]1CCn1cc(COc2ccc(N)cc2)nn1 2236388475 DUWPYOKIFYGZLY-NEPJUHHUSA-N 272.352 2.485 10 10 CECE 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251.330 2.256 10 10 CECE COc1c(F)cc(N2CCC(=O)[C@@H](C)C2)cc1F 2256195566 BNOCRXSKMRVDLQ-QMMMGPOBSA-N 255.264 2.389 10 10 CECE Nc1ccc(N2C(=O)CN(CC3CCCC3)C2=O)cc1 2288124635 HRFDBFQYHCKVLJ-UHFFFAOYSA-N 273.336 2.228 10 10 CECE C[C@H](O)c1ccc(N2C[C@H](S(C)(=O)=O)CC[C@@H]2C)cc1 2279429647 SLSWMMLLYMQILO-SLEUVZQESA-N 297.420 2.142 10 10 CECE CCOC1CC(NC(=O)N[C@H](C)c2ccccc2O)C1 2280160799 PDVRJDUECXIFOH-VOMCLLRMSA-N 278.352 2.320 10 10 CECE C[C@@H](O)c1ccc(N(C)Cc2cccnc2O)cc1O 2288563735 DACFJWUZEWIAKP-SNVBAGLBSA-N 274.320 2.183 10 10 CECE Cc1ccc2c(c1)OCCN2C(=O)C=Cc1cnn(C)c1C 2304177997 UHOAWWDHLRIIRD-UHFFFAOYSA-N 297.358 2.476 10 10 CECE Cc1cccc(CNS(=O)(=O)c2cccc(F)c2)c1O 1255687499 BABSAGXLZMYQDC-UHFFFAOYSA-N 295.335 2.318 10 10 CECE C[C@@H]1CN[C@@H](C)[C@](Sc2nccs2)(C(=O)O)C1 2307040887 FTPWLYWFSVFQOD-LAEOZQHASA-N 272.395 2.077 10 10 CECE C[C@@H](N[C@@H]1CC[C@H](CO)C1)c1cc(F)ccc1O 2308202932 PAULLJUNIYTUPK-JFGNBEQYSA-N 253.317 2.343 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H](N)[C@@H](C3)C2)c(F)c1 2312384870 SMTFOZFJJIBNDO-KWBADKCTSA-N 250.317 2.008 10 10 CECE Cc1cc(N2CCOC[C@H](F)C2)ccc1[C@H](C)O 2315068261 OUPKFZRGORKKEX-NWDGAFQWSA-N 253.317 2.223 10 10 CECE Cc1c([C@H](C)O)ccc(N(C)C[C@@H](C)CO)c1C 2318387413 MRPCHOPPCPTBLS-MFKMUULPSA-N 251.370 2.421 10 10 CECE CS[C@@H]1CC[C@@H]1N(C)C(=O)Cc1ccc(N)cc1 2327899810 PZDSBANTQJDZDZ-QWHCGFSZSA-N 264.394 2.164 10 10 CECE CN[C@H]1CCc2cc(N3C[C@@H](F)[C@H](OC)C3)ccc21 2331550671 LORRVDDFJDPKRM-QLFBSQMISA-N 264.344 2.066 10 10 CECE Oc1cccc2c1[C@@H](N1CC[C@@H]3CCO[C@@H]3C1)CC2 2331555535 QTQHKZGPXIOEJL-OSAQELSMSA-N 259.349 2.490 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)[C@@H]2OC[C@@H]3CCCC[C@@H]32)C1 2333521732 CFVCVVZACICTEG-FIQHERPVSA-N 264.329 2.103 10 10 CECE Cc1cc(F)c[nH]c1=NCCOc1ccc(N)cc1 2336822266 VERBSXXTUKNRJM-UHFFFAOYSA-N 261.300 2.024 10 10 CECE CNCc1ccc(N2C[C@H]3CC[C@H]2C[C@H]3O)c(Cl)c1 2337135249 IVHMAMHSLNVANP-TYNCELHUSA-N 280.799 2.409 10 10 CECE CCN(CCN=[N+]=[N-])C(=O)COc1cccc(F)c1 2337778466 XBLYFGXSCBYQPH-UHFFFAOYSA-N 266.276 2.363 10 10 CECE CN(Cc1ccccc1O)C1C[C@H]2CNC[C@H](C1)C2 2337834195 PYRFRXOOOIFMAS-STQMWFEESA-N 260.381 2.212 10 10 CECE CNCc1ccc(N2CCO[C@H]3C[C@H]32)cc1C1CC1 2339147943 ZRTBBXNSYJQXDJ-CVEARBPZSA-N 258.365 2.261 10 10 CECE C[C@@]1(CO)CCN(c2ccc(CO)c(C3CC3)c2)C1 2339158607 XTGJUIKMXZSMTA-MRXNPFEDSA-N 261.365 2.265 10 10 CECE Cc1cccc(O)c1CN1C[C@@]2(C(=O)O)CC[C@H]1C2 2339613168 WXYDTXPWRSGJQH-XHDPSFHLSA-N 261.321 2.140 10 10 CECE COc1ccc(N2CC=C(C(F)(F)F)C2)c(CN)c1 2340470940 YPOWOMLYPQCDSO-UHFFFAOYSA-N 272.270 2.463 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1CN2[C@@H](C)c1c(O)cccc1O 2340772058 BLOFLCGYTJNFFF-DYNIEEOBSA-N 263.337 2.268 10 10 CECE Cc1cc(N(C)C[C@H]2CCO2)ccc1C=CC(=O)O 2341149466 FPQOCYBBCVWZOD-CQSZACIVSA-N 261.321 2.318 10 10 CECE COC1(C(F)F)CC(NCc2cccc(F)c2O)C1 2343084787 DXEZXOMQMJRQRR-UHFFFAOYSA-N 275.270 2.434 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3CC[C@H]2[C@H](O)C3)c(F)c1 2349995698 RUMOGZZVBRXGGP-FCIDVOKBSA-N 265.328 2.229 10 10 CECE COc1cnc(CN[C@H](C)c2ccccc2O)nc1 2352331035 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N[C@@H](c1ccc(Cl)c(Cl)c1O)[C@H](O)C1CC1 95804443 GVGUXOYRWXYHLN-VHSXEESVSA-N 262.136 2.470 10 10 CECE CC(C)[C@H]1CCC[C@](NCCN=[N+]=[N-])(C(N)=O)CC1 90257997 GPSTYMIRMHRSOP-WCQYABFASA-N 267.377 2.347 10 10 CECE Cc1nnc(N[C@H](C)c2c(O)cccc2O)s1 235228887 SOBAMKQUVPFVAP-ZCFIWIBFSA-N 251.311 2.431 10 10 CECE CC(=O)N(c1ccc(N)cc1)S(=O)(=O)c1ccccc1 242841036 FVZVMWWMBYLTEA-UHFFFAOYSA-N 290.344 2.011 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1CC[C@@H]2C[C@@H]2C1 700105957 VNWGRPGSIRULSJ-DDHJBXDOSA-N 266.345 2.254 10 10 CECE CN(C)c1ccc(/C=C\C(=O)NC[C@@H]2CCC[C@H]2O)cc1 252678718 PJNYOYBNIYLGIN-CKSNUIATSA-N 288.391 2.043 10 10 CECE NC(=O)[C@@H]1CCCCN1Cc1cc(Cl)c(F)cc1O 294815685 FOCZXZPLDWCAQA-NSHDSACASA-N 286.734 2.025 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)C1(O)[C@@H]2C[C@@H]2[C@H]2C[C@H]21 2166619927 ADGPERHDIFANMJ-OXGONZEZSA-N 272.392 2.030 10 10 CECE COC1(COc2ccc(N3CCC[C@@H](N)C3)cc2)CC1 2167862880 ZZJKFHLEAKNWIL-CYBMUJFWSA-N 276.380 2.172 10 10 CECE COc1ccc(N2C[C@H](CN)[C@@H](C(F)(F)F)C2)c(F)c1 2162645800 CYEXYUDCYRKQBV-WPRPVWTQSA-N 292.276 2.408 10 10 CECE CC1(C)C[C@@H](N)CN(c2ccc3c(c2)OCCCO3)C1 2162666224 CBJMBHKYYZNJRC-GFCCVEGCSA-N 276.380 2.412 10 10 CECE c1cc2c(cc1N1CC[C@@]3(CCCNC3)C1)OCCO2 2162671557 RLZILWPTWYENAX-MRXNPFEDSA-N 274.364 2.038 10 10 CECE CC(C)(C)NC(=O)C1CN(c2ccc(CN)c(Cl)c2)C1 2168045052 DADUUXXXWRNGRC-UHFFFAOYSA-N 295.814 2.150 10 10 CECE NCc1ccc(N2CCC[C@@]3(CO)CCC[C@H]23)cc1F 2165238841 HTXJRLUVZAJBNU-JKSUJKDBSA-N 278.371 2.416 10 10 CECE CN1CCc2cc([C@@]3(N)C[C@H]4CCCCN4C3)ccc21 2163062133 JUZOJOPLGSBLRI-NVXWUHKLSA-N 271.408 2.091 10 10 CECE CCc1c([C@H](NC)c2ccc(N(C)C)cc2)cnn1C 2163074288 QRWDFRXUKFQOKM-MRXNPFEDSA-N 272.396 2.357 10 10 CECE N[C@@H]1C[C@]2([C@@H](O)c3ccc(N4CCCCC4)cc3)C[C@H]12 2163100135 ODJIWRNYXOFDCT-WCXIOVBPSA-N 272.392 2.448 10 10 CECE CN1CCCc2cc([C@@H](O)[C@H]3CCCNCC3)ccc21 2163102879 OIOKJCBMMCVQGG-GUYCJALGSA-N 274.408 2.492 10 10 CECE NN[C@H](c1ccc(N2CCCC2)cc1)[C@@H]1CCCOC1 2163104676 FYYPETBXMDWTPP-GDBMZVCRSA-N 275.396 2.218 10 10 CECE Cc1ccc([C@@H](O)[C@H](N)c2ccc(N(C)C)cc2)cn1 2163127787 QDCAWFBWRXUNIT-HZPDHXFCSA-N 271.364 2.189 10 10 CECE CCN1CCc2cc([C@H](NC)[C@H](O)CC3CC3)ccc21 2163147317 YZBPKFIYVAYRRO-SJORKVTESA-N 274.408 2.491 10 10 CECE CC[C@H]1CCNC[C@@H]1N(C)Cc1cccc(OC)c1O 2163630197 YBPKCHISUGLBOV-JSGCOSHPSA-N 278.396 2.221 10 10 CECE O=C(O)/C=C\c1ccc(N2C[C@H]3COC[C@H]3C2)c(F)c1 718638925 SNRJGEGFXMORJW-AGQFFEFTSA-N 277.295 2.006 10 10 CECE CO[C@@H]1C[C@H](CF)N(CCCc2ccc(N)cc2)C1 2133712786 WWGAPUBWMMCYIW-HUUCEWRRSA-N 266.360 2.260 10 10 CECE CCOC(=O)[C@@H](F)[C@H](N)c1c(F)ccc(Cl)c1O 725274856 QSGDZPHOVFXUMU-DTWKUNHWSA-N 279.670 2.086 10 10 CECE CO[C@H]1CC[C@H]1NCc1ccc2c(c1)CCCN2C 724200374 MGASVAXKFKBVEC-ZBFHGGJFSA-N 260.381 2.336 10 10 CECE CCOc1ccc(CNC2(CF)CCOCC2)c(O)c1 824691153 VMLDYKRAZRYAIU-UHFFFAOYSA-N 283.343 2.399 10 10 CECE CC(=O)[C-]1NC(C2=C=C=C(Cl)S2)=S=C1C 725456288 DCFIQGLUJFXNOG-UHFFFAOYSA-N 256.759 2.231 10 10 CECE 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267.344 2.476 10 10 CECE COc1cccc(O)c1CN[C@@H]1C[C@]12CCCOC2 1896389272 PRYBDUPJZCKPJV-CABCVRRESA-N 263.337 2.060 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@H]2[C@@H](C)O)c(F)c1 1879187926 OKGPWMCSOFAVHW-WDMOLILDSA-N 266.360 2.456 10 10 CECE CN(CCCc1ccc(N)cc1)CC12CC(CO1)C2 1878423657 FIFUFDKINUNDNT-UHFFFAOYSA-N 260.381 2.312 10 10 CECE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCC=CO1 1136743169 KPMFCGQPLOTCIF-HNNXBMFYSA-N 274.364 2.370 10 10 CECE FC(F)(F)COc1ccc(N2CCN[C@@H]3C[C@H]32)cc1 1879915223 OFUHLMBOXCTUFJ-VXGBXAGGSA-N 272.270 2.178 10 10 CECE c1cc2c(cc1CN[C@]13CCOC[C@H]1C3)CCCO2 1880172116 ORBFIBXMIGBKEB-ZBFHGGJFSA-N 259.349 2.280 10 10 CECE COC[C@H]1CCN(c2c(F)cc([C@@H](C)O)cc2F)C1 1880487666 SDHZWRUYQNLKPP-ZJUUUORDSA-N 271.307 2.491 10 10 CECE CC[C@@H]1CN(c2c(F)cc([C@H](C)O)cc2F)C[C@@H]1O 1880488796 WTGTZSWINMDLOP-RWEMILLDSA-N 271.307 2.225 10 10 CECE CN1CCc2cc([C@H](NN)[C@H]3C[C@](C)(F)C3)ccc21 1898010249 WRFOVINCMIUCCC-QEJZJMRPSA-N 263.360 2.322 10 10 CECE CN(CC(=O)N1CC[C@@H](CN=[N+]=[N-])C1)C(=O)OC(C)(C)C 1885563039 OMIWWBIEEGTEOV-JTQLQIEISA-N 297.359 2.012 10 10 CECE Cc1ccc(C(=O)NOc2ccccc2F)c(O)c1O 1303332690 JOUKHCPAEDGKRU-UHFFFAOYSA-N 277.251 2.269 10 10 CECE C[C@H]1OCC[C@@H]1CCN1CCc2cc(CN)ccc21 1885649533 RLWVOKTWRZSJHR-OCCSQVGLSA-N 260.381 2.323 10 10 CECE C[C@H](CCN)Nc1c(N)cccc1Br 1888905427 OGYWGNMEJMMXBF-SSDOTTSWSA-N 258.163 2.181 10 10 CECE CCCCN(c1c(F)cc(CN)cc1F)C1COC1 1889955833 XANCMDBBVUTDOA-UHFFFAOYSA-N 270.323 2.429 10 10 CECE CCCCOC(=O)[C@H](C)N1CCOc2cc(CN)ccc21 74338291 LNUVXTBOULZFNA-LBPRGKRZSA-N 292.379 2.076 10 10 CECE CO[C@H]1C[C@@H](NCc2ccc(F)cc2O)C1(C)C 1964593064 BRXAFZNTFSIJNB-OLZOCXBDSA-N 253.317 2.434 10 10 CECE CCOc1cccc(CN[C@@H](C)[C@@H](O)C(C)C)c1O 1964590685 WQZQRVHVEQZCAM-FZMZJTMJSA-N 267.369 2.286 10 10 CECE C[C@@H](Sc1ncccn1)C(=O)Nc1ccc(N)cc1 19869684 ZNEURXMROQCXNI-SECBINFHSA-N 274.349 2.178 10 10 CECE CCc1ccc(S(=O)(=O)NCCCN=[N+]=[N-])cc1 1963987953 KGQXDOWLPTVFHQ-UHFFFAOYSA-N 268.342 2.228 10 10 CECE COc1ccc(CN[C@@H]2CCCn3ncnc32)cc1C 1964047032 ABKCBTCUJDXKQU-CYBMUJFWSA-N 272.352 2.220 10 10 CECE COc1cccc(CNc2nccc(Cl)n2)c1O 83482652 SRSUBGPYQPZHPQ-UHFFFAOYSA-N 265.700 2.456 10 10 CECE Oc1c(Br)cccc1CNCC1CC(O)C1 84446083 VPIPFIUQXQEGBH-UHFFFAOYSA-N 286.169 2.015 10 10 CECE CC1(C)CC[C@@H](C(=O)O)CN1Cc1ccc(N)cc1 1891268822 JEBRLDVLVLZLEK-GFCCVEGCSA-N 262.353 2.344 10 10 CECE CC(C)(C(=O)O)[C@H]1CCCN1Cc1ccc(N)cc1 1891508115 WNYIVZNIIXAPMP-CYBMUJFWSA-N 262.353 2.344 10 10 CECE COc1cc(Cl)cc(CN2C[C@H]3CNC[C@@]3(C)C2)c1O 703618842 HEBQHKRRXYJGCU-ABAIWWIYSA-N 296.798 2.096 10 10 CECE COc1ccc(CN(C)[C@H]2CCCC[C@H]2CN)c(O)c1 250243774 SFGHXFRLLXWVPJ-WFASDCNBSA-N 278.396 2.350 10 10 CECE Oc1ccc(CNCC[C@H]2CCSC2)cc1O 704923543 PUIDQXCAAOWWGB-JTQLQIEISA-N 253.367 2.331 10 10 CECE Nc1ccc(OCCC(=O)Nc2ccsn2)cc1 705758577 MCDQUFIDDDAZDY-UHFFFAOYSA-N 263.322 2.133 10 10 CECE Cn1nc2c(c1[C@H](O)Cc1ccc(N)cc1)CCCC2 686055606 IEJQPNSFGIAREV-OAHLLOKOSA-N 271.364 2.157 10 10 CECE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2[C@H](C)[C@H](O)C3)cc1 686186736 SLPCMVHGAMZLMM-RLYLYKIYSA-N 260.381 2.444 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(=O)O)CC[C@@H]2CCC[C@H]21 707740771 VKJIYGOOVUZGCZ-HOSYDEDBSA-N 252.318 2.310 10 10 CECE CN(c1ccc(CN)c(F)c1F)C(C)(C)CCO 688385777 XKARSBDBTIDGOL-UHFFFAOYSA-N 258.312 2.021 10 10 CECE CC[C@H](O)c1ccc(N(C)CC(C)(C)S(C)(=O)=O)cc1 713919321 PCBHQZSAKONZNS-AWEZNQCLSA-N 299.436 2.389 10 10 CECE CC(C)O[C@@]1(CNCc2cccc(F)c2O)CCOC1 722353789 GFWXBAGROXMLFU-OAHLLOKOSA-N 283.343 2.205 10 10 CECE Cc1ccc(O)c(CNc2ccccc2CC(N)=O)c1 71407804 GCOVDRBWXHSRKZ-UHFFFAOYSA-N 270.332 2.341 10 10 CECE CCCN(CCC)S(=O)(=O)Nc1ccc(O)cc1 776745196 FZIQLDAUTQAAGJ-UHFFFAOYSA-N 272.370 2.171 10 10 CECE Oc1ccc(Cl)cc1CN1CC[C@@]12CCOC2 1203664526 IVTBMKXAWLGQMF-ZDUSSCGKSA-N 253.729 2.410 10 10 CECE Cc1cc(C)c(C(=O)N2Cc3cccc(O)c3C2)[nH]1 1348789661 WEGIIVDIZJYGSL-UHFFFAOYSA-N 256.305 2.493 10 10 CECE CC(C)n1ccc(C(=O)NCC2(CN=[N+]=[N-])CC2)n1 2117724786 NQBRMZTUZIAAJW-UHFFFAOYSA-N 262.317 2.284 10 10 CECE CCC[C@H](CO)CN[C@@H](C)c1cc(OC)ccc1O 2120746957 DXLKZVAOLRXOKZ-RYUDHWBXSA-N 267.369 2.460 10 10 CECE CC(C)N1CCN(c2cc(Cl)c(CN)cc2F)CC1 2120879145 IJAOFHZUIYPECM-UHFFFAOYSA-N 285.794 2.468 10 10 CECE Cc1ncccc1/C=C\C(=O)NCc1ccc(O)c(O)c1 1545637408 SVDJVGGPGDYDBA-ALCCZGGFSA-N 284.315 2.131 10 10 CECE CCN[C@H](C)c1ccc(N2CC3(CC[C@H]3O)C2)cc1 2123114279 JFZMGLATQFUVAI-IUODEOHRSA-N 260.381 2.318 10 10 CECE CCNCc1ccc(N(CC)CCC(=O)O)c(OCC)c1 212047502 QWLSWUBQMKFEEQ-UHFFFAOYSA-N 294.395 2.496 10 10 CECE O=C(/C=C/c1ccc(O)c(O)c1)Nc1cnc2ccccn12 1632282565 DILQYCKRECGRHS-FNORWQNLSA-N 295.298 2.397 10 10 CECE O=C(Nc1cc[nH]n1)c1cc2cc(O)c(O)cc2s1 1631766801 LUPOOXCOMOLIHS-UHFFFAOYSA-N 275.289 2.288 10 10 CECE COC(=O)C1(NCCCN=[N+]=[N-])CC(C(F)(F)F)C1 1912199489 SWDRUGJJZDCACU-UHFFFAOYSA-N 280.250 2.161 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)[C@H]2COc3ccccc32)C1 1912190348 CGCZSERZYMFSQE-JQWIXIFHSA-N 272.308 2.321 10 10 CECE CCC[C@H]1CCC[C@@]1(NCCCN=[N+]=[N-])C(N)=O 1912161082 FBOUJNGPIHDVTR-JQWIXIFHSA-N 253.350 2.101 10 10 CECE [N-]=[N+]=NC1CCN(CC(=O)N2CCCCCC2)CC1 1912183429 PAZVNFRHRKMWSV-UHFFFAOYSA-N 265.361 2.164 10 10 CECE C[C@H](N[C@H]1C[C@@H]2CC[C@H](C1)O2)c1ccc(O)cc1O 2124956509 XJNSBWWTBLPGFS-XRRVDJEJSA-N 263.337 2.458 10 10 CECE O=C(CCc1cccc(O)c1)NCc1ccc(O)cc1O 1643104345 VCPKIIJQBVOJOJ-UHFFFAOYSA-N 287.315 2.052 10 10 CECE Cc1cc(C)c(C(=O)NCc2cc(O)ccc2O)cc1C=O 1643882457 YBPLWGVPXSIYIN-UHFFFAOYSA-N 299.326 2.457 10 10 CECE CCOc1ccc(CNC[C@@H](C)CCN)cc1C 258863474 IWAYPDLKRMINPI-LBPRGKRZSA-N 250.386 2.468 10 10 CECE CCc1cccc(C(=O)NCc2c(O)cccc2F)n1 1652298953 WCRVFTRLMRQURX-UHFFFAOYSA-N 274.295 2.419 10 10 CECE COc1cc(C)c(N(C)[C@@H](C)CC(=O)O)c(OC)c1 260291455 YMVCXKGTNKFNIU-JTQLQIEISA-N 267.325 2.312 10 10 CECE O=C(NCc1cccc(O)c1O)c1ccoc1Cl 1593738871 BAMLZNJELMXYCW-UHFFFAOYSA-N 267.668 2.274 10 10 CECE CC[C@@H](CO)Nc1c(N)cccc1Br 700007042 WIXLIBBQYMZCCQ-ZETCQYMHSA-N 259.147 2.214 10 10 CECE CN[C@@H]1CCc2cc(N3CC[C@H](C)[C@H]3CO)ccc21 2128315210 PNCPJNNKFWLKDV-IUIKQTSFSA-N 260.381 2.100 10 10 CECE OC[C@@H]1CCCN(c2ccc3c(c2)CC[C@@H]3O)CC1 2128314774 KIMBPGQVMLHMCU-WBMJQRKESA-N 261.365 2.265 10 10 CECE CC(C)(C)[C@@H]1[C@H](O)CCN1CCc1ccc(N)cc1 2128680205 QJBMKMYGABSMMV-CABCVRRESA-N 262.397 2.293 10 10 CECE CC1CC(CO)(CN[C@H](C)c2ccc(O)cc2O)C1 2128723408 YYJCWRGSBVVJDE-LOIXOFCESA-N 265.353 2.157 10 10 CECE CCCN1CCN(Cc2cccc(F)c2O)CC1 160194966 MEBFIIFDLSKHAD-UHFFFAOYSA-N 252.333 2.059 10 10 CECE CCCN(CCO)c1ccc(CNC)cc1Cl 163989841 GSGYRWDRQNVNGG-UHFFFAOYSA-N 256.777 2.268 10 10 CECE CCC1=NN(CC)C(=O)/C1=C/c1ccc2c(c1)OCCO2 1865671673 NLUSVWPPEDFMNL-FMIVXFBMSA-N 286.331 2.469 10 10 CECE CC[C@H](CNC)CN(C)c1cc2c(cc1C)OCO2 259063858 TVCWPSCYRHFQBN-GFCCVEGCSA-N 264.369 2.406 10 10 CECE COc1ccc(N2C[C@H](CO)CC2(C)C)cc1OC 259528638 VUVPHTHIMSLEHL-LLVKDONJSA-N 265.353 2.301 10 10 CECE NCc1ccc(N2CCCC[C@@H]2C2(O)CC2)c(F)c1 2130493371 CKDFXIPJVWCWRP-CQSZACIVSA-N 264.344 2.168 10 10 CECE CC(C)N1C[C@@H]2C[C@H]1CN2c1ccc([C@H](C)N)cc1 2131042751 YIJDJCMQVLCVAE-RCBQFDQVSA-N 259.397 2.378 10 10 CECE CC(C)N1C[C@H]2C[C@H]1CN2c1ccc(CN)cc1Cl 2131042709 XYTVDSZPLXKYMR-QWHCGFSZSA-N 279.815 2.470 10 10 CECE CC[C@@]12C[C@@H]1C(=O)N(c1cc(C)c(N)cc1C)C2=O 2132829343 CYOIQXNUANLJJN-MEBBXXQBSA-N 258.321 2.175 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@@H](O)[C@H]2C)cc1Cl 1914418641 HCHWFNUZPIOOPW-JRKPZEMJSA-N 255.745 2.353 10 10 CECE CC[C@H](c1ccccc1O)N1CC2(C[C@@H]2C(=O)O)C1 1914768837 VADHLHVKLQBDCF-VXGBXAGGSA-N 261.321 2.250 10 10 CECE CCN[C@H](C)c1ccc(N2CCO[C@@H](CO)C2)cc1Cl 221134121 PLVBLAWIEHYDHS-DGCLKSJQSA-N 298.814 2.208 10 10 CECE CC(=O)C(=O)[C@@H](O)c1ccccc1NC(=O)OC(C)(C)C 1919280210 ZYZQDBBAGAPWBU-ZDUSSCGKSA-N 293.319 2.225 10 10 CECE Cc1cccc(CN=c2cc[nH]cc2[N+](=O)[O-])c1O 2139744096 SQFCBSMNCGFCGO-UHFFFAOYSA-N 259.265 2.038 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@H]3CC[C@@]3(CN)C2)c1 2136674426 YUBWIOJQMUTVQU-WOSRLPQWSA-N 260.381 2.432 10 10 CECE C[C@H]1CCCC[C@]1(O)CNCc1cccc(O)c1O 2136796216 LBBJHBCTVFQHAJ-NHYWBVRUSA-N 265.353 2.129 10 10 CECE C[C@H]1[C@H]2CNC[C@H]2CN1[C@H](C)c1cc(F)ccc1O 227385182 JRUKQDOHCKNVAB-YAMSLAJTSA-N 264.344 2.132 10 10 CECE COc1cccc(O)c1CN[C@H](C)C12CC(CO1)C2 1967847903 DVEDXMBANCUKOO-RWWNRMGGSA-N 263.337 2.058 10 10 CECE COc1ccc(CNCC2CCC(O)CC2)c(O)c1 227641306 DLLGUXGQLBOIHS-UHFFFAOYSA-N 265.353 2.042 10 10 CECE Oc1ccccc1CNC1CCC2(CCNC2)CC1 1967988928 VVXXPLNKEZUZFC-UHFFFAOYSA-N 260.381 2.404 10 10 CECE CC(=O)NC1CCN([C@H](C)c2ccc(C)cc2O)CC1 228355528 MCJBHNIFIWIPOT-GFCCVEGCSA-N 276.380 2.362 10 10 CECE CN(C)c1ccc(CN2CC[C@@H](N)C3(CCC3)C2)cc1 1968001627 ODBDMXORMNEHPU-MRXNPFEDSA-N 273.424 2.456 10 10 CECE Nc1ccc(NC(=O)N2C[C@H]3CSC[C@@H](C3)C2)cc1 1968121606 MBPNSHJBQPKTNR-QWRGUYRKSA-N 277.393 2.486 10 10 CECE CCOC(=O)[C@H](CC)[C@H](N)c1ccc2c(c1)CCN2C 1927418466 KIYBJWQKNLFYQY-UKRRQHHQSA-N 276.380 2.268 10 10 CECE CN(CCc1cccs1)c1ccc2c(c1)NC(=O)[C@@H]2N 123368830 YRGCHQXBCFVYLD-CQSZACIVSA-N 287.388 2.379 10 10 CECE CC(C)[C@H](CN[C@H](C)c1c(O)cccc1O)N(C)C 232725550 DYWPFYSSXVSCMO-NEPJUHHUSA-N 266.385 2.335 10 10 CECE CCN(C(=O)c1cccc(O)c1O)c1ccncc1 233461900 HTEVVBVTHQJWLJ-UHFFFAOYSA-N 258.277 2.160 10 10 CECE CCNCc1ccc(N(C)C[C@@H](C)C(=O)NC)c(Cl)c1 233510931 YHVBZONQTRZJOB-LLVKDONJSA-N 297.830 2.268 10 10 CECE CCOC[C@H](C)O[C@H](C)C(=O)Nc1ccc(N)cc1 233786564 MJNZEJSARZQIJV-WDEREUQCSA-N 266.341 2.037 10 10 CECE CCc1occc1C(=O)NCc1cc(N)ccc1O 234154306 DZBINTFDMOPRTG-UHFFFAOYSA-N 260.293 2.060 10 10 CECE CNCc1ccc(OC)c(CS(=O)(=O)[C@H](C)C(C)C)c1 234416047 YWRKMKXJGOUBGE-GFCCVEGCSA-N 299.436 2.374 10 10 CECE CCCSC[C@](C)(O)[C@@H](N)c1ccccc1O 1943692822 YWOAVOUTKRXWMC-STQMWFEESA-N 255.383 2.286 10 10 CECE C[C@@H](O)c1ccc(N2CC(C)(CO)C2)c(Cl)c1 1951063381 QWHAVJDDBLRYBB-SECBINFHSA-N 255.745 2.212 10 10 CECE O[C@@H]1CC[C@H]2CN(c3ccc(CNC4CC4)cc3)C[C@H]12 252848145 DJXYUDRZKMPZRM-RRQGHBQHSA-N 272.392 2.146 10 10 CECE O=C(O)[C@@H](NCc1cc(F)ccc1O)C1CC(F)(F)C1 1973070946 HPPAETKAYFNICP-NSHDSACASA-N 289.253 2.119 10 10 CECE CO[C@H](CNCc1cc(F)ccc1O)C1CCOCC1 2150222866 JHDBUWNLVPRYPM-OAHLLOKOSA-N 283.343 2.063 10 10 CECE CCN(CC)c1ccc([C@H]2C[C@H](CN)CN2C)cc1 258388443 LUJICOIIXXTOMN-CZUORRHYSA-N 261.413 2.484 10 10 CECE Nc1ccc(NC(=O)NC2([C@@H]3CCCO3)CCC2)cc1 2150445397 SVBSZFCAVRNGTL-ZDUSSCGKSA-N 275.352 2.492 10 10 CECE CCOC(=O)c1cc(OC)c(O)c([C@H]2CCCN2)c1 260172589 MWNCOXPIQPTYKQ-LLVKDONJSA-N 265.309 2.002 10 10 CECE CN(Cc1ccco1)c1cc2c(cc1N)NC(=O)CC2 35701105 JDQJVDNPSSGXHM-UHFFFAOYSA-N 271.320 2.383 10 10 CECE C[C@H](N)c1ccc(N2C[C@]34CC[C@]3(COC4)C2)c(F)c1 2146559135 CKHWIBOTVBASOY-KNXALSJPSA-N 276.355 2.462 10 10 CECE CCN(c1ccc(CNC2CC2)cc1F)C1CN(C)C1 2146884677 JWMXXWMSYBRRAY-UHFFFAOYSA-N 277.387 2.218 10 10 CECE O=C1Nc2cc(N3CCC[C@H](C(F)F)C3)ccc2[C@@H]1O 2149793451 WZBXUHXQQDDHLE-UFBFGSQYSA-N 282.290 2.154 10 10 CECE O=C(O)C[C@H]1CCCN(Cc2ccc(O)cc2O)CC1 2149714126 XPNIJFMQMKIUDJ-NSHDSACASA-N 279.336 2.175 10 10 CECE Nc1ccc(NC(=O)C[S@@](=O)c2ccccc2)cc1 40961000 CQIWGISHUCDLSI-IBGZPJMESA-N 274.345 2.015 10 10 CECE C[C@@H](CNCc1cccc(O)c1O)N1CCCCC1 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2089725636 PCGNJPNXNDKGLQ-RCBQFDQVSA-N 261.365 2.481 10 10 CECE C[C@@H]1CO[C@@H](CN(C)c2ccc([C@@H](C)O)c(O)c2)C1 2109959819 GCOGIKRJKWUALT-DMDPSCGWSA-N 265.353 2.307 10 10 CECE CC1(C)CCc2cc(N3CC4(CNC4)C3)ccc2O1 2110241836 XCTBCCPFRXEXLY-UHFFFAOYSA-N 258.365 2.200 10 10 CECE C[C@@H](N[C@@H]1COCCC1(F)F)c1ccc(O)cc1O 2110390209 GTKQEBVMUJPBKF-PRHODGIISA-N 273.279 2.173 10 10 CECE CN[C@H](C)c1ccc(N(CCO)[C@H]2C[C@H]2C)c(F)c1 2110791040 ZRBWHNRZDIJQSC-HFAKWTLXSA-N 266.360 2.313 10 10 CECE CCC[C@H](C)[C@H](N)[C@@H](O)c1ccc2c(c1)CCN2C 2091261968 DZPSDTKSMCNUEL-UVBJJODRSA-N 262.397 2.476 10 10 CECE CN[C@H](C)c1ccc(N2CCOCC[C@@H]2C)cc1O 2092486268 APCDQJIRLLINIG-NWDGAFQWSA-N 264.369 2.288 10 10 CECE Cc1sccc1CNS(=O)(=O)Cc1ccc(N)cc1 2093079919 UQAFZTNGLNUOPZ-UHFFFAOYSA-N 296.417 2.258 10 10 CECE CCCn1nccc1CNCc1cc(F)ccc1O 2094296425 HYXNSXBHWQWFSN-UHFFFAOYSA-N 263.316 2.428 10 10 CECE Nc1ccc(CCN2CCC[C@@H]3OCC[C@@H]3C2)cc1 2095537896 DBXNNSFEQOUXMY-ZBFHGGJFSA-N 260.381 2.312 10 10 CECE C[C@H]1CCO[C@H]1CNCc1ccc2c(c1)CCN2C 2096108661 UNKSCZSHUCKFLZ-LRDDRELGSA-N 260.381 2.194 10 10 CECE Oc1cccc(CNCc2cc(C3CC3)no2)c1O 2096463333 NNNCTFNIRAUHRY-UHFFFAOYSA-N 260.293 2.253 10 10 CECE NC1CC2(CCCCN2Cc2cc(F)ccc2O)C1 2096855349 NVTRKWBDNSKFJI-UHFFFAOYSA-N 264.344 2.377 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H]2C[C@@H]2[C@@H]1C(=O)O 2096882151 JMECUOFZNDOPNM-PQFRYHKHSA-N 261.321 2.248 10 10 CECE C[C@H](NC1C[C@@H]2COC[C@H]2C1)c1ccc(O)cc1O 2099932862 GNPFOLZEAZEHJK-HBNTYKKESA-N 263.337 2.173 10 10 CECE C[C@@H]1CCCN([C@H](C)c2ccc(O)cc2O)[C@@H]1C(=O)O 2201052216 XDGGBABMYMRZCR-RULNRJAQSA-N 279.336 2.344 10 10 CECE COc1ccc(N2CCCN(C(C)C)CC2)c(N)c1 2113696069 WNHCKQJZIAQAQM-UHFFFAOYSA-N 263.385 2.198 10 10 CECE CNCc1ccc(N(CCOC)[C@H]2CCSC2)cc1 2113787741 SEKSFLYAQMAZHL-HNNXBMFYSA-N 280.437 2.364 10 10 CECE COc1cc(N(C)[C@@H]2COCCC2(F)F)ccc1CN 2204549175 MYCSEALIUGCPSY-CYBMUJFWSA-N 286.322 2.014 10 10 CECE COc1cc(N(C)C[C@H]2CC[C@H](OC)C2)ccc1CN 2204538929 LLLUZWXAOZKONC-WFASDCNBSA-N 278.396 2.405 10 10 CECE CNCc1ccc(N(C)C[C@@H]2C[C@@H]2COC)cc1OC 2204551556 XOPNVYWQOZNGPH-UONOGXRCSA-N 278.396 2.133 10 10 CECE COc1cccc(O)c1CN[C@H]1C[C@H]2CC[C@H]1[C@@H](O)C2 2204618625 VZWKOBRMFOFXTN-ZSEWYUTFSA-N 277.364 2.040 10 10 CECE Cc1cccc(CNCc2ccc(C(=O)O)nc2)c1O 2204623932 LRBYDQYHEFDKMG-UHFFFAOYSA-N 272.304 2.084 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CC(c2nncs2)C1 2269937219 QFQRVXWUZUGKEJ-JTQLQIEISA-N 274.393 2.470 10 10 CECE Cc1cc(N(C)[C@H]2[C@H]3[C@H]4[C@H]3C[C@@H]3[C@H]4[C@H]23)ccc1CCN 2208373051 NXHAHTZPASCFQM-CVTHGXEASA-N 268.404 2.443 10 10 CECE CCN1CCc2cc([C@@]3(O)[C@H]4[C@H]5[C@H]4C[C@@H]4[C@H]5[C@@H]43)ccc21 2208404759 GWUSLTUHWCHHIS-JVRBIKQJSA-N 267.372 2.398 10 10 CECE COc1ccc(N2CC[C@H](O)C23CCC3)cc1F 2219616663 HNYMSOUWQLUOPJ-ZDUSSCGKSA-N 251.301 2.328 10 10 CECE O=[N+]([O-])c1cc(CO)ccc1N1CC[C@H]2C[C@]2(F)C1 2230319275 CBJSGSMUXAINCF-GWCFXTLKSA-N 266.272 2.025 10 10 CECE COc1ccc(N2CCSCC2)c(C[C@H](C)N)c1 2220418530 AOUWAFLEYHRIJP-NSHDSACASA-N 266.410 2.138 10 10 CECE COc1ccc(N(C)CCCF)c(C[C@@H](C)N)c1 2220418863 FNRVHEPFBUPUNN-LLVKDONJSA-N 254.349 2.381 10 10 CECE COC(=O)C1(CN2CCC(N=[N+]=[N-])CC2)CCCC1 2230930480 FGGCXFDTOVQPDE-UHFFFAOYSA-N 266.345 2.495 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CC(CCN(C)C)C1 2232106801 RNRYIAITMZNFRA-ZDUSSCGKSA-N 262.397 2.436 10 10 CECE Cc1cc([C@@H](C)O)ccc1N(C)Cc1ncccn1 2232103650 BONNTTYBANSUCL-GFCCVEGCSA-N 257.337 2.475 10 10 CECE Cc1ccc([C@@H](C)NC[C@@H](C2CC2)S(C)(=O)=O)c(O)c1 2232823940 SALXYGVANJOGHU-ABAIWWIYSA-N 297.420 2.174 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)C1=C(C(=O)O)CCCC1 2234171383 LLVZUSHDSNZKOQ-MNOVXSKESA-N 278.312 2.289 10 10 CECE C[C@]1(C(=O)N2CCC(N=[N+]=[N-])CC2)CC[C@@]1(C)C(=O)O 2234245639 FDPFHNCEHPYWNH-OLZOCXBDSA-N 280.328 2.179 10 10 CECE CCOc1ccc(N2C[C@H](CO)OC3(CCC3)C2)cc1 2235091633 IFWHLHLIFBRFRE-OAHLLOKOSA-N 277.364 2.206 10 10 CECE COc1ccc(N2C[C@@H](CO)[C@@H](C(F)(F)F)C2)c(F)c1 2235116073 ALOIMLZWUQUYIF-WPRPVWTQSA-N 293.260 2.441 10 10 CECE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1csc2cncn12 2225791812 HPNUBDFQABCTJM-SFYZADRCSA-N 276.325 2.357 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@H](C2)N3C)c(C=O)c1 2235994686 LOPMUVIHJSSKMV-OKILXGFUSA-N 274.364 2.181 10 10 CECE COc1ccc(N(C)C[C@@H]2CCO[C@H]2C)c(C(=O)O)c1 2235951679 GKHADGCEOJKJKZ-QWRGUYRKSA-N 279.336 2.255 10 10 CECE COc1ccc(N(C)[C@H]2C[C@@H]3CC[C@H](C2)O3)c(CN)c1 2235971438 BDUSEOMBJNNUGL-XMQYKBBCSA-N 276.380 2.300 10 10 CECE CCNCc1cc(OC)ccc1N1CC[C@H](O)C[C@@H]1C 2235966494 UGZPSOMNDOPDKS-JSGCOSHPSA-N 278.396 2.154 10 10 CECE COc1ccc(N2CC(COC(C)C)C2)c(CCN)c1 2235975183 QKINTDRSAKGRQC-UHFFFAOYSA-N 278.396 2.058 10 10 CECE OC[C@@H]1[C@H]2C[C@@H]2CN1c1ccc(OC(F)(F)F)cc1 2226544589 IWVFRQJLHHNNJB-JFUSQASVSA-N 273.254 2.402 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CCO3)CC[C@@H]1CCO 2226748926 ZEOZVNUVNGQKJR-QWHCGFSZSA-N 261.365 2.466 10 10 CECE CC1(C)[C@H]2C[C@H]1CN(c1ccc3c(c1)NC(=O)[C@@H]3N)C2 2237478271 PXSUJWBJPFDGHY-PKFCDNJMSA-N 271.364 2.121 10 10 CECE COc1ccc(N2CCC[C@@H](O)[C@H]2C)c(OC)c1C 2277976497 GFDSFZYXXCUYFY-DGCLKSJQSA-N 265.353 2.362 10 10 CECE C[C@H]1SCC[C@]1(Oc1ccc(N(C)C)cc1)C(=O)O 2229387822 REPFCPPYVJAZIP-QMTHXVAHSA-N 281.377 2.480 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)[C@H]1CCCC[C@H]1O 2239635090 BOFYMRXUDKABTB-OLZOCXBDSA-N 299.392 2.054 10 10 CECE OC[C@@H]1CCN(c2ccc(CNC3CCC3)cc2F)C1 2240012072 XETDGWOUULQHHV-CYBMUJFWSA-N 278.371 2.286 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)[C@H](C)[C@H](C)S(C)(=O)=O 2240754641 ATADOXOBKGIYFL-XQQFMLRXSA-N 298.452 2.273 10 10 CECE CCOC[C@H]1CN(c2ccc([C@H](C)O)cc2C)CCO1 2240841377 GKONHRYIJKBLHT-DZGCQCFKSA-N 279.380 2.290 10 10 CECE Cc1cc(N2CCN(C)C(=O)C2(C)C)ccc1[C@H](C)O 2285175232 RSGQGNSISPZZOX-LBPRGKRZSA-N 276.380 2.105 10 10 CECE CSc1ncc(CNC[C@H]2C[C@@H]3CC[C@H](C2)N3)s1 2257133521 VHOIXWFBHIQOJG-RTCCRHLQSA-N 283.466 2.485 10 10 CECE CNCC(C)(C)N(C)[C@H](C)c1c(O)cccc1O 2260457811 SQOIMLAZOSWBAN-SNVBAGLBSA-N 252.358 2.089 10 10 CECE CN(C)c1ccc([C@]2(O)[C@H]3CC[C@@H]2C[C@H](N)C3)cc1 2270440726 FQYKYTFSJZNZAL-NAMSHAPFSA-N 260.381 2.088 10 10 CECE CN[C@H]1CCc2cc(N3C[C@H]4COC[C@H]3C4)ccc21 2271367173 PFJYFZODIIBWIC-PEYYIBSZSA-N 258.365 2.118 10 10 CECE C[C@@H]1CCN(C(=O)COc2ccc(N)cc2)C1(C)C 2271327580 SNCBWGOQDWPZKS-LLVKDONJSA-N 262.353 2.295 10 10 CECE CC1(C)CN(c2ccc(OC(F)F)cc2)C[C@H]1O 2263935215 NPCITSADQWITEY-LLVKDONJSA-N 257.280 2.495 10 10 CECE COc1ccc(N2CCC[C@H]3CCNC[C@H]32)cc1F 2274450462 RKCGEOIZHZJGCV-SMDDNHRTSA-N 264.344 2.413 10 10 CECE C[C@@H]1[C@H]2CNC[C@@H]2CN1c1ccc(OC(F)F)cc1 2278483896 NOPIVKKHTNORNI-GIPNMCIBSA-N 268.307 2.332 10 10 CECE O=C1NC(=S)SC1=CC1=Cc2ccccc2OC1 2296716989 SOCCRKZXYHAIPZ-UHFFFAOYSA-N 275.354 2.494 10 10 CECE COc1ccc(N(CCN)C2CCOCC2)c(C)c1C 2284606501 LFJXMZRJVNHQRZ-UHFFFAOYSA-N 278.396 2.256 10 10 CECE Cc1cc(N2CCS(=O)(=O)C(C)(C)C2)ccc1[C@@H](C)N 2285126908 IBSWLGBDIZQTRY-GFCCVEGCSA-N 296.436 2.028 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N(C)CC(F)(F)C(=O)O 2295303672 MMMGNJVVCKKUND-JTQLQIEISA-N 286.322 2.465 10 10 CECE COc1ccc(N2C[C@H](C)C[C@@H](CO)C2)c(OC)c1C 2295374986 FZOWQWUGVIFFQJ-DGCLKSJQSA-N 279.380 2.467 10 10 CECE COCCCCCCOC(=O)COc1ccc(N)cc1 2286987105 OBOTWFLLSFMIQD-UHFFFAOYSA-N 281.352 2.398 10 10 CECE Nc1ccc(O)c(CN2CCC3(CC[C@H](O)C3)CC2)c1 2288002472 JMMRFDVSZQFJRM-AWEZNQCLSA-N 276.380 2.101 10 10 CECE CCN[C@@H](C)c1ccc(N(CCOC)C[C@@H](C)O)cc1 2288053122 CLWDWLXYVAGKBL-KGLIPLIRSA-N 280.412 2.191 10 10 CECE CCNCc1cc(OC)ccc1N1CC[C@@H](O)[C@H]1CC 2288910151 NLCZHNOYAIBIBK-GDBMZVCRSA-N 278.396 2.154 10 10 CECE Cc1ccc2ncc(C=C3SC(=S)NC3=O)n2c1 2302310638 BFICMHCXAPIUEW-UHFFFAOYSA-N 275.358 2.132 10 10 CECE C[C@H]1C[C@H](C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])CCO1 2312333232 DHLFDTMBKBOQIL-ZDCRXTMVSA-N 252.318 2.149 10 10 CECE Oc1c(F)cccc1CN[C@@H]1CC[C@H]2C[C@@H]1CO2 2312742906 SKKAXTIVAMLYAC-NTZNESFSSA-N 251.301 2.188 10 10 CECE CO[C@H](C)CCSCC(=O)Nc1ccc(N)cc1 2315291716 NQBYTQZJMSSJKD-SNVBAGLBSA-N 268.382 2.366 10 10 CECE CCCn1nccc1C(=O)N(CC)CCN=[N+]=[N-] 2315990270 LVMYSWTVYNYRTC-UHFFFAOYSA-N 250.306 2.066 10 10 CECE CC[C@H](c1ccccc1O)N1C[C@@H]2C[C@H]1[C@H]2C(=O)O 2333051619 KXJLFUGUMBUFHE-TWJQMWNJSA-N 261.321 2.248 10 10 CECE Oc1c(F)cccc1CNC[C@@H]1CC[C@@H]2C[C@H]1CO2 2334122567 IXHGJUXEOLRHHW-WCFLWFBJSA-N 265.328 2.436 10 10 CECE CCNCc1ccc(N2C[C@@H](O)[C@H]2C)cc1C1CC1 2339159880 HVTZMUMQHSZDBC-BDJLRTHQSA-N 260.381 2.243 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@H]2CC[C@H]1[C@H](O)C2 2349959202 GSPARFHUMYOBRO-GUYJKWIASA-N 260.381 2.364 10 10 CECE OC[C@]12CC[C@H](C[C@@H]1NCc1ccc(F)c(F)c1O)C2 2354525893 YBVQUJYPCKGHLU-MURWCNHISA-N 283.318 2.311 10 10 CECE O=C1O[C@@H](CNCc2ccccc2)c2ccc(O)c(O)c21 33875211 PYBLDNUYDFLEMS-ZDUSSCGKSA-N 285.299 2.099 10 10 CECE CCCNCc1ccc(N(C)[C@@H](C)CO)c(F)c1 122680810 HSZZRRGNODPMOF-NSHDSACASA-N 254.349 2.142 10 10 CECE COc1ccc(CC(=O)N(C)Cc2ccc(N)cc2)cc1 35360141 CCPXCFDHGGTFDK-UHFFFAOYSA-N 284.359 2.479 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H](C)N2CCOCC2)c1 184934272 LPSWGAAPOCUUQP-KGLIPLIRSA-N 278.396 2.072 10 10 CECE CC(C)N(Cc1ccc(N)cc1)c1ccc(C(N)=O)cn1 37671752 IYSQYFLKHKRXDJ-UHFFFAOYSA-N 284.363 2.178 10 10 CECE CCN(CCCOc1ccc(N)cc1)CCOC 42491871 MTJZQZWSRYXMRC-UHFFFAOYSA-N 252.358 2.006 10 10 CECE CCN[C@@H](C)c1ccc(N2CCN3C(=O)CC[C@H]3C2)cc1 228053197 MIOPOGISEWDJRC-BBRMVZONSA-N 287.407 2.168 10 10 CECE CN(C)Cc1cc(CN(C)C)c2cccnc2c1O 196109321 KBVKCJMJBNCHBM-UHFFFAOYSA-N 259.353 2.064 10 10 CECE O=C(CNCCc1ccccc1)c1ccc(O)c(O)c1 80310255 QASFXHGAGRXGIY-UHFFFAOYSA-N 271.316 2.113 10 10 CECE CS[C@H](C)CCNCc1ccc(O)c(O)c1O 226753384 ARJPVMOLTRDBHM-MRVPVSSYSA-N 257.355 2.035 10 10 CECE CN1CCC[C@@H](NCc2cc(Br)ccc2O)C1 227439031 WPMYUCULHVFJOC-GFCCVEGCSA-N 299.212 2.339 10 10 CECE C[C@@H](c1ccc(N(C)C)cc1)N1CCC[C@@H]2CNC[C@@H]21 221278611 KEVXEXMMYCTGTL-LXZKKBNFSA-N 273.424 2.497 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])c1ccc(OC)c(F)c1 90259645 WOEWRIUGMUNFKZ-LBPRGKRZSA-N 296.302 2.338 10 10 CECE COC(=O)C[C@@H](C)NCc1cc(Cl)ccc1O 383397095 MKVHXFFTADJEBK-MRVPVSSYSA-N 257.717 2.087 10 10 CECE COc1ccc(O)c(CN[C@H]2CCOC2(C)C)c1 294943704 YCCAOWNEHBUSRQ-ZDUSSCGKSA-N 251.326 2.058 10 10 CECE CC[C@H](N)c1cc(Br)cc(C(=O)O)c1O 95713468 RIXNTZJMNIFZHS-QMMMGPOBSA-N 274.114 2.263 10 10 CECE COC1(CN[C@@H](C)c2c(O)cccc2O)CCC1 234744931 IJNZJKUIQLDMAU-JTQLQIEISA-N 251.326 2.318 10 10 CECE CO[C@H]1CCN(c2ccc(/C=C/C(=O)O)cc2F)C1 234972044 WGSLYGKQMZPQSW-TZNOJPMFSA-N 265.284 2.149 10 10 CECE COc1cc2c(c(OC)c1)N1CC(C)(C)NC[C@H]1CC2 527419830 GRKPRWVQAFIEME-GFCCVEGCSA-N 276.380 2.207 10 10 CECE Cc1ccc(/C=C\C(=O)NCCc2ccc(O)c(O)c2)o1 254981314 UPAXYCDOSOKLCL-ALCCZGGFSA-N 287.315 2.371 10 10 CECE C[C@H](CO)c1c(O)c(O)cc(Br)c1F 258572002 XTWUUWZXPCEJEE-SCSAIBSYSA-N 265.078 2.095 10 10 CECE CN1CCc2cc(CNC[C@H]3CCC[C@H]3C(=O)O)ccc21 250370758 IKSSICFYLKOJCA-HUUCEWRRSA-N 288.391 2.269 10 10 CECE O=C(NCCCc1ccccn1)NCc1ccccc1O 269481906 MUCWBGONTCFKEE-UHFFFAOYSA-N 285.347 2.219 10 10 CECE C[C@H](CCNC(=O)COc1ccc(N)cc1)C(F)(F)F 2166594309 AQOZASXQXDDUSP-SECBINFHSA-N 290.285 2.352 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1nccnc1C 2164021273 NCCBAUMGGKWUFD-MRXNPFEDSA-N 268.364 2.086 10 10 CECE Oc1cccc(CNCc2nc3c(s2)CCC3)c1O 719642300 YRMMQOZIDRELNR-UHFFFAOYSA-N 276.361 2.333 10 10 CECE CCCN(CC(=O)N(C)C)c1ccc([C@H](C)N)cc1F 723191292 HZRIVSFKISNJDQ-NSHDSACASA-N 281.375 2.150 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2CO[C@H](C)C2)cc1 2163100487 RNLDAOOBZJJRGB-INWMFGNUSA-N 277.412 2.462 10 10 CECE CO[C@@]1(CN(C)c2ccc([C@H](C)O)cc2)CCCOC1 2166163839 NCVXAKLGIXPHIR-XJKSGUPXSA-N 279.380 2.372 10 10 CECE COC(=O)N1C[C@H]2CC[C@H]1[C@H](NCc1ccccc1O)C2 818234032 GSQDDGAOAMVFGR-YUTCNCBUSA-N 290.363 2.101 10 10 CECE O=C(O)/C=C\c1ccc(N2C[C@H](F)[C@H](F)C2)cc1 714590461 XLAJUNVQEUQJPC-KHQOXSAWSA-N 253.248 2.281 10 10 CECE CC[C@@H](N)c1ccc(N(CC)CC(=O)N(C)C)cc1 723194599 DJPAHVCQEBKMBY-CQSZACIVSA-N 263.385 2.011 10 10 CECE C[C@@H]1CN(C)C[C@@H]1Nc1c(N)cccc1Br 722290702 UKIYGUIAUWRMFK-KCJUWKMLSA-N 284.201 2.393 10 10 CECE Cc1cc(O)c(CN(C)C[C@H]2COCCO2)c(Cl)c1 827139468 BBQMLTPCYMZNSY-NSHDSACASA-N 285.771 2.201 10 10 CECE C/C=C/[C@H](O)C(=O)NCc1ccc(N(CC)CC)c(F)c1 900637630 QSVNYRNZRIITBU-SZTZYQKNSA-N 294.370 2.225 10 10 CECE C[C@H](NC(=O)c1cnc(C2CC2)nc1O)c1ccccc1O 913763623 LNQPLFABOMGRIV-VIFPVBQESA-N 299.330 2.256 10 10 CECE CCO[C@@H]1CN(Cc2cc(Cl)cc(C)c2O)C[C@H]1CN 844903607 HLUFXQBGCFESJS-TZMCWYRMSA-N 298.814 2.150 10 10 CECE CO[C@@H](C(=O)NCc1cc(Cl)ccc1O)C1CCC1 855022752 IDIBRRKJHWQWSE-CYBMUJFWSA-N 283.755 2.477 10 10 CECE COc1cccc([C@H](C)N[C@H]2C[C@@H](C)n3ncnc32)c1O 850499458 PYBYDRZKWWWHLW-SCVCMEIPSA-N 288.351 2.349 10 10 CECE CN[C@@H](C)c1ccc(N2CCC[C@@H]2COC)cc1O 696544968 MJJMUUCZQKCCNW-WCQYABFASA-N 264.369 2.288 10 10 CECE CO[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 930934626 LZOQMOSSKHINNP-HZPDHXFCSA-N 288.391 2.328 10 10 CECE Cc1cc(N2CC(N3CCCC3)C2)ccc1C[C@@H](C)N 697781087 MLXRXWVNWPMUFS-CQSZACIVSA-N 273.424 2.169 10 10 CECE COc1ccc(N2CC[C@H](N[C@@H]3CCOC[C@H]3C)C2)cc1 850489387 SUKPMRCEJXXAGN-JKIFEVAISA-N 290.407 2.289 10 10 CECE COC[C@]1(C)CN(Cc2cc(C)cc(C)c2O)CCO1 863340398 KOPDNFJCFVSRQJ-INIZCTEOSA-N 279.380 2.246 10 10 CECE 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CCOc1cccc(CNC[C@H]2CCO[C@@H]2C)c1O 233789851 NKBZTDFGSDNDMD-VXGBXAGGSA-N 265.353 2.306 10 10 CECE COCCN(C[C@H]1CCCN1)[C@@H](C)c1ccccc1O 234746486 DFWMOCTWNOEDFW-UONOGXRCSA-N 278.396 2.154 10 10 CECE CN(C)c1ccc2nc(-c3cccc(O)c3O)[nH]c2n1 126597636 OPLXIOSOQRLYFP-UHFFFAOYSA-N 270.292 2.102 10 10 CECE C[C@](CO)(NCc1ccc(Cl)cc1O)C1CC1 1942798153 YETJWBQAQBVXHU-CYBMUJFWSA-N 255.745 2.296 10 10 CECE C[C@H](N[C@@H]1CCCCC[C@H]1O)c1cc(O)ccc1O 252847828 DGONVMCHNJMNGO-PSOPSSQASA-N 265.353 2.442 10 10 CECE Nc1ccc(O)c(CNc2cccc3nccn23)c1 128018839 LSMKSCBBSTYDKR-UHFFFAOYSA-N 254.293 2.234 10 10 CECE C[C@@H]1CN(C(=O)COc2ccc(N)cc2)CC[C@H]1C 129099349 ZQDFEGKNAFNQMC-VXGBXAGGSA-N 262.353 2.152 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@H](CCO)CC2)cc1O 2149741932 UPRFFQQCELIBAE-OLZOCXBDSA-N 279.380 2.434 10 10 CECE CC(C)(C)OC(=O)C[C@](C)(N)c1c(O)cccc1F 1951842567 IVIITDSCWLWFPC-AWEZNQCLSA-N 269.316 2.437 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H](N)[C@@H]1c1cccc(O)c1O 1952308558 MTEPHXSEOLQHTF-PWSUYJOCSA-N 294.351 2.107 10 10 CECE CN(CCN=[N+]=[N-])C1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12 1954207586 XUSKTMIGXCGJFT-UWVGGRQHSA-N 281.360 2.094 10 10 CECE CO[C@H]1C[C@H]2C[C@H]1C[C@H]2NCc1cccc(F)c1O 1974115018 VYTTVNHBCGGFOL-WVWOOGAGSA-N 265.328 2.434 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)CCCc2cccnc21 2148161272 LOFLDCGNUCNEDZ-ZBFHGGJFSA-N 270.332 2.011 10 10 CECE C[C@H](O)c1ccc(N2CCOC[C@@]2(C)C2CC2)cc1O 2144679690 AMDAZGHWBNPRFA-ZBEGNZNMSA-N 277.364 2.451 10 10 CECE COC(=O)CC[C@H](N)c1c(C)c(F)cc(C)c1O 260107268 NLWHVLTXTAAJGX-JTQLQIEISA-N 255.289 2.101 10 10 CECE CCOC(=O)C[C@@]1(c2ccccc2O)CCCCN1 260638890 PRXONFODVKRFES-OAHLLOKOSA-N 263.337 2.314 10 10 CECE O=C1[C@@H](NCc2c(O)cccc2Cl)CCCN1C1CC1 2145564573 IVJKYEWOLDMVOV-ZDUSSCGKSA-N 294.782 2.289 10 10 CECE CCCN[C@H](C)c1ccc2c(c1)CCN2CC[S@](C)=O 2145838097 VUWPMOMQWRRHHY-XCLFUZPHSA-N 294.464 2.488 10 10 CECE CCc1nnc(CN2CCc3cc([C@@H](C)N)ccc32)o1 2145825182 AAYIQHVNAAYFBP-SNVBAGLBSA-N 272.352 2.214 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCC[C@H](C2CNC2)C1 2149008048 XSGRNQHLNGPHGZ-NEPJUHHUSA-N 276.380 2.090 10 10 CECE N[C@H]1CCCN(Cc2c(O)ccc3ccccc23)C1 41027835 JDRJFVBYLLDQGI-ZDUSSCGKSA-N 256.349 2.469 10 10 CECE CN1CCc2cc(CN[C@H]3CC[C@@]34CCCO4)ccc21 2160725893 PEHACXJLWKNRNV-IRXDYDNUSA-N 272.392 2.480 10 10 CECE CCN[C@H](C)c1ccc(N2CC[C@H]([C@@H](C)O)C2)cc1O 167820517 DFXABRIUXKNLSO-UPJWGTAASA-N 278.396 2.270 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCN2CCCC[C@H]1C2 2154250767 HOHWZXCNDSLMSJ-OLZOCXBDSA-N 276.380 2.329 10 10 CECE COc1cc([C@@H](N)c2ccccc2O)cc2c1OCO2 2154717581 OGBOUJHCSOYPPY-CQSZACIVSA-N 273.288 2.178 10 10 CECE CCN1CCC(CN[C@H](C)c2ccc(O)cc2O)CC1 44517522 GBSHMONOJQJKLY-GFCCVEGCSA-N 278.396 2.480 10 10 CECE COC[C@H]1C=CCN1c1ccc(CO)cc1Br 2011266408 OAJYGGWIYNCUBH-LLVKDONJSA-N 298.180 2.333 10 10 CECE CN(C)c1ccc(CNc2ccnc3ccnn23)cc1 2160481702 VUFSOLIFDFQXEU-UHFFFAOYSA-N 267.336 2.407 10 10 CECE N[C@H]1CN(Cc2c(O)cccc2Cl)[C@@]2(CCCOC2)C1 2156299217 DFGPITAHFQOOCK-ABAIWWIYSA-N 296.798 2.128 10 10 CECE CN(Cc1c(O)ccc2ccccc12)[C@@H]1[C@@H]2CNC[C@@H]21 2159782123 ORNHJWRFXVUGLP-XOIINTDNSA-N 268.360 2.195 10 10 CECE CCN[C@H](c1ccccc1O)[C@](C)(O)C(F)(F)F 2031152013 BEVSDNKPSKAGBB-MNOVXSKESA-N 263.259 2.356 10 10 CECE COc1ccc(N(C)[C@H]2CCOC[C@@H]2C)c(N)c1 2031911122 LWEAJHSTKHZMOK-GWCFXTLKSA-N 250.342 2.139 10 10 CECE CCN(C)[S@@](=N)(=O)N(C)[C@@H](C)c1ccccc1O 2036699458 BRZUJOHVKMKFPW-XTZNXHDOSA-N 271.386 2.213 10 10 CECE O=C(CN1CC[C@H](C2CC2)C1)c1ccc(O)c(O)c1 400253798 VZPWPTOFJSWRKQ-LBPRGKRZSA-N 261.321 2.012 10 10 CECE Oc1ccc(-c2nc([C@@H]3CCSC3)no2)cc1O 405230043 UOKLMERNIQSOSR-MRVPVSSYSA-N 264.306 2.368 10 10 CECE CCn1nncc1N(Cc1ccc(N)cc1)C(C)C 311295571 TWWYQJHTNWNQHO-UHFFFAOYSA-N 259.357 2.295 10 10 CECE CCNCc1ccc(N(C)CCOCCOC)cc1C 313578182 XCONOGLJOVJVBS-UHFFFAOYSA-N 280.412 2.204 10 10 CECE Fc1cc(OC[C@@H]2CC2(F)F)ccc1N1CCNCC1 701100453 XBPBLYALYVKULP-JTQLQIEISA-N 286.297 2.269 10 10 CECE CCCN([C@H]1CCNC1=O)[C@@H](CC)c1ccccc1O 2171236632 NUXSTSJICQPIOC-KBPBESRZSA-N 276.380 2.444 10 10 CECE CN(C)c1ccc([C@@H](N)c2cn(C)nc2C(F)F)cc1 2178747782 JLRHLFFIDRSITC-GFCCVEGCSA-N 280.322 2.472 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cncc(Cl)n2)C1 701315587 FOFATRDBXFTXMT-ZETCQYMHSA-N 266.692 2.045 10 10 CECE Cc1ncccc1[C@@H](C)NC(=O)c1ccc(O)c(O)c1 2176558862 IKNPCGLQKHHBTC-SNVBAGLBSA-N 272.304 2.292 10 10 CECE OCc1ccc(N2CCO[C@@H]([C@H]3CCOC3)C2)c(Cl)c1 2171691523 RZQJJMCZRQTAHW-SWLSCSKDSA-N 297.782 2.074 10 10 CECE CC[C@@H](NCc1ccc(F)c(F)c1O)C(C)(C)O 703230747 WRSVCZOWPKTQHV-SNVBAGLBSA-N 259.296 2.310 10 10 CECE CCN(CC)C[C@@H](C)NCc1ccc(F)c(F)c1O 703229015 FKPNJWDICSBHTK-SNVBAGLBSA-N 272.339 2.490 10 10 CECE COC[C@@H]1CN(c2ccc3c(c2)CC[C@H](C)N3)CCO1 705875041 ZPMXYIFMZDLIRC-WFASDCNBSA-N 276.380 2.285 10 10 CECE CCOC[C@@H]1CN(c2ccc(CO)cc2Cl)CCO1 705842874 JVPXCIFETPWLRB-LBPRGKRZSA-N 285.771 2.074 10 10 CECE CCCN[C@H](C)c1ccc(N2CCO[C@H]3C[C@H]32)cc1O 2171801915 GTRIXFQTFIIIQM-XFJVYGCCSA-N 276.380 2.430 10 10 CECE Nc1ccc(OCCC(=O)N[C@@H]2CCCC23CC3)cc1 706562031 AYWGOPHBOBTDDT-CQSZACIVSA-N 274.364 2.487 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC([S@@](C)=O)C2)c(F)c1 2171956905 MKSCXRFJHXHROT-PRWKNARSSA-N 298.427 2.453 10 10 CECE C[C@@H]1CN(Cc2cc(F)cc(F)c2O)CC[C@H]1N(C)C 708433559 LUDXNDQTYNAUKB-QMTHXVAHSA-N 284.350 2.442 10 10 CECE CCC[C@H]1CN(c2ccc(CO)cc2F)CCO1 708945966 OSNLVSJJUKYEDD-LBPRGKRZSA-N 253.317 2.323 10 10 CECE CNCc1ccc(N(C)[C@@H](CO)C(C)(C)C)cc1 689782237 UVYBPUIBTFSGND-AWEZNQCLSA-N 250.386 2.249 10 10 CECE CN1CCCc2cc([C@]3(N)C[C@@H]4OCCC[C@@H]43)ccc21 2163096656 JFENWMFCQGUKCR-BHYGNILZSA-N 272.392 2.422 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3NC[C@H]4CCC[C@@H]43)ccc21 2163072727 ZDPYVFAWVADJFE-WTTBNOFXSA-N 272.392 2.100 10 10 CECE CN(C)Cc1ccc(N2CCN3CCC[C@H]3C2)cc1 709712664 MVSXCZLWRRTSPC-INIZCTEOSA-N 259.397 2.033 10 10 CECE COc1ccc(N(C)CCc2nccs2)c(N)c1 688693053 NGZAGPCBTKNHHZ-UHFFFAOYSA-N 263.366 2.413 10 10 CECE COC(=O)[C@@]1(NCCN=[N+]=[N-])CCCC[C@H]1C1CC1 709940657 FJHUABKQNFCMOJ-WCQYABFASA-N 266.345 2.398 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H]3CC(C)(C)CN3)ccc21 2163106335 IZXUKNMJAKFNPC-GOEBONIOSA-N 274.408 2.491 10 10 CECE CCN(CC)c1ccc([C@H](NN)[C@@H]2COC[C@H]2C)cc1 2163157172 ZFWQCGFOSVNBBD-WQVCFCJDSA-N 277.412 2.320 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@]23COC[C@H]2C3)c1 689213099 HUOVIBZTDXLTLD-FIXISWKDSA-N 263.337 2.088 10 10 CECE CN1CCCc2cc([C@H](N)[C@H](O)[C@H]3CC34CC4)ccc21 2163243710 QPQHWTGHPPNJBY-VNQPRFMTSA-N 272.392 2.230 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CCN2CC[C@H]1C2 381697015 NRNRDUNMDFNIMR-INIZCTEOSA-N 273.424 2.387 10 10 CECE Oc1ccc(CNCC2C[C@H]3[C@H](C2)C3(F)F)c(O)c1 693353710 RSGSRDCYGIOWAO-RYUDHWBXSA-N 269.291 2.479 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCn1cncn1 382054634 ZCHQRANWGGUSFN-RYUDHWBXSA-N 272.352 2.130 10 10 CECE CCOCCCN(C)c1ccc([C@H](C)N)c(O)c1 382779664 DSYDWARZRUNIAL-NSHDSACASA-N 252.358 2.275 10 10 CECE CCS[C@H]1CCN(C(=O)COc2ccc(N)cc2)C1 383142883 FTPQCPSAVQAGLB-ZDUSSCGKSA-N 280.393 2.002 10 10 CECE C[C@H](c1ccc(O)cc1O)N(C)C1(C(=O)O)CCCC1 383936582 WRAYUVSWMUPGNV-SNVBAGLBSA-N 279.336 2.488 10 10 CECE CCCN[C@H](C)c1ccc(N2C[C@@H](C)[C@@H](O)C2)cc1O 387998170 YUCKYVVKLOTLBQ-HSMVNMDESA-N 278.396 2.270 10 10 CECE CCO[C@@H]1CCC[C@](NCCCN=[N+]=[N-])(C(=O)O)C1 721160217 OWHXSTVJOLJWPM-ZYHUDNBSSA-N 270.333 2.079 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@@H](C(C)(C)O)C2)cc1O 721790743 QSFXOHPDQCKOQS-GHMZBOCLSA-N 264.369 2.009 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CC[C@@H](CCN)C1 723689592 HVOYLXRCPAQBCB-WDEREUQCSA-N 252.333 2.263 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1[C@H]2CC[C@@H]1CNC2 723865164 QYOBSVOQJPLOMX-ZMLRMANQSA-N 250.317 2.029 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2cnc(C)[nH]2)c1 724678023 ZSKZPNGNHVJZRQ-SECBINFHSA-N 261.325 2.283 10 10 CECE C[C@@H](Nc1c(N)cccc1C(=O)O)C1CCN(C)CC1 396497771 SLQXJCHVDOOLGA-SNVBAGLBSA-N 277.368 2.109 10 10 CECE C[C@H](C[S@](C)=O)N(C)c1ccc(CN)cc1Cl 399265175 RUJDCAQURNXDDG-XLFHBGCDSA-N 274.817 2.002 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)[C@H](C)[C@H]1C 399558764 VTACCIUUBJMPDG-JNIYBQFBSA-N 273.380 2.144 10 10 CECE Oc1c(F)cccc1CNC[C@H]1CC12CCOCC2 780028412 VXEIPUXQUCUEKC-GFCCVEGCSA-N 265.328 2.438 10 10 CECE Nc1ccc(CCCN2CC[C@@H](C(=O)O)C23CC3)cc1 2179710373 OQXAPDOEURGPCG-AWEZNQCLSA-N 274.364 2.141 10 10 CECE COc1ccc(O)c(Cn2nc(C3CC3)cc2C=O)c1 2069985261 FMKXMHBUKVFCTF-UHFFFAOYSA-N 272.304 2.336 10 10 CECE CN(Cc1ccccc1O)Cc1n[nH]c2c1CCC2 1232431009 GWYWASDKFLQHEK-UHFFFAOYSA-N 257.337 2.236 10 10 CECE C[C@H](O)c1ccc(N2CCN(C3CC3)C(=O)C2)c(Cl)c1 2170568372 OHLKZMHIJOUDJO-JTQLQIEISA-N 294.782 2.204 10 10 CECE Cc1cc(N(C)Cc2ccccc2O)ccc1C(N)=O 2192570488 RSGHBYBUGOXJNE-UHFFFAOYSA-N 270.332 2.436 10 10 CECE CCC(=O)N1CCN(c2ccc([C@@H](C)NC)cc2)CC1 2182602352 PKZIWIGONHGVIK-CYBMUJFWSA-N 275.396 2.026 10 10 CECE Cc1cc(C(=O)O)c(C)n1-c1ccc2c(c1)CNCC2 2189291340 WPLSQTWMPJPBEV-UHFFFAOYSA-N 270.332 2.438 10 10 CECE C[C@H]1CN(C)CCN(c2ccc3c(c2)CCC[C@H]3N)C1 2184683753 DNJZZDAMRCJJQA-SUMWQHHRSA-N 273.424 2.411 10 10 CECE FC(F)(F)Oc1ccc(N2CCN[C@H]3C[C@@H]32)cc1 2044328363 QBNZPUSIFXIGFF-QWRGUYRKSA-N 258.243 2.136 10 10 CECE CN[C@@H]1CCCc2cc(N(CCO)CC3CC3)ccc21 2184686631 JISOTOVIZSNGML-QGZVFWFLSA-N 274.408 2.492 10 10 CECE CN[C@@H]1CCCc2cc(N(C)CC(F)(F)CO)ccc21 2184680593 UNKBGGIHMQJRFS-CQSZACIVSA-N 284.350 2.347 10 10 CECE COc1ccc(N2CCNC[C@@H]2C(C)C)c(F)c1 2044507401 QUOXTLMJKXUPPZ-CQSZACIVSA-N 252.333 2.269 10 10 CECE CCN(C)C[C@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2184734525 UJQYXFXXUJLPPR-DYVFJYSZSA-N 273.424 2.411 10 10 CECE CN1C[C@@H]2CN(c3ccc4c(c3)CC[C@H]4O)C[C@@]2(C)C1 2184729843 OBZULLHRUNIEEH-KBRIMQKVSA-N 272.392 2.054 10 10 CECE CC(C)(CNC(=O)c1cc(O)c(O)c(O)c1)CC(F)F 2190208996 JGKGRBMAIKWHCF-UHFFFAOYSA-N 289.278 2.215 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)C1(CF)CCC1 2047703300 MWBUQANTIWMQRB-CHWSQXEVSA-N 253.317 2.153 10 10 CECE CNCC[C@@H](C)N(C)c1ccc(OC)cc1OC 2049151010 OPBNPFWOWRYYKR-LLVKDONJSA-N 252.358 2.138 10 10 CECE OC[C@H](NCc1ccc(Cl)cc1O)c1cscn1 2055446124 WMJIYOHGCRVQKE-JTQLQIEISA-N 284.768 2.325 10 10 CECE C[C@@H](O)c1cc(F)c(N2CC(N3CCCC3)C2)c(F)c1 2194509771 INLFDZGGNBRRBB-SNVBAGLBSA-N 282.334 2.303 10 10 CECE COc1ccc(N2C[C@H](N)CC(F)(F)C2)c(F)c1 2064312262 UZNKLTULDPPYDQ-MRVPVSSYSA-N 260.259 2.007 10 10 CECE Nc1ccc(CNc2cc3c(cc2N)OCCO3)cc1 2191613698 YLWODZMPGYURCI-UHFFFAOYSA-N 271.320 2.234 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(S(=O)(=O)C2CC=CC2)C1 2068642615 MWFCXJCXVDGWMP-SNVBAGLBSA-N 270.358 2.057 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]2C(C)(C)O)c(F)c1 2071165158 SKRZRTHZRQADGE-ZANVPECISA-N 252.333 2.195 10 10 CECE C[C@@H](NS(=O)(=O)C1CC=CC1)c1ccccc1O 2072486824 QNFKRLXQIYQAQY-SNVBAGLBSA-N 267.350 2.091 10 10 CECE C[C@H](C(=O)O)[C@@H](C)N(C)[C@@H](C)c1ccccc1O 2072461877 PPHJOPHEGQNYTP-AXFHLTTASA-N 251.326 2.494 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2ncno2)c(F)c1 2104123269 FYNQNELIUODVHO-SECBINFHSA-N 264.304 2.126 10 10 CECE CC[C@H]1CN(Cc2ccc(F)cc2O)CC[C@H]1N 2084080075 PWOZSJBISJKIGR-GXFFZTMASA-N 252.333 2.091 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2[C@@H](N)CCC[C@H]2C1 2104483688 IYAWNTKEAFIWOV-CFVMTHIKSA-N 260.381 2.260 10 10 CECE 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2034726589 STXFSCJFAXQGHZ-KBPBESRZSA-N 264.394 2.227 10 10 CECE CC12CC(NCc3cc(F)cc(F)c3O)(CO1)C2 2038994886 WHCXCAZBFITBAZ-UHFFFAOYSA-N 255.264 2.082 10 10 CECE Oc1cccc(Cl)c1CN1CCN(CCF)CC1 402778771 OFEIVIHNZCGEGU-UHFFFAOYSA-N 272.751 2.133 10 10 CECE Nc1ccc(CS(=O)(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)cc1 403296084 ORHCLGVPAGTQKM-HZSPNIEDSA-N 294.420 2.124 10 10 CECE CC[C@@H]1CN(C(=O)CCc2ccc(N)cc2)[C@H](C)CO1 403744785 KPDAIEMNSRCIKA-IUODEOHRSA-N 276.380 2.227 10 10 CECE c1cc(CNCc2ccc(N3CCOCC3)cc2)sn1 404358465 DGSQUIRMFJJVMX-UHFFFAOYSA-N 289.404 2.270 10 10 CECE CSC[C@](C)(O)CN[C@H]1CCc2cccc(O)c21 311163683 NDJBVBKNPDTFHY-SMDDNHRTSA-N 267.394 2.083 10 10 CECE CN(C)c1ccc(CNC[C@@H]2C[C@H]3CC[C@H]2O3)cc1 311749431 SLYWJFQXDYMTRP-NUEKZKHPSA-N 260.381 2.410 10 10 CECE Nc1ccc(CCC(=O)OC[C@H]2CCC[C@H](O)C2)cc1 312474377 HHIVCTVNJDHYQK-ZFWWWQNUSA-N 277.364 2.296 10 10 CECE CCOc1ccccc1NC[C@H](O)CN1CCCCC1 312688083 ODYFZHMVCPHGOO-AWEZNQCLSA-N 278.396 2.344 10 10 CECE C[C@@H](N)c1ccc(N2CC=CC23CCOCC3)cc1O 2171989701 FVYXUVRJHQHPML-GFCCVEGCSA-N 274.364 2.337 10 10 CECE CCNCc1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)cc1 702400719 JGYIZQSEYYCBRM-WBVHZDCISA-N 273.424 2.184 10 10 CECE NCc1ccc(N2CC3(CCCO3)C2)cc1Br 702886363 UTFSDJCDGHVPKG-UHFFFAOYSA-N 297.196 2.277 10 10 CECE CNCc1ccc(N2CC[C@H](CCO)[C@@H](C)C2)c(F)c1 2172458244 BFCASODDWUAUAH-GXTWGEPZSA-N 280.387 2.390 10 10 CECE CNC[C@H]1CCCN1Cc1c(O)cccc1Br 706866857 CEXWJBKKPSDAOM-SNVBAGLBSA-N 299.212 2.339 10 10 CECE CCN1CCc2cc(N3C[C@@H]4CC[C@H](C3)C4N)ccc21 2163061646 JBMZDMFMRVMDAE-VMZNBEPHSA-N 271.408 2.243 10 10 CECE CCN1CCc2cc([C@]3(O)CO[C@@H](C4CC4)C3)ccc21 2163074011 OIZAZWMFKNHROG-IAGOWNOFSA-N 273.376 2.456 10 10 CECE CNCc1ccc(N2C[C@]3(C)CN(C)C[C@@]3(C)C2)cc1 707023979 ANTAOHAHNMXRAM-IRXDYDNUSA-N 273.424 2.184 10 10 CECE CCN1CCC[C@@](N)(c2ccc3c(c2)CCN3C)CC1 2163071090 LPHGXDGXFMGGFQ-KRWDZBQOSA-N 273.424 2.339 10 10 CECE C[C@@H](O)c1ccc(N2[C@@H]3CC[C@@H]2[C@@H](C)[C@H](O)C3)cc1 686168938 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CC[C@@H]1CN(c2ccc(CN)cc2C(F)(F)F)C[C@@H]1O 399881228 TVKNRZBUPVUCDG-MFKMUULPSA-N 288.313 2.371 10 10 CECE CN(C)c1ccc([C@H](NN)[C@@]23CC[C@@](C)(C2)OC3)cc1 2178363757 RSQGQMYHSQWAQJ-JYJNAYRXSA-N 275.396 2.216 10 10 CECE Cc1ccc(O)c([C@H](C)N2C[C@@H]3C[C@@H](C(=O)O)[C@@H]3C2)c1 2174326056 PXGJULHGTKNQDS-CDGCEXEKSA-N 275.348 2.414 10 10 CECE COc1ccc(O)c([C@@H](C)n2nc(C)cc2C(=O)O)c1 2069970409 OSJCSOIMAPQGJY-SECBINFHSA-N 276.292 2.213 10 10 CECE CNC(=O)c1cc(C(C)C)nn1Cc1cc(C)ccc1O 2070033627 CBVAOZHDQDIFHE-UHFFFAOYSA-N 287.363 2.428 10 10 CECE CCOC(=O)[C@@H](CC(C)C)NCc1ccc(O)cc1O 2169630215 CHKXGFQHNMIPHN-CYBMUJFWSA-N 281.352 2.165 10 10 CECE CCCN(Cc1ccnn1C)c1ccc(CN)c(F)c1 2170037077 QIXZMERZLLMIHU-UHFFFAOYSA-N 276.359 2.435 10 10 CECE CN[C@@H](C)c1ccc(N(CCS(C)(=O)=O)C(C)C)cc1 2170175664 LCYONMYATVZKFA-ZDUSSCGKSA-N 298.452 2.226 10 10 CECE CCCOc1cc(N2CC(O)(C(F)(F)F)C2)ccc1N 2170378707 MSMTZNQGXJHWHM-UHFFFAOYSA-N 290.285 2.171 10 10 CECE Cc1ccc([C@@H](C)N2CCO[C@@H](CN(C)C)C2)c(O)c1 2170343013 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2.243 10 10 CECE CC[C@@H](OC)C(=O)N(Cc1ccc(N)cc1)C1CC1 1924091871 JKKMVQLIRUKYTN-CQSZACIVSA-N 262.353 2.185 10 10 CECE O=C(C[C@@]12CCC[C@@H]1C2)NCCc1ccc(O)c(O)c1 1968738918 HMZWELMQYAEMEC-WBMJQRKESA-N 275.348 2.337 10 10 CECE COC[C@H]1CCCN(c2ccc(CN)c(F)c2F)C1 234860721 BSYHSNSWFANTEI-JTQLQIEISA-N 270.323 2.286 10 10 CECE CCN[C@H]1CCN(Cc2c(O)cccc2Br)C1 1942865706 IUBOYUFORCDUGX-JTQLQIEISA-N 299.212 2.339 10 10 CECE COc1ccc([C@@H](C)N2CC[C@@](C)(N(C)C)C2)c(O)c1 2149955090 DYXQFLWHIIVWQQ-MLGOLLRUSA-N 278.396 2.488 10 10 CECE Oc1c(Cl)cccc1CNC[C@@H]1CC=CCO1 1946379886 GTIRVJDCIWIPJK-NSHDSACASA-N 253.729 2.480 10 10 CECE NC1CC2(C1)CN(Cc1ccc(Br)cc1O)C2 1946774560 QCZJSBCLDKIMTQ-UHFFFAOYSA-N 297.196 2.078 10 10 CECE Cc1ccc([C@H](C)NC2CN(CC(F)F)C2)c(O)c1 1970963746 FABBOHPCDZRGJW-JTQLQIEISA-N 270.323 2.301 10 10 CECE CCN(CC)c1ccc([C@](C)(O)CC(=O)O)cc1 1951554195 ACOHHJHGFNQYJT-CQSZACIVSA-N 251.326 2.215 10 10 CECE CC(C)(C)OC(=O)N1C[C@@H](N)C[C@H]1c1ccc(O)cc1O 1952453197 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Cc1ccn2nc(N(C)Cc3ccc(N)cc3)nc2c1 2148894584 MRFZONOUSTXOHN-UHFFFAOYSA-N 267.336 2.256 10 10 CECE Cc1ccc([S@@](=O)CC(=O)Nc2ccc(N)cc2)cc1 40961826 YXDQCSJLBVZHBU-HXUWFJFHSA-N 288.372 2.324 10 10 CECE COCCN(CC(C)C)C(=O)CCc1ccc(N)cc1 42271357 PQIJEJCRPBGAIJ-UHFFFAOYSA-N 278.396 2.332 10 10 CECE C[C@H](O)C12CCC(CC1)N2c1ccc([C@@H](C)O)c(O)c1 2153394356 MMRINLNFKJGPHS-GUVYTERUSA-N 277.364 2.328 10 10 CECE Oc1cc(Cl)ccc1CN[C@@H]1[C@@H]2CCCO[C@H]21 2007563824 RZWGNQMTKZDSTD-CYZMBNFOSA-N 253.729 2.313 10 10 CECE C[C@H](O)[C@@H]1CCN1c1ccc([C@@H](C)N)c(Cl)c1 2011147348 VUVXCCSCLUVSIF-ZDMBXUJBSA-N 254.761 2.319 10 10 CECE CN(C)[C@H]1CCCCN(C(=O)Nc2ccc(N)cc2)C1 2154980369 PAKLOCZJTNKCEY-AWEZNQCLSA-N 276.384 2.217 10 10 CECE COCCCCCOC(=O)CCOc1ccc(N)cc1 2155509358 VJXWLIYDENWLLD-UHFFFAOYSA-N 281.352 2.398 10 10 CECE CN[C@@H](C)c1ccc(N(CCOC)CCOC)cc1 48895484 IQBAWYIWBKRYFT-ZDUSSCGKSA-N 266.385 2.066 10 10 CECE Nc1cccc(Cl)c1N[C@H]1C[C@H]2CC[C@H]1NC2 2016927863 UDCQQFJROGVFSQ-FXAINCCUSA-N 251.761 2.475 10 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2.103 10 10 CECE NCc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)c(Cl)c1 381697154 YQODECDRMVJYIC-VHKOSHJNSA-N 278.783 2.004 10 10 CECE CNCc1ccc(N2CC3(CO)CCC2CC3)c(F)c1 2178884726 SDWXAFGBKVIHDY-UHFFFAOYSA-N 278.371 2.286 10 10 CECE CC(C)NCc1ccc(N2C[C@@H](O)C[C@@H]2C)c(C#N)c1 384798501 QVSXRQNDQFIOSM-WFASDCNBSA-N 273.380 2.016 10 10 CECE CNCc1ccc(N2C[C@H](O)C[C@H]2C)c(Br)c1 384788027 QYSUCNYKBHAQBU-MWLCHTKSSA-N 299.212 2.128 10 10 CECE CC(C)n1ncnc1[C@H](O)CCc1ccc(N)cc1 695879660 IGRMFJMAGWNLHD-CYBMUJFWSA-N 260.341 2.107 10 10 CECE CN(Cc1ccc(O)c(O)c1)[C@@H](CC(C)(C)C)C(=O)O 387612849 ZEERMNXRKAKFCW-NSHDSACASA-N 281.352 2.419 10 10 CECE CC1(C)CN(c2ccc(CN)cc2Cl)C[C@H]1O 387758774 FETPTZZPKUZTFB-GFCCVEGCSA-N 254.761 2.006 10 10 CECE C[C@@H]1[C@H](NCc2cc(Cl)ccc2O)CCN1C 719562725 SAJVLDIKGFZNOD-BXKDBHETSA-N 254.761 2.228 10 10 CECE COc1ccc(O)c(CNC[C@H]2C[C@H]3CC[C@H]2O3)c1 388704592 UKPUYSNATUMIFY-UXIGCNINSA-N 263.337 2.058 10 10 CECE CN(C[C@H]1C[C@H]1C1CC1)C(=O)COc1ccc(N)cc1 698244718 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CECE COc1cccc(CN[C@H]2CCC[C@@H]2n2ccnc2)c1O 37107027 YPLSEEPCEMIDAU-KBPBESRZSA-N 287.363 2.481 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3COC[C@@H]32)c(F)c1 2129807417 FAYPROCMUYEHOM-GMXABZIVSA-N 264.344 2.331 10 10 CECE CCn1cc(CN2CCc3cc(OC)ccc32)cn1 127685428 OZBKFWXCCCNAEF-UHFFFAOYSA-N 257.337 2.474 10 10 CECE C[C@@H](NC1CCC(CO)CC1)c1c(O)cccc1O 311533299 WMWJROAVXXGTKC-VOMCLLRMSA-N 265.353 2.300 10 10 CECE Oc1c([C@@H]2CCCN2)cc(Br)c(F)c1O 213440044 BECCXSXANKQIIV-ZETCQYMHSA-N 276.105 2.424 10 10 CECE CSCC(=O)N(Cc1ccc(N)cc1)C(C)C 70435211 KGWSLKGGRGSALH-UHFFFAOYSA-N 252.383 2.369 10 10 CECE CCC[C@H](C)N(C)S(=O)(=O)Cc1ccc(N)cc1 36789919 VGJYYLHUVYVAQS-NSHDSACASA-N 270.398 2.219 10 10 CECE C[C@@H](c1cnn(C)c1)N(C)Cc1cc([N+](=O)[O-])ccc1O 180992817 IUFRJNIYHSXKCI-JTQLQIEISA-N 290.323 2.227 10 10 CECE CCOC(=O)C[C@@H](C)N(C)Cc1cccc(OC)c1O 183187274 MHBZAKWDPREJNB-LLVKDONJSA-N 281.352 2.174 10 10 CECE C[C@@](N)(CCCCSc1nccs1)C(=O)O 45596014 PFJJVHSFULXFNZ-SNVBAGLBSA-N 260.384 2.208 10 10 CECE COc1ccc(N(C)C[C@@H](O)CC(F)(F)F)c(OC)c1 189746281 FTVALEKWNWZPHR-VIFPVBQESA-N 293.285 2.453 10 10 CECE Nc1ccc(NC(=O)CSc2nccs2)cc1 40676605 GCIRBFPTTZNBQK-UHFFFAOYSA-N 265.363 2.456 10 10 CECE CO[C@@H](C)CN(C)Cc1cc(C(C)=O)ccc1O 380658868 GUSWMLXEPBUHRG-JTQLQIEISA-N 251.326 2.062 10 10 CECE CN(C)c1ccc(/C=C/C(=O)Nc2cc[nH]n2)cc1 48798566 NQKPMKBWOJFJRC-VMPITWQZSA-N 256.309 2.128 10 10 CECE CCC1C[C@@H]2C(=O)N(c3ccc(N)c(OC)c3)C(=O)[C@H]2C1 229902561 IJBWITYCPKIFAZ-RYUDHWBXSA-N 288.347 2.203 10 10 CECE C[C@H]1COc2ccccc2[C@@]1(NCCCN=[N+]=[N-])C(=O)O 228184756 IEXQXYSOHTWWJZ-IINYFYTJSA-N 290.323 2.285 10 10 CECE COC(=O)C(C)(C)N[C@H](C)c1cc(F)ccc1O 94617418 XYYOUFJNOJPLSW-MRVPVSSYSA-N 255.289 2.134 10 10 CECE COC(=O)CN(Cc1ccc(N)cc1)C(=O)OC(C)(C)C 140139024 ALIAJRDQMHVJRV-UHFFFAOYSA-N 294.351 2.179 10 10 CECE C[C@@H](N)c1ccc(N(CCO)C2CCCC2)cc1O 93671092 VSRMVMKPZTZEDF-LLVKDONJSA-N 264.369 2.153 10 10 CECE [N-]=[N+]=NC[C@@H]1CNC(=N)N1c1ccccc1Cl 93378793 JPDZWCZIYFIRLB-ZETCQYMHSA-N 250.693 2.363 10 10 CECE CCN(CCC(=O)NC(C)C)Cc1ccc(N)cc1 54048589 NPXSWANCAKCVJA-UHFFFAOYSA-N 263.385 2.005 10 10 CECE COc1ccc(CNCC2(C)OCCCO2)cc1C 277159059 GNTANXWAGPRNAR-UHFFFAOYSA-N 265.353 2.246 10 10 CECE O=C(/C=C\c1ccc(O)c(O)c1)NC1(C(F)F)CC1 800679674 ACKCKTQSSASOSF-RQOWECAXSA-N 269.247 2.025 10 10 CECE COC[C@@]1([C@@H](NCCCN=[N+]=[N-])C(=O)O)CC=CCC1 2166475011 PBGLZIXYWLHPAI-WCQYABFASA-N 282.344 2.103 10 10 CECE C[C@@H](O)c1ccc(N2CC(C(=O)NC(C)(C)C)C2)cc1 2168050071 ATVWCKORFYTBTA-LLVKDONJSA-N 276.380 2.091 10 10 CECE C[C@@H]1CCN(Cc2cc(Cl)c(F)cc2O)[C@@H]1CO 294776910 UDLXFKWUZKPUGS-PRHODGIISA-N 273.735 2.387 10 10 CECE C[C@H]1CCC2(CC2)N(CC(=O)Nc2ccc(N)cc2)C1 2169000472 BSNGOJNQVBQKRY-LBPRGKRZSA-N 273.380 2.472 10 10 CECE CC[C@H](N[C@@H]1CCn2ncnc2C1)c1ccccc1O 2165197906 NYIRRMOOUXZOAV-YPMHNXCESA-N 272.352 2.039 10 10 CECE CCN(CCN(C)C)c1ccc(/C=C/C(=O)O)c(C)c1 708463681 YFOMOKAJNFZNQR-VQHVLOKHSA-N 276.380 2.481 10 10 CECE CN1CCc2cc(N3C[C@@H](N)[C@H](C(F)(F)F)C3)ccc21 2163071770 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CCC[C@@H](c1c(O)cccc1OC)N1CCNCC1 575266550 HHAXFSTWOQCNRK-LBPRGKRZSA-N 264.369 2.147 10 10 CECE CO[C@@H]1CCN(C/C=C\c2ccc(N(C)C)cc2)C1 835028509 KVDDAKLRBVPNML-YIEVGGLXSA-N 260.381 2.487 10 10 CECE COC[C@H](CC(C)(C)C)NC(=O)c1cccc(O)c1O 848313919 ZJZDYQSOHOXEMZ-JTQLQIEISA-N 281.352 2.279 10 10 CECE CN(C)c1ccc(/C=C/CN[C@@H](CN)C2CC2)cc1 841027936 GSPMMPFOQQDGGV-CWDCEQMOSA-N 259.397 2.093 10 10 CECE C[C@@H](CNC(=O)NCc1c(O)cccc1F)C1CC1 914371198 OMJJDZPXNLGCAQ-VIFPVBQESA-N 266.316 2.377 10 10 CECE COc1ccc(CNC[C@@H]2C[C@@H](C)O[C@@H]2C)c(O)c1 686510627 BTDJNIHGHRIYMG-WZRBSPASSA-N 265.353 2.304 10 10 CECE COc1ccc(O)c([C@@H](C)NCc2cnn(CCF)c2)c1 922217252 NITBELPKZHQVAN-LLVKDONJSA-N 293.342 2.418 10 10 CECE C[C@@H]1COC[C@H]1N(C)c1ccc(/C=C/C(=O)O)cc1 688241242 VKGFKTKZUPVJEH-AZLLNVJASA-N 261.321 2.256 10 10 CECE CC(C)(CNCc1cc(F)ccc1O)n1cccn1 697637824 ABPFLKXLORNXRN-UHFFFAOYSA-N 263.316 2.253 10 10 CECE COc1ccc(CNCCc2cncc(C)n2)cc1C 850390752 RBRROIBRHVGMHK-UHFFFAOYSA-N 271.364 2.434 10 10 CECE 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C[C@@H](NC[C@H]1CCCCO1)c1cc(O)ccc1O 42812414 OBXGZEYVRGFHAX-ZYHUDNBSSA-N 251.326 2.318 10 10 CECE CN1CCc2cc(CNC[C@H]3CCC[C@H]3CO)ccc21 250373320 JKBCPNWBJRCGDE-CVEARBPZSA-N 274.408 2.177 10 10 CECE CNCc1ccc(N2CCC[C@@H]2C(C)(C)O)c(F)c1 707179026 QBVWFWDARHCPHU-CQSZACIVSA-N 266.360 2.285 10 10 CECE O[C@H]1CCCN(c2c(F)cc(CNC3CC3)cc2F)C1 62712367 POCCJKRITHDIKN-LBPRGKRZSA-N 282.334 2.178 10 10 CECE C[C@H]1CCC[C@@H](CNCc2ccc(O)c(O)c2)O1 688868114 VRTACJKEBLJIKN-JQWIXIFHSA-N 251.326 2.145 10 10 CECE C[C@H](N)c1ccc(N(C)[C@@H](CO)C(C)(C)C)cc1O 689678285 OAZCBXGQKBRGIH-HZMBPMFUSA-N 266.385 2.255 10 10 CECE Cc1ccc(CNC(=O)NCc2ccccc2O)o1 1253694014 ZPNMQGKDCYTZOG-UHFFFAOYSA-N 260.293 2.293 10 10 CECE CCNCc1ccc(N(C)C[C@H](COC)OC)c(C)c1 691373504 UXQCUFHEQNDPKO-OAHLLOKOSA-N 280.412 2.202 10 10 CECE C[C@@H]1CCN(Cc2ccc(Br)cc2O)C[C@@H]1N 691485717 COXAYWFGPFDRDQ-SKDRFNHKSA-N 299.212 2.324 10 10 CECE CC[C@@H]1CN(c2ccc3c(c2)OCCO3)CCCN1 86285786 HJTSJABKZYKNIU-GFCCVEGCSA-N 262.353 2.036 10 10 CECE 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CC(C)(C)NCc1ccc(N2CCSC[C@H]2CO)cc1 387968233 JSBOYIMVCNMXGG-OAHLLOKOSA-N 294.464 2.489 10 10 CECE C[C@H]1CN(c2ccc(CNC3CC3)cc2Cl)C[C@@H]1O 388081826 MJXONHIYCYHGBM-BONVTDFDSA-N 280.799 2.409 10 10 CECE CCN[C@@H](C)c1ccc(N2CCSC[C@H]2CO)cc1 388094839 QZQMMHYSPRMZOP-SWLSCSKDSA-N 280.437 2.271 10 10 CECE Cc1cc(N2C[C@H](C)[C@H](O)C2)ccc1CNC1CC1 388080713 PADAJGRPZRAYFM-BLLLJJGKSA-N 260.381 2.064 10 10 CECE COC(=O)[C@H](CC1CCCC1)NCCCN=[N+]=[N-] 394580333 SCCGRMQENFUUTA-NSHDSACASA-N 254.334 2.398 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1sc(C)nc1C 394835278 GTBYBXSZBYJSLJ-SECBINFHSA-N 283.357 2.264 10 10 CECE CCC1(O)CN(c2c(F)cc(CNC3CC3)cc2F)C1 394960245 IUBDWUNVPVLYKR-UHFFFAOYSA-N 282.334 2.178 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CSC[C@@H]1C 397874121 HAOSMUICXOTABL-GZMMTYOYSA-N 266.366 2.219 10 10 CECE COC[C@@]12CN(c3c(F)cc(CO)cc3F)C[C@]1(C)C2 2165467619 LAQPUYARJNJBAZ-LSDHHAIUSA-N 283.318 2.320 10 10 CECE CCCOc1cc(N2C[C@@H]3C[C@H](CO)[C@@H]3C2)ccc1N 2174306184 DFMAUCHYQJUAJN-OUCADQQQSA-N 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CNCc1ccc(N2CCN3CCC[C@H]3C2)c(Cl)c1 249858046 UNTOLNDKXPUHRD-ZDUSSCGKSA-N 279.815 2.344 10 10 CECE CN(C)c1ccc2c(c1)[C@@H](CN)N(Cc1ccccn1)C2 82701816 YTILZJAOHQIIBJ-QGZVFWFLSA-N 282.391 2.163 10 10 CECE NCCc1nnc(-c2ccc(-n3cccc3)cc2)o1 83398753 PYVOWNJQBPRGCK-UHFFFAOYSA-N 254.293 2.029 10 10 CECE N#Cc1ccc([C@@H]2NCCc3c(O)ccc(O)c32)cc1 83657851 LPINASQXFUUEBJ-INIZCTEOSA-N 266.300 2.205 10 10 CECE Cc1ccc([C@@H]2NCCc3c2ccc(O)c3O)cc1O 75793276 IHPTVXPWSFLMLK-HNNXBMFYSA-N 271.316 2.347 10 10 CECE C[C@H](N)[C@H](C)Nc1c(N)cccc1Br 1888912919 SEEDENUIBDXHQR-BQBZGAKWSA-N 258.163 2.179 10 10 CECE CC(=O)Nc1nc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)cs1 701297630 WASCTOAKGAQYBT-MRVPVSSYSA-N 294.340 2.016 10 10 CECE N[C@H](c1ccccc1O)[C@@]1(O)[C@H]2CC[C@H]3[C@@H](C2)C[C@H]31 1893478786 WTMMRYNGYRPRJJ-SAGMSUGKSA-N 259.349 2.189 10 10 CECE C[C@H](N)c1ccc(N2CCC[C@@H](N3CCC3)C2)cc1 702323961 YYLJTKRGEROWSH-XJKSGUPXSA-N 259.397 2.381 10 10 CECE CC1(C)CN(Cc2ccc(Br)cc2O)CCN1 691385015 CKOUXFXLBQPALU-UHFFFAOYSA-N 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C[C@H](O)c1ccc(N(C)CC23COC(C)(C2)C3)cc1O 2202830036 ZZCAAGNMLYOJDK-SOISORPOSA-N 277.364 2.451 10 10 CECE COc1ccc([C@H](C)NC[C@H]2CCCO2)c(O)c1 20092599 ASLJHKKLOFPYMB-CMPLNLGQSA-N 251.326 2.230 10 10 CECE [N-]=[N+]=NC1CCN(S(=O)(=O)C2CCCC2)CC1 1912184496 FQFQIISHAVWZGH-UHFFFAOYSA-N 258.347 2.034 10 10 CECE COC(=O)[C@H](CC(C)C)N1CCC[C@@H](N=[N+]=[N-])C1 1912172436 UKLFYCRLQXLZQL-MNOVXSKESA-N 254.334 2.349 10 10 CECE COc1ccc(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)nc1 1912161851 OEIVIHRHWGEEQH-VIFPVBQESA-N 261.285 2.005 10 10 CECE Cc1nn(C)c(C)c1CCC(=O)N(C)CCCN=[N+]=[N-] 1912172453 FDGHGPRIHMOVIL-UHFFFAOYSA-N 278.360 2.128 10 10 CECE C[C@]1(C(=O)N2CCC(CN=[N+]=[N-])CC2)CCCO1 1912174302 XNKNNOSJUFIAEB-GFCCVEGCSA-N 252.318 2.104 10 10 CECE CCN1CCc2cc([C@H](O)C[C@@H]3CC[C@@H]3N)ccc21 2126622532 RGQOOMVYWMRQAA-HZUKXOBISA-N 260.381 2.230 10 10 CECE CN[C@@H]1CCN(c2ccc(OC)cc2OC)C[C@@H]1C 219763769 XQNRMIWVOLETPN-WCQYABFASA-N 264.369 2.138 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](CO)CC2(C)C)cc1O 2127834434 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CC1(C)OCCO[C@H]1CN1CCC[C@@H](N=[N+]=[N-])CC1 2130413011 TXWAMJCSDJLIQI-NEPJUHHUSA-N 268.361 2.345 10 10 CECE CCCN(Cc1ccccc1O)C[C@@H]1[C@@H]2COC[C@@H]21 2132392776 MCPDDGLQTRRSAC-QDMKHBRRSA-N 261.365 2.497 10 10 CECE COC1(CCN2CCc3cc(CN)ccc32)CCC1 2133388321 NLQBXKVSZJDCLN-UHFFFAOYSA-N 260.381 2.467 10 10 CECE O=C(N[C@H]1COCc2ccccc21)c1cccc(O)c1O 1148224674 RWVXLAOSNLQQPL-ZDUSSCGKSA-N 285.299 2.099 10 10 CECE Nc1ccc(O)c(CN2[C@H]3CC[C@H]2CSC3)c1 1914574233 LRYIQXSLBXMWPB-RYUDHWBXSA-N 250.367 2.054 10 10 CECE COCCN(c1ccc([C@H](C)N)cc1)[C@H](C)COC 109570199 NZXQNHIGYXBKJZ-OLZOCXBDSA-N 266.385 2.194 10 10 CECE CC[C@@H]1C[C@@H]1CN(C)c1ccc2c(c1)NC(=O)[C@@H]2N 2135311056 BRBYQLSYSSBGMF-GPCCPHFNSA-N 259.353 2.121 10 10 CECE CNCc1ccc(N(C)C[C@H]2C[C@H]2CF)cc1OC 2139698674 LRORXZGAEBBVIU-QWHCGFSZSA-N 266.360 2.456 10 10 CECE CC1(C)CCCN(Cc2ccc(F)cc2O)[C@H]1CN 2139771934 IBPVYFDSPIHBFZ-AWEZNQCLSA-N 266.360 2.481 10 10 CECE C[C@H]1CCOC[C@@]1(Sc1nccs1)C(=O)O 1904756148 BEQRHJVJCLORMO-XVKPBYJWSA-N 259.352 2.115 10 10 CECE CCCNCc1ccc(N(C)[C@H]2CCNC2=O)cc1Cl 1916819927 ZAVJVKXORGQICK-AWEZNQCLSA-N 295.814 2.164 10 10 CECE CC[C@H]1CN([C@@H](C)c2ccc(OC)cc2O)CCN1C 211528522 OTGGXVLDEFNOMA-STQMWFEESA-N 278.396 2.488 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@]23CCOC3)cc1O 1915827883 JEBNNNIKIZNBPW-ABAIWWIYSA-N 262.353 2.042 10 10 CECE CNC[C@@]1(CN(C)c2ccc(OC)cc2)CCCOC1 111327213 XSXWWVOZENAVLT-MRXNPFEDSA-N 278.396 2.148 10 10 CECE CC(=O)C(=O)[C@](C)(O)c1cc(Cl)ccc1Cl 1919400836 BAICCMWXQPNXPN-LLVKDONJSA-N 261.104 2.359 10 10 CECE Cc1cccc(O)c1CN1C[C@H]2C[C@@H](C(=O)O)C[C@H]2C1 1968209258 IRMXDNPXSIHZSB-XYYAHUGASA-N 275.348 2.243 10 10 CECE C[C@]1(CCO)CCN1c1ccc2c(c1)CCC[C@@H]2O 2140571480 MDEXHYHCYFUJIR-JKSUJKDBSA-N 261.365 2.408 10 10 CECE CCC(CC)CC(=O)NCc1cc(N)ccc1O 1926391320 YMQZWBZFRQHSBR-UHFFFAOYSA-N 250.342 2.417 10 10 CECE COc1cc2c(cc1OC)N1CC[C@H](C)C[C@@H]1C(=O)N2 229303738 SQLLFCQUXUVOFD-JOYOIKCWSA-N 276.336 2.261 10 10 CECE COC(=O)[C@H](C(C)C)[C@H](N)c1ccc2c(c1)CCN2C 1927407729 KPPGXPRZKHUVRD-HUUCEWRRSA-N 276.380 2.124 10 10 CECE CC(C)N(CCc1ccnn1C)c1ccc(CN)cc1 230749273 OKQSVNQQJMOEQC-UHFFFAOYSA-N 272.396 2.336 10 10 CECE CCCN(CCCO)c1ccc(CN)c(Cl)c1 1944453053 RHWUFBIDSKBJRU-UHFFFAOYSA-N 256.777 2.398 10 10 CECE CN[C@@H](C)c1ccc(N2CCCC[C@@H]2CCO)cc1O 2143431489 TXCHWLMBOSRLQB-QWHCGFSZSA-N 278.396 2.414 10 10 CECE CC[C@]1(O)CCN(c2ccc(CN)c(Cl)c2)C1 1945551311 KOBUHUVYZQUPAA-ZDUSSCGKSA-N 254.761 2.150 10 10 CECE N[C@@H](c1ccccc1O)[C@@]1(O)CCOC12CCCCC2 2148164858 QQTFBMSWILMMJT-HOCLYGCPSA-N 277.364 2.246 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H]2OCCO[C@H]2C)cc1 2143687052 NNHLXFYZGWMWJR-DVOMOZLQSA-N 278.396 2.207 10 10 CECE c1cc2c(cc1CNC[C@@H]1C[C@H]3O[C@H]1[C@H]1C[C@H]13)CCO2 2144068846 NDXTVTMDYZSQEW-IUKJFTNHSA-N 271.360 2.135 10 10 CECE COc1ccc(N(C)CCC[C@](N)(CO)C(C)C)cc1 2144100157 IUFWQKLOTKGDPX-INIZCTEOSA-N 280.412 2.257 10 10 CECE CC(C)(C)OC(=O)N[C@@H](C(=O)O)c1ccc(F)cc1O 1951385201 LEALEHPVXONFJN-SNVBAGLBSA-N 285.271 2.182 10 10 CECE CC(C)(C)OC(=O)Nc1cccc([C@@H](N)CCO)c1O 1952204861 PWTRAUCYZUFYFV-JTQLQIEISA-N 282.340 2.121 10 10 CECE COc1cccc(CN[C@@H](CO)[C@@H]2CC=CCC2)c1O 1971212385 QZRGJUFOTLLLKA-OCCSQVGLSA-N 277.364 2.208 10 10 CECE CCOc1cccc(CNC[C@@H]2C[C@@]23CCOC3)c1O 1974202247 OZGINCUBUPPJQC-XJKSGUPXSA-N 277.364 2.307 10 10 CECE Cc1ccc([C@H](C)N[C@H]2C[C@@H](CS(C)(=O)=O)C2)c(O)c1 1974492561 VALRRPWYMLSJRF-RWMBFGLXSA-N 297.420 2.174 10 10 CECE NCCc1cccc2c1ccn2COC[C@@H]1CCCO1 2149027988 MPJHDSIUJLDDRU-AWEZNQCLSA-N 274.364 2.296 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCC[C@@H]2[C@H](C(=O)O)[C@@H]21 2151009445 UYULXNKOOYISIP-DQBQHTNRSA-N 279.311 2.387 10 10 CECE CN1C(=O)[C@@H](O)c2ccc(N3C[C@H]4CCC[C@H]3C4)cc21 2145853718 BRCSNHTYYLSVQD-PGUXBMHVSA-N 272.348 2.075 10 10 CECE COC(=O)C1(c2ccc(F)c(O)c2O)CCCC1 260056133 DNDACQRSOLCYNL-UHFFFAOYSA-N 254.257 2.222 10 10 CECE COC1CC(C(=O)O)(N(C)Cc2c(O)cccc2Cl)C1 2151207560 NYRUFJMJFXZPOS-UHFFFAOYSA-N 299.754 2.110 10 10 CECE CCCNC(=O)[C@@H](C)N(CCC)Cc1ccc(N)cc1 35364864 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CCN(Cc1c(O)cccc1F)C[C@@H]1CCCNC1 2104511148 SEIJQEFNQBWKOS-GFCCVEGCSA-N 266.360 2.353 10 10 CECE Cc1c([C@H](C)NCc2c(O)cccc2F)cnn1C 2104507996 VSLIWNBOBYAPCE-VIFPVBQESA-N 263.316 2.424 10 10 CECE N[C@H]1CC[S@](=O)(=Nc2ccc(C3=S=CC=C3)s2)C1 2085062179 AJBYIIKKQPTCGZ-NIVTXAMTSA-N 298.458 2.204 10 10 CECE CCN1CCc2cc([C@]3(N)C[C@H](C)O[C@H]3C)ccc21 2106789582 ZLOMWDSUCAOYFP-MKBNYLNASA-N 260.381 2.420 10 10 CECE Cc1cnc([C@@H](O)[C@H](N)c2ccc(N(C)C)cc2)s1 2106855637 QLLBIAQKZPHHNZ-OLZOCXBDSA-N 277.393 2.251 10 10 CECE CN1CCC[C@](O)(c2ccc(N3CCCC3)cc2)C1 2106830859 KNSFOLYGTYZJEQ-MRXNPFEDSA-N 260.381 2.200 10 10 CECE CCN[C@H](c1ccc(N(C)C)cc1)[C@]1(O)CCSC1 2106849393 VMIIUEWMADJMFY-CABCVRRESA-N 280.437 2.271 10 10 CECE COc1cccnc1C(=O)c1cccc2c1NCC2 2107704287 SIIRFQQZFRWHJK-UHFFFAOYSA-N 254.289 2.289 10 10 CECE CN[C@@H](C1=CCOCC1)c1ccc2c(c1)CCN2C 2107899253 MDFSAPKYDDEOKR-INIZCTEOSA-N 258.365 2.286 10 10 CECE CC(F)(F)[C@H]1C[C@@H]1CNC(=O)c1cccc(O)c1O 2108160379 HVXUQYICHUWIBE-APPZFPTMSA-N 271.263 2.119 10 10 CECE CO[C@H]1C[C@@H](OC)CN(Cc2cccc(Cl)c2O)C1 2109152125 YZZHDBDPPUJILJ-TXEJJXNPSA-N 285.771 2.281 10 10 CECE CCCn1ccc(=NCc2cc(OC)ccc2O)[nH]1 2109454923 VLCCMSZMCVZBGK-UHFFFAOYSA-N 261.325 2.041 10 10 CECE COc1cc(N)c(N2CC[C@@H](CCF)C2)cc1OC 2109629189 UVBSEDSWKPXYEP-SNVBAGLBSA-N 268.332 2.472 10 10 CECE C[C@@]1(OCCNCc2c(O)cccc2Cl)CCOC1 2090067219 VLZGSIILNXJJKP-CQSZACIVSA-N 285.771 2.331 10 10 CECE COc1ccc([C@H](NN)c2ccccc2O)cc1C 2090038397 WXCFCKHNNJKTDI-HNNXBMFYSA-N 258.321 2.262 10 10 CECE CC[C@H](NC)c1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1 2090118607 IMLHUVFDYDQIEM-KBMXLJTQSA-N 260.381 2.176 10 10 CECE C[C@H](O)c1ccc(N(C)Cc2ccc(N)cc2)nc1 2092475631 OZEKKIUVNTZOPG-NSHDSACASA-N 257.337 2.354 10 10 CECE CCN[C@H](c1nc(C)cc(C)n1)c1ccccc1O 2093558541 OXDNCCWMQURRMN-AWEZNQCLSA-N 257.337 2.498 10 10 CECE C[C@H](NC[C@@H]1[C@@H]2CCOC[C@@H]21)c1ccc(F)cc1O 2093642523 MAHJBCXKCKPYSG-WTDIUWLJSA-N 265.328 2.464 10 10 CECE CN(C[C@@H]1[C@H]2CCC[C@H]21)C(=O)c1cccc(O)c1O 2093776922 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CECE COC(=O)c1cccc(N)c1N[C@H]1CCC[C@@H]1OC 130303450 QSTMXLJDRONLCW-RYUDHWBXSA-N 264.325 2.035 10 10 CECE OC[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1O 226610093 PIZZQWNYTWBIGR-GXFFZTMASA-N 253.317 2.172 10 10 CECE CCCN[C@@H](C)c1ccc(N(C)C[C@@H](O)COC)c(F)c1 220249107 WKRGXBCYYUUQCL-GXTWGEPZSA-N 298.402 2.330 10 10 CECE C[C@H]1CN([C@H](C)C(=O)Nc2ccc(N)cc2)C[C@H](C)S1 226665803 VQPZCWRUKZKXLG-SDDRHHMPSA-N 293.436 2.422 10 10 CECE COc1ccc(N2CCO[C@H](CO)C2(C)C)cc1Cl 2226930886 QHYKULAAGIAGOW-CYBMUJFWSA-N 285.771 2.325 10 10 CECE CN(C)c1ccc(CNC[C@@H]2CCC[C@H]2CO)cc1 89489497 GUDWEWAICLGQIX-GJZGRUSLSA-N 262.397 2.251 10 10 CECE Cc1nc(COC(=O)Cc2ccc(N)cc2)cs1 89253048 VYPJTFQGOCMFAW-UHFFFAOYSA-N 262.334 2.320 10 10 CECE Oc1ccc(Br)cc1[C@H]1COCCCN1 96886705 PINKUEUOLRGTLZ-SNVBAGLBSA-N 272.142 2.206 10 10 CECE Nc1ccc(O)c(CNC(=O)Cc2c(F)cccc2F)c1 95045892 VZNFJPGCNNKBBG-UHFFFAOYSA-N 292.285 2.112 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)c1cc(C)nn1CC 90122583 REKUGNSXQONVHM-UHFFFAOYSA-N 286.379 2.456 10 10 CECE C[C@H](O)CN(C)c1ccc(CNC2CC2)c(Cl)c1 235560185 LBLRVLHUIDBJLN-JTQLQIEISA-N 268.788 2.409 10 10 CECE NC1(CCc2cc(Br)c(F)c(O)c2O)CC1 259855192 MLKURFXTWIOAMQ-UHFFFAOYSA-N 290.132 2.423 10 10 CECE O=C(O)/C=C/c1ccc(N2C[C@H]3C[C@H]2CO3)cc1Cl 388957865 ZGLZNLVKBSQEHX-VOBIIGJTSA-N 279.723 2.415 10 10 CECE COC[C@@H](C)N(C)c1ccc(/C=C\C(=O)O)cc1C#N 383396954 VJFSTSQQYNMELB-JPVGGKMYSA-N 274.320 2.127 10 10 CECE CN1CCCc2cc([C@H](N)[C@@H](C(=O)O)C3CC3)ccc21 2166998663 AWVDZKPDZBBOMG-GJZGRUSLSA-N 274.364 2.180 10 10 CECE CO[C@H]1C=CCN(c2ccc(C=CC(=O)O)cc2C)C1 2165045058 DRPRJZVHXGTSBF-AWEZNQCLSA-N 273.332 2.484 10 10 CECE CNC[C@H]1CN(c2ccc(OC3CCC3)cc2)CCO1 2162622255 LBLXBEAMGYHGEN-INIZCTEOSA-N 276.380 2.043 10 10 CECE CC(=O)C(=O)COC(=O)c1ncsc1-c1ccccc1 808539416 AHVFRMOETUJQRX-UHFFFAOYSA-N 289.312 2.125 10 10 CECE CN(c1ccc(OC(F)(F)F)cc1)[C@]1(CN)CCOC1 2162641196 ZCINMHJCAWVJJZ-LBPRGKRZSA-N 290.285 2.139 10 10 CECE CN1CCc2cc([C@@H](O)C[C@H]3CCNC3(C)C)ccc21 2163072290 WVYMARUEYXCADJ-ZBFHGGJFSA-N 274.408 2.491 10 10 CECE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1[C@@H](NN)c1ccc2c(c1)CCN2C 2163158884 UHCYKNJZNTZKSY-QMCDRNHQSA-N 271.408 2.475 10 10 CECE C[C@@H]1CN([C@H](C)c2cc(O)ccc2O)C[C@@H]1CCN 723920826 ZWTLYTCKYJALSP-UTUOFQBUSA-N 264.369 2.076 10 10 CECE C[C@@H](NCCCN)c1cccc(C(F)(F)F)c1O 817938022 BQJHOHFQFCTTMF-MRVPVSSYSA-N 262.275 2.410 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CC[C@H]3O)[C@H]2CC[C@H]12 2133728698 WFGNXUPFTZTQKH-JONQDZQNSA-N 259.349 2.016 10 10 CECE Cc1ccc(Br)c([C@@H](C)N2CCNCC2)c1O 575283712 IUKGNEUHLYJNOV-SNVBAGLBSA-N 299.212 2.429 10 10 CECE CO[C@H]1C[C@@H](C[C@@H](NN)c2ccc(N(C)C)cc2)C1 721117595 DMJCTQOCKGGYPB-BYCMXARLSA-N 263.385 2.072 10 10 CECE CN(C/C=C\c1ccc(N(C)C)cc1)CC1CN(C)C1 827126295 YUTLIQSUMQIPAC-WAYWQWQTSA-N 273.424 2.259 10 10 CECE COc1cccc(CNC(=O)[C@@H]2CCC2(C)C)c1O 830535446 HQWDWEHVJIBIIH-NSHDSACASA-N 263.337 2.453 10 10 CECE CC[C@@H](N[C@H](CC)c1ccc(N(C)C)cc1)C(=O)NC 834910050 CJEABLVJYSKKIE-HUUCEWRRSA-N 277.412 2.318 10 10 CECE CN(C)c1ccc(/C=C\CN[C@@H]2CCCCNC2=O)cc1 835037807 XRUASKLPXUCXOX-OGZRUICASA-N 287.407 2.024 10 10 CECE C[C@H]1CCNC[C@H]1NCc1cc(Cl)cc(F)c1O 841059570 UNOHLODDPGBTLI-QPUJVOFHSA-N 272.751 2.272 10 10 CECE CCCN(CC(=O)N(C)C)Cc1cc(C)cc(OC)c1O 754723815 VYFXCYXYMUZMPA-UHFFFAOYSA-N 294.395 2.009 10 10 CECE Cc1ccncc1CCNC(=O)NCc1ccccc1O 852494672 FKYZMMQEPAGUDG-UHFFFAOYSA-N 285.347 2.138 10 10 CECE COC(=O)C1=CC[C@@H](N[C@@H](C)c2cccc(OC)c2O)C1 858470511 IBRPVLGQRWAFIL-CMPLNLGQSA-N 291.347 2.313 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)CCOCC2CC2)c1 751388919 QUHGIZWUVXZJBA-NSHDSACASA-N 293.363 2.395 10 10 CECE COCC1(CCNC(=O)NCc2cc(C)ccc2O)CC1 858570243 VJHQJYFWNOWFBJ-UHFFFAOYSA-N 292.379 2.317 10 10 CECE CC[C@@H]1NCC[C@H]1NC/C=C\c1ccc(N(C)C)cc1 863647157 XXUMPCHHEOJLBH-JOGGYFKDSA-N 273.424 2.496 10 10 CECE CCc1cc(NC(=O)NCCc2ccc(O)c(O)c2)no1 761647325 TXIMXSOJIXEVOB-UHFFFAOYSA-N 291.307 2.012 10 10 CECE C[C@H](N[C@@H]1CCNC12CCC2)c1cc([N+](=O)[O-])ccc1O 863540561 CFJVOXADTFFDHG-IINYFYTJSA-N 291.351 2.236 10 10 CECE CCC[C@](C)(CO)NCc1ccc(F)c(F)c1O 877035269 GCXYGZOSSXACFD-CYBMUJFWSA-N 259.296 2.311 10 10 CECE CCc1cc(CN(C)c2ccc(CO)cc2)n(C)n1 1877231395 JPGXZDKEMNIUJX-UHFFFAOYSA-N 259.353 2.111 10 10 CECE CN(Cc1ccccc1O)C[C@H]1CCC(F)(F)[C@@H]1O 1877524220 QEZRYKZPJDSIBX-DGCLKSJQSA-N 271.307 2.230 10 10 CECE NC(=O)C[C@@H]1CCCCN1Cc1cccc(Cl)c1O 775664953 STJBBMHGZNHQJD-NSHDSACASA-N 282.771 2.276 10 10 CECE COC(=O)[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C1CC1 774481857 ILDKNASYIMBLNX-NHYWBVRUSA-N 276.380 2.355 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])CC[C@@H]1C1CC1 1876610835 NOBHTEMIBRESIG-YPMHNXCESA-N 266.345 2.398 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1CCN1Cc1ccc(N)cc1 1955941905 RXPFULHKGLQNNL-CQSZACIVSA-N 291.395 2.368 10 10 CECE C[C@@H]1CO[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 895712136 ZOUVCDHYXXAABA-BBRMVZONSA-N 288.391 2.328 10 10 CECE Cc1cc(CO)ccc1N1CC(O)(c2cccs2)C1 1878933260 YLKWJGDTNKGSMI-UHFFFAOYSA-N 275.373 2.257 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2NCCSC2(C)C)cc1 1879490869 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MDUJUWPVOPGXIE-QGZVFWFLSA-N 272.392 2.173 10 10 CECE C[C@H]1CC(F)(F)CN1C(=O)CCOc1ccc(N)cc1 2172048648 SUMJIFBDCOAXPI-JTQLQIEISA-N 284.306 2.294 10 10 CECE C[C@@H]1N([C@H](C)C(=O)Nc2ccc(N)cc2)CCC1(F)F 2172041538 NSWVJLNQDWXCJW-ZJUUUORDSA-N 283.322 2.325 10 10 CECE CN1C[C@H]2CN(c3ccc(CN)c(Cl)c3)C[C@]2(C)C1 702270059 NYEMKCQAMUUVFC-WFASDCNBSA-N 279.815 2.187 10 10 CECE CN(c1ccc(OC(F)(F)F)cc1)[C@@]1(CN)CCOC1 2162641195 ZCINMHJCAWVJJZ-GFCCVEGCSA-N 290.285 2.139 10 10 CECE OC[C@@H]1CCC[C@@H]1CNCc1ccc(F)c(F)c1O 703363546 HCRQJBNPAQQXBY-KOLCDFICSA-N 271.307 2.169 10 10 CECE CC[C@@H](COCc1cc(CNC)ccc1OC)N(C)C 2177823783 BEMIBELXSOYBCA-HNNXBMFYSA-N 280.412 2.271 10 10 CECE CCN1CCc2cc([C@@H](N)C3(O)CC(SC)C3)ccc21 2163130088 DVBMWKZWZPNSNX-OGVSOVDVSA-N 292.448 2.325 10 10 CECE Nc1ccc(NC(=O)CN2CC[C@H]3CCC[C@@H]32)cc1 378683536 ZIGOMPDRIQJLBX-RISCZKNCSA-N 259.353 2.082 10 10 CECE CCOC[C@@H]1CCN(c2ccc([C@H](C)N)c(O)c2)C1 707593711 NKCHNEMQBTWEEO-NWDGAFQWSA-N 264.369 2.275 10 10 CECE CO[C@@H]1CCC[C@H]1N(C)c1ccc(CN)cc1F 687425324 NFTRYOQVVDZYOY-ZIAGYGMSSA-N 252.333 2.288 10 10 CECE CNCc1ccc(N(C)C[C@@]2(C)CCOC2)c(F)c1 687509074 ADXVGLWZGSDSNT-OAHLLOKOSA-N 266.360 2.408 10 10 CECE CCN1CC[C@@H](N(C)c2c(F)cc(CNC)cc2F)C1 688459692 ZQNQNJINPATLDW-GFCCVEGCSA-N 283.366 2.215 10 10 CECE N[C@H]1C(=O)Nc2cc(N3CCC[C@H](CCF)C3)ccc21 689467772 CUKAIFKPZAKYHP-QMTHXVAHSA-N 277.343 2.215 10 10 CECE CNC1(C(=O)N(C)Cc2ccccc2O)CCCCC1 380737756 SXINBOFOQQHRPZ-UHFFFAOYSA-N 276.380 2.273 10 10 CECE CC1(C)CN(c2c(F)cc(CN)cc2F)CCCO1 381806721 FQOMQAQXTHIQMF-UHFFFAOYSA-N 270.323 2.429 10 10 CECE CNCc1ccc(N2CC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1C 2178159963 LHOJUNZJKUECSN-XHSDSOJGSA-N 274.408 2.310 10 10 CECE COc1ccc([C@H](C)N[C@H]2CCCC23OCCO3)c(O)c1 715601142 YGJLVRXINYJFOL-NHYWBVRUSA-N 293.363 2.347 10 10 CECE CC[C@H]1[C@H](CO)CCN1c1ccc(CN)c(F)c1F 385627943 AVCRWUCNKSRMPB-QWRGUYRKSA-N 270.323 2.021 10 10 CECE CN(Cc1ccn(C)n1)c1ccc(CO)c(Cl)c1 723488258 QEFSWCWWRBPLPD-UHFFFAOYSA-N 265.744 2.202 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCc1cn(C)nn1 389811296 GRWDXHDMPYNMFK-PWSUYJOCSA-N 272.352 2.167 10 10 CECE C[C@H]1CN(C)C[C@@H]1NCc1c(O)cccc1Br 722243452 ILGWWPHNYXACAT-CABZTGNLSA-N 299.212 2.194 10 10 CECE Nc1ccc(CCNC(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)cc1 394185206 SCJXWUQPTJKTTI-KCQAQPDRSA-N 273.380 2.299 10 10 CECE CCO[C@@H]1C[C@H](OC)CN(c2ccc([C@@H](C)O)cc2)C1 2165442468 YJKXLYDBAMJRNX-UHOFOFEASA-N 279.380 2.370 10 10 CECE Oc1c(Cl)cccc1CN[C@@H]1CC12CC(O)C2 725000037 IYTOMAZILAUZPN-DMLGSKKGSA-N 253.729 2.049 10 10 CECE C[C@@H]1CC[C@H](C(=O)O)CN1[C@H](C)c1ccc(O)cc1O 397045048 UOMSIIBDZDNOTM-MXWKQRLJSA-N 279.336 2.344 10 10 CECE C[C@@H]1Cc2c(cnn2C)[C@H](c2ccc(N(C)C)cc2)N1 2174327972 IAAVLDXTDRXHAN-BZNIZROVSA-N 270.380 2.110 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](CO)OCC2(C)C)cc1Cl 2167526737 KKDKQGCQDGCTQA-CMPLNLGQSA-N 298.814 2.336 10 10 CECE Oc1ccc(-c2noc([C@H]3CCCCNC3)n2)cc1O 2178928251 CVOURTGBALBIOX-JTQLQIEISA-N 275.308 2.005 10 10 CECE CN1CCCc2cc(N3C[C@H]4CCNC[C@@H]4C3)ccc21 2168793139 VPJXPWPLITXVPE-HUUCEWRRSA-N 271.408 2.115 10 10 CECE C[C@H](NCCOC(=O)N1CCCC1)c1ccccc1O 2179209858 QBYFCPHITDZPLJ-LBPRGKRZSA-N 278.352 2.275 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2nc(CC(F)(F)F)no2)C1 2169741496 BVBUZQNIVKCKLQ-ZETCQYMHSA-N 290.249 2.449 10 10 CECE CCN(C[C@@H]1CCOC1)c1cc(OC)c(OC)cc1N 2169932931 BISLNHCKZJBRTQ-NSHDSACASA-N 280.368 2.149 10 10 CECE CN(C[C@H]1[C@H]2OCCC[C@H]12)C(=O)Nc1ccc(N)cc1 2176453288 VEZDVFCVWTUFDZ-MCIONIFRSA-N 275.352 2.158 10 10 CECE Cc1cc(N2CCS[C@H]3COCC[C@H]32)ccc1CCN 2170505997 PJDGDHHJABAJCL-CVEARBPZSA-N 292.448 2.207 10 10 CECE CCN[C@H](C)c1ccc(N2CC3(CC[C@@H]3O)C2)cc1O 2179702126 AHHCSGFNODNHSR-ABAIWWIYSA-N 276.380 2.024 10 10 CECE CC(C)(C)NCc1ccc(N2C[C@@H](F)[C@H](CO)C2)cc1 2177144309 QTVPNZXFZILJSA-DZGCQCFKSA-N 280.387 2.341 10 10 CECE C[C@@H]1CCCN(C2CN(c3ccc(CN)cc3F)C2)C1 2188383158 YMHWKCUAZHRSRM-GFCCVEGCSA-N 277.387 2.205 10 10 CECE CNCc1ccc(N2CCN3C[C@@H](C)C[C@@H]3C2)cc1C 2181277323 BVFBWFKBGZNDGB-SUMWQHHRSA-N 273.424 2.245 10 10 CECE Cc1cncc(/C=C/C(=O)N2CCCn3nccc32)c1 269452400 SRQGDKMKMFBFHS-ONEGZZNKSA-N 268.320 2.037 10 10 CECE CCN(CCOCC(F)F)Cc1ccc(N)cc1 2328208755 DWQISXJSVYFAMP-UHFFFAOYSA-N 258.312 2.372 10 10 CECE COc1ccc(N(C)[C@@H]2CCN(C)[C@@H](C)[C@H]2C)c(N)c1 2193641851 FMZUVZXNANLFIU-TYNCELHUSA-N 277.412 2.442 10 10 CECE O=C(O)[C@@H]1CCC[C@H](CNCc2c(O)cccc2Cl)O1 2193743910 MQYAWIJQXGYEFR-RNCFNFMXSA-N 299.754 2.158 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)[C@H]3CS[C@@H](C)C3)ccc21 2189453728 KGTFTHTWODKODT-PXWWUCIGSA-N 291.420 2.229 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H]3C[C@@H]32)c(Br)c1 1907001354 ZERAGLCIQPPDII-OXHMUOHRSA-N 297.196 2.446 10 10 CECE COc1ccc(O)c(CN2CCC[C@H]3[C@H]2CCN3C)c1 2183736396 SBSVHKGZOZMAQQ-LSDHHAIUSA-N 276.380 2.069 10 10 CECE NCc1ccc2c(c1)CCCN2[C@H]1CC(F)(F)C[C@H]1O 2189838230 BUBRSLXQJYAISE-UONOGXRCSA-N 282.334 2.057 10 10 CECE COCCNCc1ccc(N2[C@H]3COC[C@H]2C3)cc1Cl 2198574863 NGBNEAFNHPWJIX-ZIAGYGMSSA-N 296.798 2.054 10 10 CECE CCc1cc(CN[C@@H](C)c2c(O)cccc2O)on1 2096357818 OJSWUCUSZLWREY-VIFPVBQESA-N 262.309 2.499 10 10 CECE C[C@@H](N)c1ccc(N2[C@H]3CC[C@@H]2[C@H]2CC[C@@H]3O2)cc1O 2198653933 FXRWGAGXMDCLMT-OATJKSFMSA-N 274.364 2.311 10 10 CECE N[C@@H]1CCCc2cc(N3CCN4CCC[C@@H]4C3)ccc21 2184682877 TZSVPKKGGKYVBW-NVXWUHKLSA-N 271.408 2.307 10 10 CECE CN(C1C[C@@H]2CC[C@H]2C1)S(=O)(=O)Cc1ccc(N)cc1 2190434009 COORVWMKHPLWQA-STQMWFEESA-N 294.420 2.219 10 10 CECE CN(c1ccc2c(c1)CC[C@H]2N)[C@H]1CN2CCC1CC2 2184739117 BYJWJJZWACETGX-SJORKVTESA-N 271.408 2.163 10 10 CECE CCN[C@H]1CCc2cc(N3CC(C[S@@](C)=O)C3)ccc21 2184726925 MNWDNSOESRHFLL-OXJNMPFZSA-N 292.448 2.098 10 10 CECE Oc1cc(Cl)ccc1CNCC1CC(n2cncn2)C1 2184868277 XDXSAILLRCJITH-UHFFFAOYSA-N 292.770 2.378 10 10 CECE CC[C@@H]1CN(c2c(F)cc([C@H](C)NC)cc2F)C[C@@H]1O 2194686493 BYUQCZVWMVVPSK-RBZYPMLTSA-N 284.350 2.452 10 10 CECE CC[C@H](C)N(CC(=O)O)Cc1c(C)cccc1O 2042625070 HYBLPRPOKRYILR-NSHDSACASA-N 251.326 2.386 10 10 CECE CC1(CN)CN(c2ccc(OC(F)(F)F)cc2)C1 2044340533 LZRQSRKSBABMFZ-UHFFFAOYSA-N 260.259 2.370 10 10 CECE Nc1ccc(OCC(=O)OC[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2191057711 UEXBIIMOARAENJ-WIBJFCRQSA-N 273.332 2.093 10 10 CECE C[C@@H]1CO[C@@H](CN[C@@H](C)c2c(O)cccc2O)C1 2047502948 PBBAHMYBZSETPF-GARJFASQSA-N 251.326 2.173 10 10 CECE CN1CCN(c2ccc(CN)c(Cl)c2)[C@@H]2CC[C@H]21 2049377391 XGWDPRSVTJASBT-ZIAGYGMSSA-N 265.788 2.082 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN1C(=O)[C@@H]1CCCc2nccn21 2185978790 OQJCNOODOKRKRC-MNOVXSKESA-N 274.328 2.062 10 10 CECE CCNCc1ccc(N(C)C[C@@]2(O)CCOC2)cc1Cl 2185942587 JZFHXLGMCQBSFJ-HNNXBMFYSA-N 298.814 2.037 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCC[C@H]2CC[C@H]21 2052301251 YARUROGNTXUKKI-UMNHJUIQSA-N 252.318 2.008 10 10 CECE CCNCc1ccc(N(C)C[C@@]2(OC)CCOC2)cc1 2186291494 ICEDVFHEYZWDPN-INIZCTEOSA-N 278.396 2.038 10 10 CECE CCCOc1cc(N2CC[C@]3(CCNC3)C2)ccc1N 2191590796 TYJUCNWPXPORFG-INIZCTEOSA-N 275.396 2.247 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@](C)(N)CC(F)F)cc1 2054678061 YETLALGEBMLWRX-OLZOCXBDSA-N 258.312 2.159 10 10 CECE CN[C@@H](C)c1ccc(N2CCn3nncc3C2)cc1Cl 2186616513 NCMTXIATRKOQGJ-JTQLQIEISA-N 291.786 2.232 10 10 CECE CCP(=O)(CC)C[C@H](O)COc1ccc(N)cc1 2058335525 GZMQCSSXCIOLIA-GFCCVEGCSA-N 271.297 2.411 10 10 CECE CCN(Cc1ccc(N)cc1)C[C@H]1OCC[C@H]1F 2058656107 PURZVTZWSHHGJO-ZIAGYGMSSA-N 252.333 2.218 10 10 CECE Cc1nn(C)c(N(C)[C@@H](C)c2ccccc2O)c1C=O 2192593382 XQXSLJDIPIZJJF-NSHDSACASA-N 273.336 2.444 10 10 CECE CNC[C@]1(CN(C)[C@H](C)c2ccccc2O)CCOC1 2192566865 KURPEMDQWRFTLR-CJNGLKHVSA-N 278.396 2.011 10 10 CECE Cc1nn(C)c(N(C)[C@H](C)c2ccccc2O)c1CN 2192596618 UQJQXAOQEMOZGG-LLVKDONJSA-N 274.368 2.090 10 10 CECE Cc1nc(CN)cc(N(C)[C@H](C)c2ccccc2O)n1 2192595520 FKHKGBALTPPTTR-SNVBAGLBSA-N 272.352 2.147 10 10 CECE C[C@H](CC1CC1)N(C)c1ccc2c(c1)NC(=O)[C@H]2O 2101862548 OGMOEWUKZKVCLZ-OTYXRUKQSA-N 260.337 2.297 10 10 CECE NCc1ccc(N2C[C@H]3CCC[C@@]3(CO)C2)c(Cl)c1 2103164207 HQGKOGFZGIBSEL-DOMZBBRYSA-N 280.799 2.398 10 10 CECE CC[C@@](C)(OC)C(=O)NCc1cccc(C)c1O 2084055887 BCFZDSXFWZNDJD-CQSZACIVSA-N 251.326 2.132 10 10 CECE COc1cc(N(C)C[C@@H]2C[C@H]2CF)ccc1CN 2084017900 UPFWFHMJLSNYLR-RYUDHWBXSA-N 252.333 2.196 10 10 CECE Nc1ccc(Oc2nnc([C@H]3CCOC3)s2)cc1 2084183524 GWWULJPAQMHNDV-QMMMGPOBSA-N 263.322 2.417 10 10 CECE CN(Cc1cc(N)ccc1O)[C@H]1CC[C@@]12CCCO2 2104362850 YJEPLLYQNAIQIL-GJZGRUSLSA-N 262.353 2.118 10 10 CECE Cc1cccc(O)c1CN1CCC[C@@H]2CNCC[C@H]21 2104506717 BVFJJPQKIVUTCG-UKRRQHHQSA-N 260.381 2.275 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C[C@H]2C[C@@H]3COC[C@@H](C3)C2)C1 2085865995 GKMXRLPTESYNIC-FVCCEPFGSA-N 250.346 2.434 10 10 CECE CN(C)c1ccc([C@@H](O)[C@@H]2CC23CCNCC3)cc1 2106794814 ACYBOYSCTPXADV-LSDHHAIUSA-N 260.381 2.176 10 10 CECE CCN1CCc2cc([C@@H](N)c3ncoc3C)ccc21 2106853707 UXYNOVSVHBLZRH-CQSZACIVSA-N 257.337 2.414 10 10 CECE CN1CCc2cc([C@H](N)[C@@H]3C[C@]34CCOC4)ccc21 2106852142 BWHRMENYAQHTMJ-BPUTZDHNSA-N 258.365 2.105 10 10 CECE CC[C@@H](C)NC[C@@H](O)c1ccc2c(c1)CCCN2C 2106825184 HDXKFQYBOGWPDT-MLGOLLRUSA-N 262.397 2.491 10 10 CECE C[C@@H]1OCCO[C@H]1CN(C)Cc1cccc(Cl)c1O 2087372636 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2163072192 WFODQSRZOBFYRD-QGZVFWFLSA-N 274.408 2.276 10 10 CECE Cc1cc(Br)c(O)c(CN(C)[C@@H](C)CO)c1 809742710 GQMLHIDXECCHJO-VIFPVBQESA-N 288.185 2.276 10 10 CECE CO[C@H]1CC(N(C)c2ccc([C@H](C)N)cc2)C[C@@H]1OC 2166103875 XQPBGWOIIKRTIM-UVBJJODRSA-N 278.396 2.335 10 10 CECE CN(c1cc2c(cc1N)OCCO2)[C@@H]1[C@@H]2C[C@H]2[C@H]2C[C@H]21 2166610933 IROJAEMZDXKHLA-VMMHFHKZSA-N 272.348 2.131 10 10 CECE CN1CCN(c2ccc(CN[C@H]3C[C@@H]4C[C@@H]4C3)cc2)CC1 818238863 PTTIZPWJJZUKCL-BJWYYQGGSA-N 285.435 2.327 10 10 CECE CO[C@@H]1C[C@@H]2C[C@H](NCc3c(O)cccc3F)C[C@H]21 2133898109 QYAREBJPPPHQJM-KIGUWFBYSA-N 265.328 2.434 10 10 CECE O=C(c1ccc(O)c(O)c1)N(Cc1ccoc1)C1CC1 723737213 UVBSCAJSFOWXIS-UHFFFAOYSA-N 273.288 2.496 10 10 CECE C[C@H](NC(=O)CC1CCN(C)CC1)c1ccccc1O 827969182 JKRSLNWGZOKMEP-LBPRGKRZSA-N 276.380 2.301 10 10 CECE CC[C@H](NC[C@H]1CCCCN1CCO)c1ccccc1O 824584266 ZROUTIIPSNWWEM-ZBFHGGJFSA-N 292.423 2.280 10 10 CECE Cc1cc(O)c(CN[C@H]2CCn3ccnc32)cc1C 824525664 CALAIFNFOKWZHU-ZDUSSCGKSA-N 257.337 2.440 10 10 CECE CO[C@@H]1CC[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)C1 824670022 TVXKXBWVTCRZAS-QWHCGFSZSA-N 294.370 2.323 10 10 CECE COc1ccc(N2CCC[C@@H](OC)CC2)c(N)c1 691987167 ZZZAPNOIKLKNRN-LLVKDONJSA-N 250.342 2.283 10 10 CECE CC(=O)c1cc(F)cc(CN[C@@H]2CCNC23CCC3)c1O 903465156 DXEURCOZZTXWTE-CQSZACIVSA-N 292.354 2.108 10 10 CECE COCC(C)(C)CC(=O)NCc1ccccc1O 839611411 HEYRDTFWSQHDIS-UHFFFAOYSA-N 251.326 2.071 10 10 CECE O=C(c1cc(O)cs1)N1CCC[C@]2(CCCOC2)C1 746894055 DCLVKQMDLRSXQN-AWEZNQCLSA-N 281.377 2.487 10 10 CECE Nc1ccc2c(c1)CC[C@H]2NCc1cc2c(cc1O)OCO2 849353100 YQXRHZWKFOZGCU-CQSZACIVSA-N 298.342 2.480 10 10 CECE Cc1cc(Cl)cc(CNC[C@H](N)C2CC2)c1O 841051245 XCQGTTVVLPXRJO-LBPRGKRZSA-N 254.761 2.181 10 10 CECE CN(C)c1ccc(CN2CCC[C@]3(CCNC3)C2)cc1F 843123843 QHIZAQQYPZCVRC-QGZVFWFLSA-N 291.414 2.467 10 10 CECE C[C@]1(F)CNCCN(Cc2c(O)ccc(Cl)c2F)C1 843125233 ONXJIFKUKBMMND-ZDUSSCGKSA-N 290.741 2.318 10 10 CECE CCO[C@@H]1[C@@H](C)[C@@H]1C(=O)N[C@H](C)c1ccccc1O 913763437 GVOCHUCFABDXIA-GIFSMMMISA-N 263.337 2.240 10 10 CECE Cc1cc(O)c(CNC[C@@H](C)CCO)c(Cl)c1 840901390 JAGUMRRLMVBWBS-VIFPVBQESA-N 257.761 2.462 10 10 CECE CO[C@](C)(CO)CNCc1ccc2ccccc2c1O 848922305 QMMZNDMOCBAZEJ-INIZCTEOSA-N 275.348 2.032 10 10 CECE Cc1cc(Cl)cc(CN2CCNC[C@H]2C)c1O 843047814 WXIOBOMRGHAZJT-SNVBAGLBSA-N 254.761 2.148 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@H](CN)[C@@H](C)C2)c1O 923503698 LDNFUURRVMDTAZ-CMPLNLGQSA-N 294.370 2.151 10 10 CECE COc1ccc(N2CC[C@@H](Nc3ncc(C)cn3)C2)cc1 853759289 RHYLFMWRCILBCQ-CYBMUJFWSA-N 284.363 2.484 10 10 CECE COc1ccc([C@H](C)N2CC[C@@H]3COC[C@H]3C2)c(O)c1 690800500 XXYGJYWMENECTG-YNEHKIRRSA-N 277.364 2.430 10 10 CECE C[C@H]1C[C@H](NCc2cc(Cl)ccc2O)c2ncnn21 850351406 BCLSRAVUHGHHLY-KWQFWETISA-N 278.743 2.433 10 10 CECE CCN(C)c1ccc(CN2CCN(C3CC3)CC2)cc1 773754303 WFGSZNATKPUHKK-UHFFFAOYSA-N 273.424 2.423 10 10 CECE COc1cc(Cl)cc(CN[C@@]23CCOC[C@H]2C3)c1O 1880170987 DLKNJGUBIHPXQJ-QMTHXVAHSA-N 283.755 2.323 10 10 CECE C[C@H](O)c1cc(F)c(N2CC[C@H](CO)[C@H]2C)c(F)c1 1880491249 VAGIIXYUKNJDTG-KXUCPTDWSA-N 271.307 2.225 10 10 CECE CN[C@@H](C)c1cc(F)c(N2CCO[C@H](C)C2)c(F)c1 1880960035 FOKXZRPVAOONKL-ZJUUUORDSA-N 270.323 2.470 10 10 CECE COc1ccc(CN(C)C[C@@H]2CC[C@H](C)O2)c(O)c1 1885290977 BXNLLUQXKTXPFW-FZMZJTMJSA-N 265.353 2.400 10 10 CECE COc1ccc([N+](=O)[O-])c(Nc2ccc(N)cc2)n1 134215192 DYCFXLIDLSYPKO-UHFFFAOYSA-N 260.253 2.324 10 10 CECE CSc1ncc(CN[C@@H]2CCN3CCC[C@H]23)s1 2248710301 GPXSWGSVUYVYIJ-GHMZBOCLSA-N 269.439 2.191 10 10 CECE CC1(C)CC[C@]1(C)NS(=O)(=O)Cc1ccc(N)cc1 1889139942 BZGSWLOSRSVWKH-AWEZNQCLSA-N 282.409 2.267 10 10 CECE CC[C@@]1(C)CC[C@@H](CNC(=O)Cc2ccc(N)cc2)O1 1964440694 AMHVQXCILPCBJF-HOCLYGCPSA-N 276.380 2.275 10 10 CECE CO[C@H](CN[C@@H](C)c1ccccc1O)C1CCOCC1 877758275 QFRCSNIFYXWNIC-BLLLJJGKSA-N 279.380 2.484 10 10 CECE COc1ccc(N2CCCN(CC(F)F)CC2)cc1 1963439743 PSXREGOLEPACKH-UHFFFAOYSA-N 270.323 2.472 10 10 CECE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCN=[N+]=[N-] 1963700385 XQINFDGWNJVYMD-SNVBAGLBSA-N 299.375 2.352 10 10 CECE C[C@@H](Cc1nccn1C)NCc1ccc2c(c1)CCO2 1964056056 BUYSNYJENRGOKS-LBPRGKRZSA-N 271.364 2.076 10 10 CECE CCCN(c1ccc(CN)cc1F)[C@H]1CCOC1 394105338 HUKYNDSXEJIRGJ-LBPRGKRZSA-N 252.333 2.290 10 10 CECE O=[N+]([O-])c1cc(CNC2CCCC2)cc(O)c1O 83391429 OHAGENYHYYMITE-UHFFFAOYSA-N 252.270 2.038 10 10 CECE Cc1ccc(O)c([C@@H](N)c2nnc(C(C)(C)C)o2)c1 83448331 IZIBZMFVZYFQAE-LLVKDONJSA-N 261.325 2.429 10 10 CECE Oc1cccc([C@H]2NCCc3c(F)cccc32)c1O 83596818 WNJPLFCONFHDRS-AWEZNQCLSA-N 259.280 2.472 10 10 CECE CN(Cc1nnsc1Cl)c1ccc(N)cc1 702125664 MJVBFIIYUQCTFZ-UHFFFAOYSA-N 254.746 2.410 10 10 CECE COc1ccc(N2C[C@@H]3CCC[C@]3(N)C2)cc1OC 1893619173 MGOOBFMGQAEVOP-NHYWBVRUSA-N 262.353 2.021 10 10 CECE C[C@@H](NCCN(C)C1CC1)c1cc(F)ccc1O 94618148 OFNXASAOCKFDKG-SNVBAGLBSA-N 252.333 2.276 10 10 CECE Cc1ccc([C@H](C)NCCC(=O)N2CCCC2)c(O)c1 20127399 JICBKYYDMHCQEQ-ZDUSSCGKSA-N 276.380 2.364 10 10 CECE CCC(F)(F)CN(C)S(=O)(=O)Cc1ccc(N)cc1 692336074 KGNILLJSLOVLIG-UHFFFAOYSA-N 292.351 2.076 10 10 CECE CC(=O)Nc1ccc(C(=O)NCc2ccccc2O)s1 706343411 JTMCNLYUSGPJIG-UHFFFAOYSA-N 290.344 2.342 10 10 CECE CCc1cccc(CN2CCC[C@@H]2CN(C)C)c1O 709292315 XVEHLXAYNYDXAG-OAHLLOKOSA-N 262.397 2.481 10 10 CECE C[C@@H]1CN([C@H](C)c2ccccc2O)C[C@]1(C)C(=O)O 710264914 FOFDHODNLHKUCG-HFAKWTLXSA-N 263.337 2.496 10 10 CECE C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@]1(C)C(=O)O 710327324 GVTXLLLYOFJQLJ-WBMJQRKESA-N 276.380 2.295 10 10 CECE Nc1cc2c(cc1N1CCC[C@H](CF)C1)CCC(=O)N2 711424089 RCYIMPJJKDUZAR-SNVBAGLBSA-N 277.343 2.339 10 10 CECE CNCc1ccc(N(C)C(C)(C)CCO)cc1C 688355851 RLAFOYDZZUNOBY-UHFFFAOYSA-N 250.386 2.312 10 10 CECE CC(C)N(CCOc1ccc(N)cc1)CC(C)(C)O 689994462 RIIFXZQWUAJSGX-UHFFFAOYSA-N 266.385 2.129 10 10 CECE CC[C@@H](c1ccccc1O)N(C)C1CCS(=O)(=O)CC1 694195063 WWYWGPMKJMACLH-AWEZNQCLSA-N 297.420 2.352 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@@H]3CC[C@H](C2)O3)cc1O 93671972 YQABJEZNEVNJSZ-BNOWGMLFSA-N 276.380 2.430 10 10 CECE CNCc1ccc(N2CCN3CCCC[C@@H]3C2)c(C)c1 94439966 FKXYSGJVLGVPRP-MRXNPFEDSA-N 273.424 2.389 10 10 CECE C[C@H](NCc1ccc2c(c1)CCCO2)C1CCNCC1 904385513 ZUAPCBQFLRGWHU-ZDUSSCGKSA-N 274.408 2.489 10 10 CECE CN[C@H](C)c1ccc(N2CC[S@@](=O)C[C@H]2C)c(F)c1 2115333464 LPKJAUVWJJTJIC-XCJKDKRRSA-N 284.400 2.063 10 10 CECE CN(C)c1ccc([C@H](O)[C@H]2[C@H]3CCC[C@@H]3[C@H]2N)cc1 2116711973 IKVRFIWTJMVBDW-GVRJEKJASA-N 260.381 2.159 10 10 CECE CCN(CCO)c1ccc(OCC(F)(F)F)cc1 2219568148 VMMCFNDIYUCTOL-UHFFFAOYSA-N 263.259 2.446 10 10 CECE CC(C)N1CCN(c2ccc(CN)cc2)C(C)(C)C1 2118418529 REVOYYNRBKAHJW-UHFFFAOYSA-N 261.413 2.454 10 10 CECE CCOc1cccc(CN[C@@H]2C=C[C@H](OC)C2)c1O 2119389613 FFLMICGTZGLVGS-OLZOCXBDSA-N 263.337 2.224 10 10 CECE CCOC(=O)N1CCC(N=NNc2cccnc2)CC1 1860493759 BJMDLPZUZVCWJK-UHFFFAOYSA-N 277.328 2.482 10 10 CECE O=C(/C=C\c1cccnc1)N1CCc2cccnc21 1535409129 IUCNJRYZLSGPBZ-WAYWQWQTSA-N 251.289 2.079 10 10 CECE O[C@H](c1ccc(N2CCCCC2)cc1)[C@@H]1C=CCN1 2120520606 LWWJFFIGHUVUDM-JKSUJKDBSA-N 258.365 2.238 10 10 CECE CNc1ncc(C(=O)N[C@@H](C)c2ccccc2O)s1 1471195031 SPLWPGBCEFWJCC-QMMMGPOBSA-N 277.349 2.381 10 10 CECE CNCc1ccc(N(C)Cc2cncnc2)c(C)c1 2122277322 WSIAUDJTIQLWDK-UHFFFAOYSA-N 256.353 2.141 10 10 CECE CO[C@@H]1C[C@H]2[C@@H]1CCN2CCCc1ccc(N)cc1 2121832366 PFVDICUNTDUCSF-HRCADAONSA-N 260.381 2.311 10 10 CECE C[C@@H](N)c1ccc(N(C)C[C@@H]2OCC[C@@H]2F)c(F)c1 2122553745 XDEPBUDCXZVYSC-PUYPPJJSSA-N 270.323 2.409 10 10 CECE COc1nc(C)cc(CN2CCC[C@@H]2CN=[N+]=[N-])n1 2123017455 ASALOJDCGGCNCB-LLVKDONJSA-N 262.317 2.068 10 10 CECE Oc1ccc(CNC2(C(F)F)CCCC2)c(O)c1O 2123352132 ZVCRHDNLPDERPH-UHFFFAOYSA-N 273.279 2.471 10 10 CECE Cc1cnc(C(=O)NCc2ccc(O)cc2O)c(C)c1 1639447867 LPDBEDPCFQFXIQ-UHFFFAOYSA-N 272.304 2.040 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3CC[C@H]2O3)C1 1912168882 XNMSMWZUZWWUEK-WHOHXGKFSA-N 264.329 2.103 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(CCCOCC(F)(F)F)C1 1912161680 MFNFORJIFBHNPA-MRVPVSSYSA-N 252.240 2.340 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@@]12CCCC[C@@H]1OCC2 1912158152 VYTSXLBTFBCSAV-WCQYABFASA-N 266.345 2.495 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(CCCO[C@@H]2CCOC2)C1 1912167473 LCOZTYLRVVBUPW-CHWSQXEVSA-N 268.361 2.204 10 10 CECE Cc1cc(C)c(S(=O)(=O)N2CC[C@@H](N=[N+]=[N-])C2)s1 1912179727 UBWACCIEPYIXPL-SECBINFHSA-N 286.382 2.438 10 10 CECE O=C(O)c1ccc(NCc2cc(O)ccc2O)cc1 5933221 SQSOZLKKUXKFJQ-UHFFFAOYSA-N 259.261 2.408 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(F)c2F)[C@@H]1C 1914263802 ZKSGYSIPTLBZRO-KCJUWKMLSA-N 256.296 2.037 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)[C@@H]1CO 2128277943 USOXSPMZIMZKDI-HFBAOOFYSA-N 261.365 2.263 10 10 CECE C[C@H]1C[C@@H](O)CN(c2ccc3c(c2)CCC[C@@H]3O)C1 2128270229 CANNJFVFBYBTTL-PEYYIBSZSA-N 261.365 2.263 10 10 CECE C[C@H](O)[C@@H]1CCCCN1c1ccc2c(c1)CC[C@H]2O 2128322184 PPTFZSQUGTYULW-KNXALSJPSA-N 261.365 2.406 10 10 CECE CC1(C)CN(c2ccc3c(c2)CC[C@H]3O)CC[C@H]1O 2128317573 QGULIYJCHHFTBL-HUUCEWRRSA-N 261.365 2.263 10 10 CECE CC1(C)C[C@H](O)CN(c2ccc3c(c2)CC[C@H]3O)C1 2128325308 QUIBNWCRCLLSNI-DZGCQCFKSA-N 261.365 2.263 10 10 CECE CN(CCc1ccccn1)c1cc2c(cc1N)OCCO2 19868805 SRDBJEWOZVYTEJ-UHFFFAOYSA-N 285.347 2.114 10 10 CECE O=C(CN1C[C@H]2CCC[C@@H]2C1)c1ccc(O)c(O)c1 160037545 PKZWYYKIFSWSHE-VXGBXAGGSA-N 261.321 2.012 10 10 CECE C[C@@H]1Cc2ccccc2[C@]1(NCCN=[N+]=[N-])C(=O)O 2128958196 HRRXKAONXWDATN-RNCFNFMXSA-N 260.297 2.059 10 10 CECE C[C@@H]1CCCN(C(=O)CNCc2cc(Cl)ccc2O)C1 1857868337 CRXXWDKBBCAEIY-LLVKDONJSA-N 296.798 2.394 10 10 CECE CCN1C[C@H](C(C)C)NC[C@H]1c1cc(OC)ccc1O 250355156 SAMFWZXCHKXMDR-CABCVRRESA-N 278.396 2.392 10 10 CECE CC[C@@]1(C)CN([C@H](C)CN)c2cc(OC)c(OC)cc2N1 251499597 DQLIQXDZPRDXNR-BZNIZROVSA-N 293.411 2.452 10 10 CECE O=[N+]([O-])c1cc(N2CCCC[C@@H](F)C2)ccc1CO 2132058074 LWOFYDILDVHSFU-LLVKDONJSA-N 268.288 2.416 10 10 CECE Nc1ccc(NC(=O)NCC[C@@H]2CCCOC2)cc1 859696999 UVUHHFJRLIGXOQ-NSHDSACASA-N 263.341 2.207 10 10 CECE CC(C)[C@@H]1C[C@@H]1CNC(=O)COc1ccc(N)cc1 2135341124 VOEVEYXEWOHYHI-RISCZKNCSA-N 262.353 2.056 10 10 CECE COC[C@]1(CN[C@@H]2CCc3cccc(O)c32)CCCO1 1967527744 HCRHLAPZMQTVBT-CZUORRHYSA-N 277.364 2.165 10 10 CECE CC1(C)C[C@@H](C(=O)O)CN1Cc1ccc(F)cc1O 2139773927 LTGIARQXORQTAQ-SNVBAGLBSA-N 267.300 2.216 10 10 CECE Oc1cc(F)ccc1CN1CCC2(CCNC2)CC1 2139766289 SXUWEAUBFNHCQC-UHFFFAOYSA-N 264.344 2.107 10 10 CECE C[C@H](N[C@H](CCO)C(F)(F)F)c1c(O)cccc1O 1918555706 ZYXGNUMQPTZTEI-OIBJUYFYSA-N 279.258 2.062 10 10 CECE Oc1cc(F)ccc1CNC[C@@H]1CC(F)(F)CO1 1967823110 UGAUKCXETOJJME-JTQLQIEISA-N 261.243 2.045 10 10 CECE Cc1ccc(O)c([C@@H](C)N2CCN3C(=O)CC[C@H]3C2)c1 228184786 VXIYCLKXNWDQIQ-OLZOCXBDSA-N 274.364 2.068 10 10 CECE Nc1ccc(CC[C@@]23CCC[C@H]2CS(=O)(=O)C3)cc1 2137259994 DUBKSEGCWHZUEF-DZGCQCFKSA-N 279.405 2.416 10 10 CECE CC[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)(F)F 1968738796 FNBYSOFQGYLTAO-JTQLQIEISA-N 287.306 2.438 10 10 CECE CC(C)(C)n1c(S)nnc1-c1ccc(O)c(O)c1 232524325 KWKDZBXDNLKLDK-UHFFFAOYSA-N 265.338 2.400 10 10 CECE CCN(CC)C[C@@H](C)N[C@@H](C)c1c(O)cccc1O 233427948 HDOIVEWJSJSHRR-NEPJUHHUSA-N 266.385 2.479 10 10 CECE CCCN(CCN)Cc1c(O)cccc1Br 1937470729 AILSSCHHMDRZIJ-UHFFFAOYSA-N 287.201 2.325 10 10 CECE C[C@]1(N)CCCN(Cc2c(O)cccc2Cl)C1 1940603150 LVWQYXRRNHXGGF-ZDUSSCGKSA-N 254.761 2.359 10 10 CECE CCC[C@@H]1CCN(c2ccc3c(c2)NC(=O)[C@H]3N)C1 252838064 ADSILZKPSUDYDV-YGRLFVJLSA-N 259.353 2.265 10 10 CECE C[C@@H](CCNCc1ccc(Cl)cc1O)[S@](C)=O 1942496855 DJDCZXNLNVDLFG-XYZCENFISA-N 275.801 2.292 10 10 CECE COc1ccsc1[C@@H](NN)c1ccccc1O 1942400252 HTBOJILCQXJGAT-NSHDSACASA-N 250.323 2.015 10 10 CECE Oc1cc(Cl)ccc1CNC[C@H]1CC=CCO1 1946347181 LUVWYSNGFBVCFX-GFCCVEGCSA-N 253.729 2.480 10 10 CECE CNCc1cnc(Sc2n[nH]c(C(C)C)n2)s1 1949570508 LGRRNFIVALLGFX-UHFFFAOYSA-N 269.399 2.255 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H]3OCC[C@H]3C2)cc1 2143551655 DJHFCDMEAPQBKQ-DZGCQCFKSA-N 273.332 2.400 10 10 CECE CC(C)NCc1ccc(N(C)C[C@H]2COCCO2)cc1 2143687871 QPFGHPKESXKDRE-INIZCTEOSA-N 278.396 2.036 10 10 CECE CC[C@H](N)c1ccc(N(C)C[C@@H]2OCCO[C@@H]2C)cc1 2143683926 FATGIOKUEVNBCR-KCXAZCMYSA-N 278.396 2.337 10 10 CECE O=C(O)C1CCC(=Cc2cc(O)c(O)c(O)c2)CC1 1951474349 ZOXMJKKEXCPUJT-UHFFFAOYSA-N 264.277 2.462 10 10 CECE CCOC(=O)[C@@H]1CNC[C@H]1c1ccc2ccn(C)c2c1 1951637023 WCKNCFFLTMSRSQ-UONOGXRCSA-N 272.348 2.044 10 10 CECE COC[C@]1(OC)CCN([C@@H](C)c2cc(F)ccc2O)C1 2151855001 CIAKSBCDMSMAMZ-NHYWBVRUSA-N 283.343 2.330 10 10 CECE CCc1cccc(CN2CCOC[C@H]2CF)c1O 1971805772 UJSUAVLRSJGHNQ-CYBMUJFWSA-N 253.317 2.125 10 10 CECE CC1(O)CCN(c2ccc(CNC3CC3)cc2)CC1 168572474 RGLDEYGHARAVOU-UHFFFAOYSA-N 260.381 2.290 10 10 CECE Cc1cc(CCCC(=O)O)c(O)c(CN(C)C)c1 258583470 IVBAQKXJPSDINB-UHFFFAOYSA-N 251.326 2.170 10 10 CECE CCOC(=O)C[C@@H](N)c1cc(C(C)C)ccc1O 260273085 VMDVNMXCNQFWBG-GFCCVEGCSA-N 251.326 2.469 10 10 CECE OCCC1(NCc2c(O)cccc2Br)CC1 1989699867 FTWXSRZONFQTOJ-UHFFFAOYSA-N 286.169 2.159 10 10 CECE CN(C)c1ccc(C(=O)NCc2ccc(N)cc2)cc1 37666331 OMEHKQYBVAVERI-UHFFFAOYSA-N 269.348 2.265 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](C)[C@H]2C(=O)N(C)C)cc1 2146458224 WVIQSYOOVLOVDK-HUBLWGQQSA-N 275.396 2.009 10 10 CECE C[C@@H]1CC[C@](NCCN=[N+]=[N-])(C(N)=O)c2ccccc21 164048971 BXYHRFJPCXMNKT-QMTHXVAHSA-N 273.340 2.164 10 10 CECE Nc1ccc(NC(=O)N2CCO[C@@H]3CCC[C@@H]32)cc1 43428211 QBSWBNMCNUEMOE-QWHCGFSZSA-N 261.325 2.054 10 10 CECE Nc1ccc(OCCN2CCO[C@H]3CCCC[C@@H]32)cc1 43423833 WENBDPPAUXPULZ-HOTGVXAUSA-N 276.380 2.291 10 10 CECE COc1ccc(N(C)C[C@@H]2CCOC(C)(C)[C@@H]2N)cc1 2153814715 ZLCKINYHNMJWFE-SWLSCSKDSA-N 278.396 2.274 10 10 CECE C[C@H](NCC1CCN(C)CC1)c1cc(O)ccc1O 44515523 UEOBLBKKHQHZJV-NSHDSACASA-N 264.369 2.090 10 10 CECE COc1ccc(O)c([C@H](C)N[C@H]2CCOC[C@H]2C)c1 278555461 OVWIJGXDULEESA-SUNKGSAMSA-N 265.353 2.476 10 10 CECE C[C@H]1C[C@H](CCNCc2cc3c(cc2O)OCO3)CO1 2159421502 VBDVOEYWAUQVQN-QWRGUYRKSA-N 279.336 2.026 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@@H](C2)N(C)C3)c(C)c1 2160687672 PTWJYOFWWBUVTG-HOTGVXAUSA-N 273.424 2.245 10 10 CECE COC1(CNCc2ccc3c(c2)CCN3C)CCC1 181078440 WSSYNVMVKITGOW-UHFFFAOYSA-N 260.381 2.338 10 10 CECE OCc1ccc(N2C[C@@H](O)[C@H](C3CC3)C2)c(Cl)c1 2030220480 LMXLZRXMIKENEH-SMDDNHRTSA-N 267.756 2.039 10 10 CECE Nc1ccc(OCCN2CC3CC2(CF)C3)cc1 2030293579 CANKDJUOHMYKEW-UHFFFAOYSA-N 250.317 2.082 10 10 CECE CS(=O)(=O)[C@H]1CCCC[C@@H]1Nc1ccccc1N 2035394935 BISNCPFULKANEN-STQMWFEESA-N 268.382 2.037 10 10 CECE Cc1cc([C@@H](N)c2ccc3c(c2)CCN3C)sn1 2037098938 LIDXBDLPPSCTKB-AWEZNQCLSA-N 259.378 2.492 10 10 CECE CC(C)SC[C@@H](N)C(=O)N(C)[C@H](C)c1ccccc1O 2157830774 BOFZPIUKUUDZLS-DGCLKSJQSA-N 296.436 2.381 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)C[C@@H]1CCOC1 401407271 YQGLUYUCVZYUTL-NEPJUHHUSA-N 263.337 2.338 10 10 CECE N[C@@]1(CO)CCC[C@H](CSc2nccs2)C1 403207552 RAZBHSMNJJNWBE-ONGXEEELSA-N 258.412 2.115 10 10 CECE O=C(NC[C@@H]1CC[C@H]2C[C@@H]2C1)c1ccc(O)c(O)c1 403494652 WLICAPRXQUPLOQ-SCVCMEIPSA-N 261.321 2.264 10 10 CECE COc1ccc(CN2CCC[C@H](C)[C@H]2CCN)c(O)c1 404314585 AMZDBDOSFIOTOX-SWLSCSKDSA-N 278.396 2.350 10 10 CECE CC[C@H](N[C@@H](C)c1cc(F)ccc1O)C(=O)OC 311019738 UIZPHNDRWMIKQA-KWQFWETISA-N 255.289 2.134 10 10 CECE Cc1ccc([C@H](C)N2CCC(S(C)(=O)=O)CC2)c(O)c1 313597322 VLNRJOPSSZRGDM-LBPRGKRZSA-N 297.420 2.271 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CC[C@@H]1C[C@@H](CN)C2 2159185645 PINYWMOKZDEODZ-LPWJVIDDSA-N 276.380 2.361 10 10 CECE CCC[C@@H]1CNCC[C@@H]1NCc1ccc2c(c1)CCO2 2160557350 AVGQUJBLUDZLHQ-CVEARBPZSA-N 274.408 2.489 10 10 CECE C[C@]1(C(F)F)C[C@@H]1NC(=O)CCOc1ccc(N)cc1 2177421327 JCIGXDGAZDQXNG-FZMZJTMJSA-N 284.306 2.198 10 10 CECE COc1ccc(CN[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c(O)c1 701018896 ZWBKBRRUNUTSTH-VEABSNGSSA-N 265.353 2.302 10 10 CECE C[C@H](NC[C@@H]1C[C@H](O)C12CCC2)c1cc(O)ccc1O 2172242816 FPORKCGAXBXTGT-PGUXBMHVSA-N 277.364 2.300 10 10 CECE CC[C@](C)(OC)[C@@H](NN)c1ccc2c(c1)CCCN2C 2163102427 KNNNURGTHKXOML-HOTGVXAUSA-N 277.412 2.389 10 10 CECE C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2CCc1ccc(N)cc1 686177669 OTSGVQXQYCODES-RAEVTNRLSA-N 260.381 2.045 10 10 CECE CNCc1ccc(N2CC(O)(c3ccccc3)C2)cc1 2177790044 OTVKFNLKVYOZTG-UHFFFAOYSA-N 268.360 2.114 10 10 CECE Cc1ccc(O)c(CN2C[C@H](C)[C@@](C)(C(=O)O)C2)c1 710269930 XZNJIBPDJUMHIO-NHYWBVRUSA-N 263.337 2.243 10 10 CECE C[C@@H](N)Cc1ccc2ccn(Cc3csnn3)c2c1 381750025 RDUCYTUUYPCYSW-SNVBAGLBSA-N 272.377 2.431 10 10 CECE COC1(OC)CC[C@H]1CN[C@H](C)c1c(O)cccc1O 2173380621 AFKNHJGHNPDTEH-MNOVXSKESA-N 281.352 2.148 10 10 CECE COC[C@H](CCN[C@@H](C)c1ccc(N(C)C)cc1)OC 694362279 VQWBFQVFWCYXLX-BBRMVZONSA-N 280.412 2.455 10 10 CECE C[C@@H](N[C@@H]1CCN2CCC[C@H]1C2)c1ccc(O)cc1O 383566565 SXBUSXUBMWPOJS-TYNCELHUSA-N 276.380 2.233 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)CCCF)cc1 716785232 KXNISSHDWCGROR-CQSZACIVSA-N 253.365 2.044 10 10 CECE COC(=O)N1CCN([C@H](C)c2cc(Cl)ccc2O)CC1 387353830 SOMCQTMZDZQTQI-SNVBAGLBSA-N 298.770 2.491 10 10 CECE COc1ccc(O)c(CNCc2oc(C)nc2C)c1 389248218 CRRMXNWMLNYOQS-UHFFFAOYSA-N 262.309 2.295 10 10 CECE C[C@@H](NCc1ccc(N2CCOCC2)cc1)C(F)F 389952158 XSPDLHPHGWBCTJ-LLVKDONJSA-N 270.323 2.266 10 10 CECE CC[C@@H](C)[C@@H](COC(=O)Cc1ccc(N)cc1)OC 395098219 ZSUBEGDCUOEQFO-BXUZGUMPSA-N 265.353 2.416 10 10 CECE COc1cc(Cl)cc(CNCc2ccc(C)nn2)c1O 396597639 ZMYNTGMDTROQRA-UHFFFAOYSA-N 293.754 2.442 10 10 CECE CC[C@]1(C)CCN(CC(=O)c2ccc(O)c(O)c2)C1 399471396 VIGZKJVDYQFEJO-OAHLLOKOSA-N 263.337 2.403 10 10 CECE CC(=O)c1ccc(O)c(CN(C)Cc2cncnc2)c1 2178823701 RGVDRMWHHUTLQX-UHFFFAOYSA-N 271.320 2.017 10 10 CECE Cc1ncncc1CN1CCCc2cc(CN)ccc21 2178819956 OGDQHWLOBJSQJQ-UHFFFAOYSA-N 268.364 2.197 10 10 CECE CC(C)(F)[C@@](C)(F)C(=O)NCCOc1ccc(N)cc1 2168971642 NLQWFBYBYJQQIZ-AWEZNQCLSA-N 286.322 2.240 10 10 CECE CN(c1ccc(F)cc1)c1ncnc2c1CCNCC2 2169061498 MJPPSWUUIHZOGN-UHFFFAOYSA-N 272.327 2.072 10 10 CECE CNCc1ccc(N2CCCN(C3CC3)CC2)cc1C 2170077278 NVAZXCGWMINPNG-UHFFFAOYSA-N 273.424 2.389 10 10 CECE CC[C@H](NC)c1ccc(N2CC(n3cnnc3)C2)cc1 2170186429 DSFZWTKLMBYAFE-HNNXBMFYSA-N 271.368 2.010 10 10 CECE O=C1CCC2(CCN(Cc3cccc(Cl)c3O)CC2)N1 1231913146 FZUXFFDAATZXLX-UHFFFAOYSA-N 294.782 2.290 10 10 CECE NCc1ccc2c(c1)CCCN2C[C@@H]1C[C@@H]2C[C@H]2CO1 2179465358 NJSQXEPPHACETI-JYJNAYRXSA-N 272.392 2.323 10 10 CECE CN[C@H](C)c1ccc(N2CCc3ncn(C)c3C2)cc1 2170692781 UMVOLCDZHQPUOD-GFCCVEGCSA-N 270.380 2.263 10 10 CECE O=C(NC[C@@H]1[C@H]2CCC(F)(F)[C@H]21)c1ccc(O)c(O)c1 2170873062 GXPFFMFKLHFONP-KBVBSXBZSA-N 283.274 2.119 10 10 CECE C[C@H](C(=O)Nc1ccc(N)cc1)N1C[C@@H]2CC=CC[C@H]21 2177149636 MKSLQMHBPITBJD-TYNCELHUSA-N 271.364 2.246 10 10 CECE O=C1Nc2cc(N3CCC[C@H](C4CC4)C3)ccc2[C@H]1O 2171562609 STCGURNNJHBZIW-XHDPSFHLSA-N 272.348 2.299 10 10 CECE CC[C@H](CN(C)Cc1cc(CNC)ccc1OC)OC 2188449590 OVOZCKZYGZBHCJ-OAHLLOKOSA-N 280.412 2.271 10 10 CECE CN(CCOC(=O)CCc1ccc(N)cc1)C1CCC1 2193731314 XSVDQPHTIHAZNT-UHFFFAOYSA-N 276.380 2.229 10 10 CECE CC[C@@H](N)c1ccc(N2CCCC[C@@H]2CC(N)=O)cc1 2183265746 OCTXBWZDVSFGQA-HUUCEWRRSA-N 275.396 2.331 10 10 CECE O[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)[C@@H]2CC[C@@H]12 2190247067 OHWFYWVCZGBPAF-VQHPVUNQSA-N 273.376 2.406 10 10 CECE CCN1CCc2cc([C@H](N)[C@](C)(COC)OC)ccc21 2198207669 PBBJHHKCFGWGFC-HOTGVXAUSA-N 278.396 2.120 10 10 CECE C[C@@]12CN(c3ccc4c(c3)CCC[C@H]4O)C[C@]1(CO)C2 2184683564 BOFXYPAAXRFPAE-ZACQAIPSSA-N 273.376 2.265 10 10 CECE OC1[C@H]2CC[C@H]1CN(c1ccc3c(c1)CCC[C@@H]3O)C2 2184686460 HSVVZOQQGHXGBT-XEZPLFJOSA-N 273.376 2.263 10 10 CECE CO[C@@H]1[C@@H](N[C@@H](C)c2cc(F)ccc2O)COC1(C)C 2199467706 VKTUTIVPIMIFQT-DUFXMDAXSA-N 283.343 2.374 10 10 CECE N[C@H]1CCc2cc(N3C[C@@H]4CCC[C@]4(CO)C3)ccc21 2184735046 AZUUHWNJQHOJQM-RRQGHBQHSA-N 272.392 2.231 10 10 CECE CCN(CC1CN(C)C1)c1c(F)cc([C@H](C)O)cc1F 2194510418 ICHKPEDCLVYRLJ-JTQLQIEISA-N 284.350 2.406 10 10 CECE CN1CCCc2cc([C@@H](N)[C@@H]3CCNC3(C)C)ccc21 2198667777 OHXVRICWTFUKMQ-GOEBONIOSA-N 273.424 2.457 10 10 CECE CCCN[C@H](C)c1cc(F)c(N2CC(CO)C2)c(F)c1 2194704114 XZAZJGQFZYKOLX-SNVBAGLBSA-N 284.350 2.454 10 10 CECE COc1ccc(N2CC[C@H](C)[C@H](CN)C2)cc1F 2044283795 LIPQDFURZZUGES-WDEREUQCSA-N 252.333 2.255 10 10 CECE C[C@@H]1SCC[C@]1(O)[C@H](N)c1ccc(N(C)C)cc1 2044750771 SKGPGYZSQJTPJE-ZLKJLUDKSA-N 266.410 2.009 10 10 CECE CN(C(=O)Cn1ccnc1C(F)F)c1ccc(N)cc1 2185429746 LKNFEPKDEDOHNE-UHFFFAOYSA-N 280.278 2.066 10 10 CECE C[C@H](N[C@@H]1CO[C@@H](C(F)(F)F)C1)c1cc(O)ccc1O 2185551166 LUGYEQFODNBNRJ-YVZVNANGSA-N 291.269 2.468 10 10 CECE 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2.357 10 10 CECE NC(=O)c1cccc(N)c1N[C@H]1CCC=C1Br 2020062656 UAOXVCFRSIPURU-JTQLQIEISA-N 296.168 2.221 10 10 CECE Oc1c(Br)cccc1CN1CC[C@H]2COC[C@@H]21 2021428052 GQVGAHZXBKQYFI-JQWIXIFHSA-N 298.180 2.375 10 10 CECE Nc1ccc(-n2nccc2NC(=O)c2ccco2)cc1 61628784 IZNWAWVXDBZUON-UHFFFAOYSA-N 268.276 2.300 10 10 CECE Nc1ccc(CC(=O)N2CCCC[C@@H](F)C2)cc1 2034836030 OGPFTKRSHXYBDL-GFCCVEGCSA-N 250.317 2.162 10 10 CECE C[C@@H]1CN(C(=O)[C@@H]2CNc3ccccc3N2)CC[C@H]1C 300318679 JQKSDBFAUGCSSY-JMSVASOKSA-N 273.380 2.397 10 10 CECE CN(Cc1ccc(Cl)cc1O)C[C@@H]1CO[C@@H]2COC[C@H]21 2157986492 WMYBUFAKTJVHTB-OSAQELSMSA-N 297.782 2.139 10 10 CECE CN(C)c1ccc(CNCC2(O)CCSCC2)cc1 304278086 JTNFCNNMQQSQDG-UHFFFAOYSA-N 280.437 2.100 10 10 CECE CNCc1ccc(N2CCN(CCCF)CC2)c(F)c1 402672081 DDGIAKDJWNHRNP-UHFFFAOYSA-N 283.366 2.027 10 10 CECE COc1cccc(CN2CCCC[C@H]2CN(C)C)c1O 405207354 YTFNQLJMJPJOKO-AWEZNQCLSA-N 278.396 2.317 10 10 CECE OC[C@H]1CCC[C@H](CNCc2cccc(F)c2O)C1 312001647 RQNSLSGTBBBEIF-RYUDHWBXSA-N 267.344 2.420 10 10 CECE CP(C)(=O)[C@H]1CC[C@H](NC(=O)c2ccc(O)c(O)c2)C1 2160830078 MPZQMXAXWLMFCE-QWRGUYRKSA-N 297.291 2.371 10 10 CECE C[C@H](C(=O)NCCc1ccc(N)cc1)C(C)(F)F 328254133 LIKARAAMRQOCJZ-SECBINFHSA-N 256.296 2.219 10 10 CECE C[C@H](NC[C@@]12COC[C@H]1C2(F)F)c1cc(O)ccc1O 2161891904 PMUFNHKAGBDNGL-ZEGGKSINSA-N 285.290 2.030 10 10 CECE OCc1ccc(N2CCO[C@H]([C@@H]3CCOC3)C2)cc1Cl 2171691080 OPJCYLFJQVIZBG-DOMZBBRYSA-N 297.782 2.074 10 10 CECE Cc1cc(N2CC[S@@](=O)C[C@H]2C)ccc1C=CC(=O)O 2171961555 BPPSCUALHCXDJI-MPBGBICISA-N 293.388 2.050 10 10 CECE CCC[C@@H](CC(=O)NCCCN=[N+]=[N-])n1ccnc1 701270634 NJKGRLIPWQOOGG-NSHDSACASA-N 264.333 2.431 10 10 CECE CCO[C@H]1CCN(Cc2cc(CNC)ccc2OC)C1 701670029 VHAWSKDWWKZIDZ-HNNXBMFYSA-N 278.396 2.025 10 10 CECE COC(=O)c1ccc(CN(C)c2ccc(N)cc2)o1 702086829 JQBVUMMPQYTBAR-UHFFFAOYSA-N 260.293 2.285 10 10 CECE C[C@@H]1CNC[C@]1(C)C(=O)N(C)[C@H](C)c1ccccc1O 702386751 VAYCUOBSGDRFQA-HSMVNMDESA-N 276.380 2.157 10 10 CECE C[C@@H](OCC(C)(F)F)C(=O)Nc1ccc(N)cc1 703564931 KPSCMPIVNBBXHV-MRVPVSSYSA-N 258.268 2.268 10 10 CECE C[C@@H]1CNCCN(Cc2c(O)cccc2Br)C1 706861284 AODGYNKZHBZELQ-SNVBAGLBSA-N 299.212 2.196 10 10 CECE CCNCc1ccc(N2C[C@H]3CN(C)C[C@@H]3C2)c(Cl)c1 706998436 GKYUULPHPSUYPG-ZIAGYGMSSA-N 293.842 2.447 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2ncnn2C)c(Cl)c1 707664903 IERNGABVADOYOW-SECBINFHSA-N 279.775 2.125 10 10 CECE CN1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(Cc1ccc(N)cc1)C3 707826036 UZTDWVLIEPTDPF-HJWJTTGWSA-N 271.408 2.041 10 10 CECE CN1CCCc2cc(C3(O)C[C@H]4COC[C@@H]4C3)ccc21 2163104184 BZDBICXIWKFTJT-KBPBESRZSA-N 273.376 2.313 10 10 CECE CC(C)[C@H]1CN(Cc2cccc(F)c2O)CCO1 709021840 TVJRZWJXQRSRLM-CYBMUJFWSA-N 253.317 2.388 10 10 CECE COc1ccc(N(C)C[C@@H](N)C2(OC)CCCC2)cc1 2172614623 FVOSSEHFWXTTJC-OAHLLOKOSA-N 278.396 2.418 10 10 CECE CNCc1cc(F)c(N2CC[C@@H]3COC[C@@H]3C2)c(F)c1 690297934 HAZWNOWOMPDLPE-NEPJUHHUSA-N 282.334 2.157 10 10 CECE CC[C@@H]1CCNC[C@@H]1N(C)[C@H](C)c1cc(O)ccc1O 2163612604 JVTCWRNUCDBYGH-JMSVASOKSA-N 278.396 2.479 10 10 CECE CCc1cccc(CNCC(=O)OC(C)(C)C)c1O 691438320 OMUIHXUROUVKED-UHFFFAOYSA-N 265.353 2.386 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1CCCCCCN1 380308992 VZVIRKIGOVPJDN-CQSZACIVSA-N 276.380 2.273 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H](C)[C@@H]1CCCCO1 381649008 AODRIFCNSWYLBL-GWCFXTLKSA-N 278.352 2.425 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@H](N)[C@H]1C 381692936 FTFVEBCFYDNNMA-BREBYQMCSA-N 252.333 2.404 10 10 CECE CCCNCc1ccc(N2CC(C)(OC)C2)c(C#N)c1 382608750 WVTMCWKCGVAPMD-UHFFFAOYSA-N 273.380 2.283 10 10 CECE CCC1(N)CCN([C@@H](C)c2c(O)cccc2O)CC1 714751661 FWNNWIWVSDGOCQ-NSHDSACASA-N 264.369 2.362 10 10 CECE CCC1(N)CCN([C@H](C)c2cc(O)ccc2O)CC1 714752707 YIRJZLCRYJEZOM-LLVKDONJSA-N 264.369 2.362 10 10 CECE CN(c1ccc(CN)c(F)c1F)[C@@H]1CN(C)C(C)(C)C1 694141625 KVZUMQKILFBHPQ-NSHDSACASA-N 283.366 2.342 10 10 CECE Oc1ccc(Br)cc1CNC12CCN(CC1)C2 715654375 PQXLLNSSNZMXCG-UHFFFAOYSA-N 297.196 2.093 10 10 CECE CNCc1ccc(N2CC(O)(C(C)C)C2)c(Cl)c1 384143759 NRTVIIPCKWNTIO-UHFFFAOYSA-N 268.788 2.267 10 10 CECE CN=c1[nH]c(C(=O)N(C)[C@H](C)c2ccccc2O)cs1 384754951 OZJKBXVKURUFFP-SECBINFHSA-N 291.376 2.146 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc(OC)cc1[N+](=O)[O-] 385615734 GCALCCHRCLNUBM-CMPLNLGQSA-N 280.324 2.201 10 10 CECE N[C@H]1C[C@H]2C[C@H]1C[C@@]2(O)c1ccc(N2CCCC2)cc1 2164488610 ACSQWETTXUJHOD-JSQNDZKTSA-N 272.392 2.232 10 10 CECE COc1ccccc1C[C@H](O)Cc1ccc(N)cc1 696515528 PJEXFNNXYOXZHU-OAHLLOKOSA-N 257.333 2.424 10 10 CECE CC(=O)c1cc(Cl)cc(CN2CC[C@H](CO)[C@H]2C)c1O 386269053 LUVLVZNVGGNYBI-MWLCHTKSSA-N 297.782 2.451 10 10 CECE CN[C@H](C)c1ccc(N2CCSC[C@@H]2CO)c(F)c1 388032572 HLBZORDGPOBWDS-PWSUYJOCSA-N 284.400 2.020 10 10 CECE CCCN1CC[C@@H](N[C@H](C)c2ccc(O)cc2O)C1 389176285 PCTOXRQDGLSKFR-VXGBXAGGSA-N 264.369 2.233 10 10 CECE Cc1ccc(CNCc2ccc3c(c2)CCN3C)nn1 396528448 GCUCJQOYOWVLEG-UHFFFAOYSA-N 268.364 2.067 10 10 CECE C[C@H]1CCC(=CC(=O)NCc2ccc(O)cc2O)C1 2059296651 QKTDIMFIOUAXFT-JTQLQIEISA-N 261.321 2.460 10 10 CECE NCc1cc(F)c(N2C[C@H]3C[C@@H](O)CC[C@H]3C2)c(F)c1 398684963 ANBZXHNJBMUECB-TUAOUCFPSA-N 282.334 2.021 10 10 CECE CO[C@@H](C)CCC(=O)[C@@H](O)c1ccc2c(c1)CCN2C 2165529298 FMAYWINMTMUMSY-ZBEGNZNMSA-N 277.364 2.097 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)[C@@H]1CC[C@@H]2C[C@H]2C1 2165964896 QZQYVGNOJIGZPU-JNIYBQFBSA-N 271.364 2.263 10 10 CECE O=C(C[C@@H](O)C1CC1)NCc1c(O)ccc2c1CCCC2 2064761112 FLLXOHSEAYFQCG-MRXNPFEDSA-N 289.375 2.048 10 10 CECE CC(C)Cn1ncnc1COCCc1ccc(N)cc1 2176291193 YDABOZMKSRZGOD-UHFFFAOYSA-N 274.368 2.276 10 10 CECE CCN(C)C[C@@H]1CCN(c2ccc(CNC)cc2C)C1 2170239231 YKKZCSNLJXYBOQ-INIZCTEOSA-N 275.440 2.492 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)C1CC(C2CC2)C1 2176797777 SPNKKDFMDDNPFY-QHAMSDLMSA-N 271.364 2.263 10 10 CECE CC(C)[C@H]1NCC[C@]1(O)c1ccc(N2CCCC2)cc1 2188251469 GTSGZLZNXWYPHW-SJORKVTESA-N 274.408 2.492 10 10 CECE CO[C@H]1C[C@H](C(=O)CCc2ccc(N)cc2)C[C@H]1OC 2196606500 UUCZTVJCWHUDCF-DVSIDAKKSA-N 277.364 2.211 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CCC(=O)N(C)C2)c(Cl)c1 2188481735 ATBYNJBWDUZDHI-JQWIXIFHSA-N 295.814 2.417 10 10 CECE CN[C@H](C)c1ccc(N(C)[C@H]2CCC(=O)N(C)C2)cc1 2188486305 POUICWYVFLYNMY-DOMZBBRYSA-N 275.396 2.024 10 10 CECE CN[C@@H](C)c1ccc(N(C)[C@@H]2CCC(=O)N(C)C2)cc1 2188486307 POUICWYVFLYNMY-SWLSCSKDSA-N 275.396 2.024 10 10 CECE O=C(O)C=Cc1ccc(N2CC[C@H](F)C2)cc1[N+](=O)[O-] 2188574436 AOZOEEIIENCROS-JTQLQIEISA-N 280.255 2.241 10 10 CECE O=C(c1cc(O)c(O)c(O)c1)N1CCC[C@@H](C2CC2)C1 2188927555 FWOASKYLABPDPQ-SNVBAGLBSA-N 277.320 2.066 10 10 CECE CC1(C)CC[C@@H](C(=O)O)CN1Cc1ccc(O)cc1O 2193509401 DZDSLZUWNDSEIQ-LLVKDONJSA-N 279.336 2.173 10 10 CECE COc1ccc(O)c(CN2CC[C@H]3CCC[C@]32CN)c1 2197339925 KXUYXFIVYMHSIO-CJNGLKHVSA-N 276.380 2.104 10 10 CECE COc1cccc(CNCC23CC(C)(CCO2)C3)c1O 2193683141 KAGQEOXFFVDMPW-UHFFFAOYSA-N 277.364 2.450 10 10 CECE CCN(CC)c1ccc([C@@H](CS(=O)(=O)CC)NC)cc1 2189449426 BTBKEHSYWSHUIT-OAHLLOKOSA-N 298.452 2.228 10 10 CECE CN1CC[C@@](C)(CNCc2ccc3c(c2)CCCO3)C1 2193727778 XYICGAXTEHRRRE-KRWDZBQOSA-N 274.408 2.443 10 10 CECE OC[C@H]1CCN(c2ccc(CNC3CC3)cc2)C12CC2 2190361005 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Cc1cnn(C)c1CN(C)c1ccc2c(c1)CC[C@H]2O 2184734692 WVXOGLBHUYPGRK-MRXNPFEDSA-N 271.364 2.345 10 10 CECE CN(C)c1ccc([C@H](C[C@]23CCOC[C@H]2C3)NN)cc1 2194537875 JYOVVTWWJAZWJJ-VNQPRFMTSA-N 275.396 2.074 10 10 CECE C[C@H](O)c1cc(F)c(N(C)[C@H]2CN3CC[C@H]2C3)c(F)c1 2194516699 JJLVTPAWSGZYKC-BHDSKKPTSA-N 282.334 2.158 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ccc(Cl)nn2)CC1 2099328254 AMOHJNWOZONCKJ-QMMMGPOBSA-N 280.719 2.435 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(C(=O)CN2CCCCC2)CC1 2099337335 UOCHUOJOHRIEEH-LBPRGKRZSA-N 265.361 2.164 10 10 CECE C[C@H]1CC[C@H](CCNCc2ccc(O)c(O)c2)O1 2042904045 LQGLYEUNWOKIOA-CMPLNLGQSA-N 251.326 2.145 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)C(F)(F)[C@H]2CCOC2)C1 2185231857 WSCCXWWMJZBTRF-UWVGGRQHSA-N 288.298 2.207 10 10 CECE COc1ccc(N2CCN[C@@H](C)C[C@H]2C)cc1F 2045961477 KUOKIMUKHBKXLZ-WDEREUQCSA-N 252.333 2.411 10 10 CECE COc1cc2c(cc1OC)N1CCCC[C@]1(C)C(=O)N2 2198729115 TUTASSBWPGKGJX-OAHLLOKOSA-N 276.336 2.405 10 10 CECE CNCc1ccc(N2CC[S@@](=O)[C@@H](C)C2)cc1Cl 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2.478 10 10 CECE COc1ncccc1NC(=O)CCc1ccc(N)cc1 158118454 REBKQQKCSXSNIX-UHFFFAOYSA-N 271.320 2.244 10 10 CECE COC(=O)[C@](C)(Cc1ccccc1F)NCCN=[N+]=[N-] 158529121 JEGUVODAEICXLW-ZDUSSCGKSA-N 280.303 2.200 10 10 CECE OC[C@@]12C[C@H]1CN(c1ccc(CNC3CC3)cc1Cl)C2 2146307442 ZXBKEMOMIHHBIY-LRDDRELGSA-N 292.810 2.411 10 10 CECE CO[C@@H]1CN(c2ccc(CN)c(C(F)(F)F)c2)C[C@H]1F 2146478307 KFNOWXFLNVTCBZ-VXGBXAGGSA-N 292.276 2.337 10 10 CECE COc1ccc(CNCc2ccnc(C)n2)cc1C 37997859 JRZNLSBOAHUQTA-UHFFFAOYSA-N 257.337 2.392 10 10 CECE CCCN[C@H](c1ccccc1O)c1cnnn1C1CC1 2153882397 FMSWGQARJRQHLT-OAHLLOKOSA-N 272.352 2.408 10 10 CECE CCOCCOc1ccc(N2CCC(N)CC2)cc1 43470886 SVJJSHCBBQHUMA-UHFFFAOYSA-N 264.369 2.029 10 10 CECE Nc1ccc(N2C(=O)Cc3ccccc3C2=O)c(F)c1 43474096 USKNUERFXUWNNV-UHFFFAOYSA-N 270.263 2.137 10 10 CECE COc1cc([C@@H](N)c2ccccc2O)cc2c1OCO2 2154717651 OGBOUJHCSOYPPY-CQSZACIVSA-N 273.288 2.178 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2O)[C@H]1CCC12CCC2 2154894093 BQRGPXRXDQWJNY-KBPBESRZSA-N 272.348 2.441 10 10 CECE CCNC(=O)COc1ccc(CNCC(C)C)cc1C 2155012223 FXKFXKUVFHCKQD-UHFFFAOYSA-N 278.396 2.256 10 10 CECE C[C@@]12CCCN(c3ccc(CN)c(F)c3F)[C@@H]1COC2 2159846693 WIAAWBZJJWCCFN-DOMZBBRYSA-N 282.334 2.429 10 10 CECE C[C@@H]1C[C@H](N)CCN1c1ccc2c(c1)OC(F)(F)O2 49707982 MTOOQULNIOYVAW-RKDXNWHRSA-N 270.279 2.324 10 10 CECE COc1ccc(CNC(C)C)cc1CN1CCCC1=O 50125441 OCBBBGSQLBIQJH-UHFFFAOYSA-N 276.380 2.316 10 10 CECE CC(C)CN(CCN)[C@H](C)c1cc(O)ccc1O 2030265715 KSBXHPLEJGTTBK-LLVKDONJSA-N 252.358 2.076 10 10 CECE Cc1cc(OC[C@@H]2CCO2)ccc1N1CCC(N)CC1 2161329480 DJQKHBKHBSBIRW-HNNXBMFYSA-N 276.380 2.090 10 10 CECE COc1cc(Cl)cc(CN(CC2CC2)C2CNC2)c1O 2160201362 MBCBBWWFUSCPFC-UHFFFAOYSA-N 296.798 2.238 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)NC(=O)[C@@H]3N)[C@H](C)C1 60392704 SEKARZHGRHYRKT-GPCCPHFNSA-N 259.353 2.263 10 10 CECE CO[C@H](CNc1ccc(N)cc1)[C@H]1CCCOC1 2032831366 WFNZSIUNDINQGZ-SMDDNHRTSA-N 250.342 2.122 10 10 CECE Nc1ccc(NC(=O)[C@H]2COc3ccccc3C2)cc1 70158399 GKBSRMBFGAKDPO-GFCCVEGCSA-N 268.316 2.459 10 10 CECE C[C@@H]1NC[C@H](C)N([C@H](C)c2cc(O)ccc2O)[C@H]1C 401375911 JKSBWQGRPVZZAZ-FIQHERPVSA-N 264.369 2.230 10 10 CECE C[C@@H]1C[C@@H](O)CN(c2ccc(CNC3CC3)cc2F)C1 401747359 MEEBQOOTKOYSPJ-BXUZGUMPSA-N 278.371 2.285 10 10 CECE CNCc1ccc(N2CCN(CCF)CC2)cc1Cl 402679774 WOSGZRGYKRZIDN-UHFFFAOYSA-N 285.794 2.151 10 10 CECE Nc1ccc(CC(=O)N[C@H]2CCCOC23CCC3)cc1 2158559893 ICUXSGUNRMIXRX-AWEZNQCLSA-N 274.364 2.029 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1c(O)cccc1F 2160773309 YOMDNWNWOAULDR-NSHDSACASA-N 282.275 2.035 10 10 CECE C[C@H](N)c1ccc(N2CC[S@](=O)C(C)(C)CC2)cc1 322177108 OIMSLYZXJKTTMZ-BUXKBTBVSA-N 280.437 2.444 10 10 CECE C[C@H]1N(c2cc3c(cc2F)[C@H](O)C(=O)N3)CCC1(F)F 2172052195 ZLGROMNUHDSZMW-KBUNVGBDSA-N 286.253 2.045 10 10 CECE CNCc1ccc(N2CC[C@@H](CCO)[C@H](C)C2)c(F)c1 2172458246 BFCASODDWUAUAH-OCCSQVGLSA-N 280.387 2.390 10 10 CECE COc1cccc(CNC[C@H]2CCC[C@@H](C)O2)c1O 701567178 HNGBHNYMFBPJRZ-DGCLKSJQSA-N 265.353 2.448 10 10 CECE C[C@@H]1CCCCN(c2ccc3c(c2)N(C)C(=O)[C@@H]3N)C1 703282943 LGNYJWKSFAKMBL-IAQYHMDHSA-N 273.380 2.289 10 10 CECE C[C@@H](NC1CCC(C)(O)CC1)c1cc(O)ccc1O 703550560 UCJDRIGAFYUMIX-RWWNRMGGSA-N 265.353 2.442 10 10 CECE COC[C@H](C)[C@H](NN)c1ccc(N2CCCCC2)cc1 2163142864 IQEPOUGGIUWZHC-BBRMVZONSA-N 277.412 2.464 10 10 CECE CCOC[C@H]1CN([C@@H](C)c2ccccc2O)CCO1 705848304 KKBYDPPXCQDTKB-QWHCGFSZSA-N 265.353 2.191 10 10 CECE C[C@H]1N(c2cc3c(cc2N)OCCO3)CCOC1(C)C 707290573 IOWXMQCXSCXCND-SNVBAGLBSA-N 278.352 2.044 10 10 CECE Oc1c(F)cc(F)cc1CN(C[C@H]1CCCN1)C1CC1 708495348 VSAFUWMOAHGXBY-GFCCVEGCSA-N 282.334 2.387 10 10 CECE C[C@H](N)c1ccc(N2[C@H]3CC[C@H]2CN(C)C3)c(F)c1 687241379 MJUZZOVVKKKUKT-DRZSPHRISA-N 263.360 2.128 10 10 CECE CO[C@@H](C)CN(CCOc1ccc(N)cc1)C(C)C 688127806 GMVVYLQXJAHTBL-ZDUSSCGKSA-N 266.385 2.393 10 10 CECE CC[C@@H]1COC[C@@H]1N(C)Cc1cccc(OC)c1O 688192697 LSSCIBTVPHUKOQ-YPMHNXCESA-N 265.353 2.258 10 10 CECE C[C@@H]1COC[C@@H]1N(C)CCCOc1ccc(N)cc1 688187099 MTIJMTFKSWBXCG-DOMZBBRYSA-N 264.369 2.004 10 10 CECE C[C@@H]1CC[C@@H](CO)CN1c1ccc(CN)c(F)c1F 688682502 PZDFOYDTYNMAGG-NXEZZACHSA-N 270.323 2.021 10 10 CECE CCOc1cccc(CN2CCN[C@@H](C)C[C@H]2C)c1O 2164466854 NJCLQWUPRHEBJH-QWHCGFSZSA-N 278.396 2.363 10 10 CECE CN(c1ccc(CN)c(F)c1)C1(CO)CC2(CCC2)C1 2164570727 PAWXLZFRMZRHDY-UHFFFAOYSA-N 278.371 2.416 10 10 CECE C[C@@H](CN(C)S(=O)(=O)Cc1ccc(N)cc1)C1CCC1 692176824 YRTDPARWVQSSIT-LBPRGKRZSA-N 296.436 2.467 10 10 CECE C[C@H](CN(C)S(=O)(=O)Cc1ccc(N)cc1)C1CCC1 692176817 YRTDPARWVQSSIT-GFCCVEGCSA-N 296.436 2.467 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H]1CCC[C@H](CN)C1 713837084 LOFAKEBLPIRNLM-STQMWFEESA-N 276.380 2.116 10 10 CECE Cc1cc(CNC(C)C)ccc1N1CC(N(C)C)C1 382341347 KSNWGNHYAFLEHF-UHFFFAOYSA-N 261.413 2.243 10 10 CECE Oc1cc2c(cc1CNC1CC(C3CC3)C1)OCO2 714735271 JZZOFTWFSUOCDR-UHFFFAOYSA-N 261.321 2.399 10 10 CECE C[C@H](NC[C@H]1C[C@@H]1C(=O)O)c1ccc(N(C)C)cc1 715293881 NANMZDDLEAXUNZ-SUHUHFCYSA-N 262.353 2.124 10 10 CECE COCCN(c1ccc(CN)cc1C)C1CCOCC1 716361813 JADLBJGWYLBJJN-UHFFFAOYSA-N 278.396 2.086 10 10 CECE CN1CC[C@@](C)(NCc2cccc(Br)c2O)C1 716596662 GHHSVJDJSJOMBH-CYBMUJFWSA-N 299.212 2.339 10 10 CECE CN1CCCc2cc(CNCC[C@H](O)C(F)F)ccc21 717363192 NJUDCQBUHIRMTO-AWEZNQCLSA-N 284.350 2.175 10 10 CECE CN(C)c1ccc([C@@H](CN)N(C)Cc2nccs2)cc1 387276280 JFMBBHPDWGJWNT-CQSZACIVSA-N 290.436 2.341 10 10 CECE OCC1CCC(F)(CNCc2ccc(O)cc2O)CC1 2178637792 LZYFXUBVIFBJAF-UHFFFAOYSA-N 283.343 2.078 10 10 CECE C[C@H]1CCN(c2ccc([C@H](C)N)c(O)c2)CCO1 720444537 QSWOFKQXKRFDFU-QWRGUYRKSA-N 250.342 2.027 10 10 CECE C[C@@H]1C[C@@H](N(C)c2c(F)cc(CO)cc2F)CCO1 721486379 UIBNMKZQQAEXDU-KOLCDFICSA-N 271.307 2.461 10 10 CECE CCNCc1cc(F)c(N2C[C@@H](O)[C@@H](CC)C2)c(F)c1 399841477 CEBIOMWTRRNBAR-SMDDNHRTSA-N 284.350 2.281 10 10 CECE CC(C)(C(=O)Nc1ccc(O)c(O)c1)C1CCOCC1 2062772108 RJQGONLNFVJGAF-UHFFFAOYSA-N 279.336 2.489 10 10 CECE CCO[C@@H]1CC[C@H](C(=O)NCCc2ccc(N)cc2)C1 2174914885 GJDNFSJCYUKATK-DZGCQCFKSA-N 276.380 2.133 10 10 CECE COc1cccc(Cn2nc(C3CC3)cc2C(=O)O)c1O 2070011720 SAPPFFWQNIKIIA-UHFFFAOYSA-N 288.303 2.221 10 10 CECE Cc1cc(CN)n(Cc2ccc(Cl)cc2O)n1 2070036086 RYRXMDDAEPVGTB-UHFFFAOYSA-N 251.717 2.058 10 10 CECE COc1cccc(O)c1[C@H](C)n1cc(C(=O)O)c(C)n1 2070221815 BVLSZYLIWPJZLR-VIFPVBQESA-N 276.292 2.213 10 10 CECE C[C@H](C(=O)NCc1ccco1)N1CCC[C@@H]1CN=[N+]=[N-] 2179610722 AERAVGYHIZFHSA-GHMZBOCLSA-N 277.328 2.059 10 10 CECE Nc1ccc(OCCN2CC[C@@H](O)CC23CCC3)cc1 2169883604 NDHOOSDTFPDPCL-CQSZACIVSA-N 276.380 2.027 10 10 CECE CCN(Cc1cnn(C)c1)c1ccc([C@@H](C)O)c(O)c1 2169973016 XLCHHSNDWYGBSR-LLVKDONJSA-N 275.352 2.206 10 10 CECE CC[C@H](N)c1ccc(N2CCNC(=O)[C@@H]2C(C)C)cc1 2170032341 BZTIPKYNSOLPFP-GJZGRUSLSA-N 275.396 2.057 10 10 CECE Oc1ccc(CNCc2noc3c2CCCC3)c(O)c1 2176722664 WCJYXXGDCWVCRB-UHFFFAOYSA-N 274.320 2.254 10 10 CECE CNCc1ccc(N2CCC23CCN(C)CC3)cc1C 2170460838 BSOFNZRNLDAAKF-UHFFFAOYSA-N 273.424 2.389 10 10 CECE Oc1c(Cl)cccc1CN1C[C@@H]2CCO[C@@H]2C1 1231912497 JBBKTAPRPOFOQU-JOYOIKCWSA-N 253.729 2.266 10 10 CECE CCS(=O)(=O)[C@H]1CCN([C@H](C)c2ccc(C)cc2O)C1 2179906296 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[N-]=[N+]=NCCCN[C@@]1(C(=O)O)[C@H]2CC[C@H]3[C@@H](C2)C[C@H]31 1893493185 MHVRMMFMAAQLIE-OBBGECFZSA-N 264.329 2.166 10 10 CECE CCOc1cccc(CNC[C@H](C(C)C)N(C)C)c1O 20145638 OURAIQRRENLITE-CQSZACIVSA-N 280.412 2.467 10 10 CECE C[C@@H]1COC[C@H]1C(=O)N(C)[C@H](C)c1ccccc1O 705293026 NVJDOOOOHOPTJN-NQBHXWOUSA-N 263.337 2.194 10 10 CECE Oc1cccc2c1[C@H](N1CC[C@H]3COC[C@@H]3C1)CC2 690792833 YFLPHRWRDLIARF-MELADBBJSA-N 259.349 2.348 10 10 CECE O=C(N[C@@H]1C[C@@H]2CCCC[C@@H]21)c1cccc(O)c1O 712571685 KNHPOPNKWJWCHU-JBLDHEPKSA-N 261.321 2.406 10 10 CECE CC1CC(CN(C)c2ccc3c(c2)N(C)C(=O)[C@@H]3O)C1 691930211 VZEVDMOGPOZFGB-QKFMDRJYSA-N 274.364 2.179 10 10 CECE Oc1c(CN[C@@H]2CCCCC23OCCO3)ccc(F)c1F 715692995 FSIUFFLRDXHHKY-GFCCVEGCSA-N 299.317 2.446 10 10 CECE CC(C)N(Cc1ccc(N)cc1)C[C@@H]1CCCS1(=O)=O 694471580 ZKNLHXPALISMQA-HNNXBMFYSA-N 296.436 2.056 10 10 CECE CCNCc1ccc(N2CCS[C@@H](CO)C2)c(C)c1 719987409 CPQDYWWRROYCPY-CQSZACIVSA-N 280.437 2.019 10 10 CECE O=C(c1cccc(O)c1O)N1CCCC[C@@H]1[C@@H]1CCCO1 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Nc1ccc(NC(=O)c2cc(O)c3cccc(O)c3n2)cc1 1866483304 OPWOXXHVNFPBSE-UHFFFAOYSA-N 295.298 2.481 10 10 CECE CC[C@H](CN)CN(C)c1cc(F)c(OC)cc1F 259144156 ZXDODVHFRBAENT-SECBINFHSA-N 258.312 2.395 10 10 CECE CCCCN(C)[C@H](CN)c1cccc(OC)c1O 32022492 NBEXYSJJFCVCLE-GFCCVEGCSA-N 252.358 2.133 10 10 CECE CCN(c1ccc(CO)c([N+](=O)[O-])c1)[C@H]1CCSC1 2132058573 QNBZCJKYHBXIAX-LBPRGKRZSA-N 282.365 2.419 10 10 CECE CCN1CCC(CNCc2c(O)cccc2F)CC1 1207623576 VEERCZKPOYOMBV-UHFFFAOYSA-N 266.360 2.353 10 10 CECE CN1CCC[C@@H](CCNCc2cccc(F)c2O)C1 839179865 ALXMHUOYWKWHBH-LBPRGKRZSA-N 266.360 2.353 10 10 CECE Nc1ccc(Oc2cc3c(cc2N)CC(=O)N3)cc1 1904309205 PADXHOQZFHWNCB-UHFFFAOYSA-N 255.277 2.138 10 10 CECE CCCC(=O)Nc1ccc(O)c([C@H](C)NN(C)C)c1 213704459 PRZLBZKHOPHOLL-JTQLQIEISA-N 265.357 2.258 10 10 CECE Cc1ccc([C@H](C)N[C@H](C)[C@@H]2COCCO2)c(O)c1 1967584857 LGWPJFJLNWCZPY-ZOWXZIJZSA-N 265.353 2.155 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H](C)CN1 1921499239 QQPGHDMJENBKJN-MNOVXSKESA-N 268.788 2.475 10 10 CECE Oc1ccccc1CNC[C@@H]1CCC(F)(F)CO1 1967824095 FDWSMKGAIQGHOX-NSHDSACASA-N 257.280 2.296 10 10 CECE CN(CCCc1ccc(N)cc1)C1(CCO)CCC1 2140963437 VUYLEQZFULXCQB-UHFFFAOYSA-N 262.397 2.438 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@H](N)CC1CCCC1 1926593922 QGDDVLFMQCYJJK-CQSZACIVSA-N 276.380 2.258 10 10 CECE COC[C@]1(C)CCN(c2ccc(CO)c(OC)c2)C1 2139685100 CUKRWOZBUADCGE-OAHLLOKOSA-N 265.353 2.050 10 10 CECE COC(=O)c1ccc(OCc2ccc(N)cc2)nc1C 147662894 BELIHQNUEXCDRP-UHFFFAOYSA-N 272.304 2.338 10 10 CECE Nc1ccc(CNC(=O)C2CC(C(F)(F)F)C2)cc1 1968569578 BAUQDGUAMQCNIF-UHFFFAOYSA-N 272.270 2.474 10 10 CECE CN(C)C(=O)CN(Cc1ccccc1)c1ccc(CO)cc1 1932045017 KLJGUEPRVYBBBG-UHFFFAOYSA-N 298.386 2.274 10 10 CECE CN(C)c1ccc(CN[C@@H]2C[C@H]3CCCCN3C2)cc1 1969661045 LQZMHJBLVAJHDZ-NVXWUHKLSA-N 273.424 2.469 10 10 CECE CC[C@H]1CN(C)CCCN1CCc1ccc(N)cc1 234080655 SGZNGWAVIAEOCZ-INIZCTEOSA-N 261.413 2.227 10 10 CECE Nc1ccc(CC[C@H]2CCCCS2(=O)=O)cc1 1944061682 JNHITSOHHZJWDC-CYBMUJFWSA-N 253.367 2.169 10 10 CECE CCOCCCCNCc1cccc(OC)c1O 236843265 QEWDMBOLHQCRDJ-UHFFFAOYSA-N 253.342 2.307 10 10 CECE COC[C@@H]1CC[C@@H]1N(C)c1ccc(CO)c(OC)c1 2142423289 PFJQPCSXSRUXFH-JSGCOSHPSA-N 265.353 2.049 10 10 CECE Cc1cc(Sc2ncc(C[C@H](C)N)s2)n(C)n1 1949612719 VYENAMTWJCVRIF-ZETCQYMHSA-N 268.411 2.226 10 10 CECE CC(C)(C)OC(=O)N1CC[C@@H](N)[C@@H]1c1cc(O)ccc1O 1952309463 WCNZTTHWQQPRQE-YPMHNXCESA-N 294.351 2.107 10 10 CECE CCOC(=O)[C@@H](N)C1(c2cccc3c2ccn3C)CC1 1952551213 DLCABHQDEQMQDF-CQSZACIVSA-N 272.348 2.100 10 10 CECE C[C@@H]1CSCCCN1c1cc2c(cc1F)[C@H](O)C(=O)N2 2143613892 IAVUZUWLFSMFQM-OQPBUACISA-N 296.367 2.143 10 10 CECE CN[C@H](C)c1ccc(N2CCC(C)(O)CC2)c(F)c1 168539928 CUIGFHQEAHWTPU-LLVKDONJSA-N 266.360 2.457 10 10 CECE Oc1ccc(CCNc2nccnc2C2CC2)cc1O 2148020010 MUMHPPVWYIALKI-UHFFFAOYSA-N 271.320 2.420 10 10 CECE CCCN[C@H](c1ccccc1O)[C@H](O)c1ncc(C)[nH]1 2148161106 FINVBQJKZOIVSV-KGLIPLIRSA-N 275.352 2.198 10 10 CECE CCOC(=O)c1cc([C@H]2CCCCN2)c(O)cc1O 260326271 VXHMIEOPFWIDAT-LLVKDONJSA-N 265.309 2.089 10 10 CECE CC[C@H]1CCCN(C[C@H](O)COc2ccc(N)cc2)C1 36168651 GGZYIVOEEGXKJE-ZFWWWQNUSA-N 278.396 2.131 10 10 CECE CC[C@@H](NC)c1ccc(N2CCCNC(=O)CC2)cc1 2145347417 WKOQNOUPYHRXTR-OAHLLOKOSA-N 275.396 2.074 10 10 CECE CC[C@@H](O)c1ccc(N(C)C[C@H]2CCS(=O)(=O)C2)cc1 2148780360 YDLCOOLTWJEZHD-IUODEOHRSA-N 297.420 2.001 10 10 CECE C[C@H](c1ccccc1O)N(C)S(=O)(=O)c1ccn(C)c1 2145852300 WLABPKKLXOCNPD-LLVKDONJSA-N 294.376 2.112 10 10 CECE Cc1cc(Cn2ccc3c(CCN)cccc32)ncn1 2145807662 XXGMPJOFTXAAAW-UHFFFAOYSA-N 266.348 2.289 10 10 CECE Cc1ccccc1N[C@H](C(N)=O)c1ccc(O)c(O)c1 37942041 KYZJRPNRDACRBV-AWEZNQCLSA-N 272.304 2.045 10 10 CECE Oc1cccc(F)c1CN[C@H]1CCCC2(C1)OCCO2 1997951852 YXKBDLOACQDBCW-NSHDSACASA-N 281.327 2.307 10 10 CECE COc1ccc(N2CCC3(CCC3)[C@@H](CO)C2)c(N)c1 2151659484 KSDJEXJJZUWTID-GFCCVEGCSA-N 276.380 2.266 10 10 CECE COCC1(O)CCN(c2ccc([C@@H](C)N)c(Cl)c2)CC1 2151883986 WCBAFJWJRVLWLS-LLVKDONJSA-N 298.814 2.337 10 10 CECE Nc1ccc(-n2ccc(C(=O)OCC(F)(F)F)n2)cc1 41102173 LWPGSBAPKFXHJI-UHFFFAOYSA-N 285.225 2.174 10 10 CECE CCCc1noc(CN(C)c2ccc(CO)c(C)c2)n1 2160394657 JIULUQPUWBFEBJ-UHFFFAOYSA-N 275.352 2.459 10 10 CECE C[C@H](N)c1ccc(N2CCC23COC3)cc1Br 2004421344 YPZHJPIUWZFNMI-VIFPVBQESA-N 297.196 2.448 10 10 CECE Cc1nc(Sc2ncc(CN)s2)n2c1CCC2 2007878722 TVFDZVOLOIRLSM-UHFFFAOYSA-N 266.395 2.204 10 10 CECE CCN(C)[C@H]1CCN(c2ccc([C@@H](C)NC)c(O)c2)C1 2154002249 CASNLCIPWGXGBD-OCCSQVGLSA-N 277.412 2.203 10 10 CECE CC1(C[C@@](N)(CSc2nccs2)C(=O)O)CC1 2026537783 ITBCLBFQWNGRCU-LLVKDONJSA-N 272.395 2.208 10 10 CECE CCn1nncc1CN(C)c1ccc([C@@H](C)O)cc1F 2156484669 XPUDHGHWMLJJOG-SNVBAGLBSA-N 278.331 2.127 10 10 CECE CN[C@H](C)c1ccc(N(C)Cc2noc(C)n2)cc1O 2160430895 KBPJMOUCEKSHJP-SECBINFHSA-N 276.340 2.000 10 10 CECE C[C@H](c1ccc(F)cc1O)N(CCN)CC1CC1 2030267625 CTFGFPXFLURIOG-SNVBAGLBSA-N 252.333 2.263 10 10 CECE CN[C@H](c1ccccc1O)[C@@H](O)[C@@H]1CCCSC1 2031153323 JOERIPPQAJTCRR-HONMWMINSA-N 267.394 2.157 10 10 CECE COc1ccc(CNCc2ccc(C)nc2)c(O)c1 60942080 JPCUKMUJKOQJFN-UHFFFAOYSA-N 258.321 2.394 10 10 CECE Cc1nscc1CN(C)Cc1cc(N)ccc1O 2032899705 NOLGTMAOVZCVIW-UHFFFAOYSA-N 263.366 2.371 10 10 CECE CC(C)(NCc1ccc(O)c(O)c1)[C@@H]1CCCO1 2033144892 OVDPYRIPTHCZIS-ZDUSSCGKSA-N 251.326 2.145 10 10 CECE C[C@@H]1CN(CCN2CCC(N=[N+]=[N-])CC2)C[C@@H]1C 2038476129 BNMADOGUYCRPJO-TXEJJXNPSA-N 251.378 2.349 10 10 CECE C[C@@H](N)c1ccc(N2C[C@@H](CO)C[C@H]2C)c(F)c1 2038899145 ZSPJJTDEQIQOEK-MXWKQRLJSA-N 252.333 2.053 10 10 CECE C[C@H](N[C@@H]1CO[C@@H](C)[C@@H]1C)c1cc(O)ccc1O 405785325 URSMENZSPSRTJU-AVWBDOJWSA-N 251.326 2.172 10 10 CECE CCCN[C@@H](C)c1ccc(N2CC(OC)C2)cc1O 311393601 BGVLCBMXKZHSDL-NSHDSACASA-N 264.369 2.288 10 10 CECE Oc1ccc(CNCCOCC2CCCC2)c(O)c1 313254148 OKOTVMDZTDPELG-UHFFFAOYSA-N 265.353 2.394 10 10 CECE COc1ccc(CNC[C@]23COC[C@H]2C3(F)F)cc1C 2161886484 JKRMNHNQVOOZOV-KGLIPLIRSA-N 283.318 2.375 10 10 CECE CCCN[C@H](C)c1ccc(N2CCC(O)CC2)cc1O 93670166 UVGOWMDEICYLAR-GFCCVEGCSA-N 278.396 2.414 10 10 CECE CN(CCCOc1ccc(N)cc1)OCC(F)(F)F 704810222 PSCKZPRQXJQJRG-UHFFFAOYSA-N 278.274 2.463 10 10 CECE C[C@@H]1C[C@@H](O)CCN1c1ccc(CN)cc1Br 705571433 KQBDLCNUKNPHST-KOLCDFICSA-N 299.212 2.257 10 10 CECE COc1ccc(N(C)[C@@](C)(CN)C[C@@H]2CCCO2)cc1 689797986 YCFJZQFYYPOUAX-JKSUJKDBSA-N 278.396 2.418 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@@H]1CCCC12CC2 707121297 SNZGJMRGALEPFE-CQSZACIVSA-N 273.380 2.472 10 10 CECE CCC[C@@H]1COC[C@@H]1N(C)Cc1cc(N)ccc1O 688249008 CYWFQXGMPGVGFV-RISCZKNCSA-N 264.369 2.221 10 10 CECE C[C@@H]1C[C@@H]2CN(c3ccc([C@@H](C)O)cc3F)CCN2C1 2181178898 WMMSIBQEBTUUKB-YRGRVCCFSA-N 278.371 2.409 10 10 CECE COc1ccc([C@H](C)NC[C@@]23COC[C@@H]2C3)c(O)c1 689213152 ISIRYCGVWADCKX-PGUXBMHVSA-N 263.337 2.088 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@H]2CCCS2(=O)=O)cc1 2163100769 UZYZJILFHPBLRA-HUUCEWRRSA-N 297.420 2.143 10 10 CECE COc1ccc(N2CCC[C@@]3(CCNC3)C2)c(OC)c1 2163345488 YBEPIWSAOQSTNW-INIZCTEOSA-N 276.380 2.284 10 10 CECE CCNCc1ccc(N2CC[C@H](O)C(C)(C)C2)cc1 382067158 BKFQRYRBTOUFFV-HNNXBMFYSA-N 262.397 2.393 10 10 CECE c1cc2c(cc1CN[C@H]1CCCCC13OCCO3)CCO2 715681389 ZVHMWSKXYHUJMI-INIZCTEOSA-N 289.375 2.397 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)[C@H]1CCOC[C@@H]1C 383509113 CZJQLKDCGZMAOO-WFASDCNBSA-N 276.380 2.290 10 10 CECE CCN(c1c(F)cc(CO)cc1F)C1CCOCC1 716354001 MQTVNTFTQVJXMC-UHFFFAOYSA-N 271.307 2.462 10 10 CECE CC[C@H]1[C@@H](CO)CCN1c1ccc(CN)cc1Cl 385824562 SDAUUINCWZULJY-YPMHNXCESA-N 268.788 2.396 10 10 CECE C[C@H](N[C@@H](CO)C1CCCC1)c1ccc(O)cc1O 386127202 DFUKRPYXHJXMGR-HZMBPMFUSA-N 265.353 2.300 10 10 CECE CC(C)(C)C[S@@](=O)CC(=O)Nc1ccc(N)cc1 718777383 GBLHTRMBANLUBL-SFHVURJKSA-N 268.382 2.002 10 10 CECE CCS[C@H]1CCN(CCOc2ccc(N)cc2)C1 394996439 HNXUSWDESHFEEW-AWEZNQCLSA-N 266.410 2.475 10 10 CECE COc1cc(CN[C@H](C)c2ccc(O)cc2O)sn1 399132631 POSAEAXDFALXCW-MRVPVSSYSA-N 280.349 2.414 10 10 CECE C[C@@H](N)Cc1ccc2ccn(Cc3cncnc3)c2c1 2178777796 QLMJYHJBSJGQNN-GFCCVEGCSA-N 266.348 2.369 10 10 CECE Cc1cc(N2CC[C@@](CO)(C(F)(F)F)C2)ccc1CO 2167689525 HTHMQBDKMULCFH-CYBMUJFWSA-N 289.297 2.238 10 10 CECE CN(C[C@@H]1C[C@H]2C[C@H]2CO1)c1ccc(CN)c(F)c1F 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CCc1cccc(CN2C[C@@H](C(N)=O)CC[C@H]2C)c1O 848881215 LZQLKBTWZJPJGU-RISCZKNCSA-N 276.380 2.040 10 10 CECE CO[C@H]1CCC[C@@H]1N(C)CCOc1ccc(N)cc1 687438569 RWEZRWVSWXSPQA-GJZGRUSLSA-N 264.369 2.147 10 10 CECE CC[C@@H](SC)C(=O)NCc1c(O)cccc1F 928706133 RMVYQBNPKGPHOX-LLVKDONJSA-N 257.330 2.289 10 10 CECE CCc1nnc(NC(=O)NCc2c(O)cccc2F)s1 929218997 MISLUCPRGLJIOW-UHFFFAOYSA-N 296.327 2.267 10 10 CECE CC[C@](C)(OC)C(=O)N[C@@H](C)c1ccccc1O 827964509 NWNVKFYNQPRHFA-HZMBPMFUSA-N 251.326 2.385 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CC[C@@H](F)C3)c(Cl)cc21 689857409 TZQTWYIFOWVNLF-AMIZOPFISA-N 297.761 2.491 10 10 CECE CCOc1ccc(CN[C@@H](CO)C2CCC2)c(O)c1 850349879 LBQVXBXMZYHYEZ-AWEZNQCLSA-N 265.353 2.042 10 10 CECE C[C@H]1CC[C@@H](CCC(=O)NCc2c(O)cccc2F)O1 928705986 PXGZLCCQYRLQHB-QWRGUYRKSA-N 281.327 2.495 10 10 CECE COc1ccc(N(C)CCn2cc(C)cn2)c(OC)c1 752108281 BFHQSCWQHFJIMP-UHFFFAOYSA-N 275.352 2.345 10 10 CECE CO[C@@H]1CCC[C@H](C(=O)NCc2c(O)cccc2F)C1 928706857 XINUQBULDWOROH-WDEREUQCSA-N 281.327 2.353 10 10 CECE COC1(OC)CC[C@@H]1NCc1ccc(N(C)C)cc1C 925078543 HXVMEIAEIHOPIE-HNNXBMFYSA-N 278.396 2.302 10 10 CECE CC1(C)CC[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 850069113 JXUHXNMPTZXDGX-SNVBAGLBSA-N 278.304 2.260 10 10 CECE COCc1n[nH]c(CN[C@H](C)c2cc(Cl)ccc2O)n1 850514630 ODRYNRSYVQZLNW-MRVPVSSYSA-N 296.758 2.161 10 10 CECE O=C(COCC(F)F)NCc1ccc(N2CCCC2)cc1 858453845 ZUDOEKMCPAAABF-UHFFFAOYSA-N 298.333 2.185 10 10 CECE Nc1nc(NCc2ccccc2O)nc(C2CCCC2)n1 865487617 RUETYJUSKUYWTD-UHFFFAOYSA-N 285.351 2.429 10 10 CECE CC(=O)c1cc(F)cc(CN[C@@H](C)c2ccnn2C)c1O 879683579 AYYPLVAUEINUKM-VIFPVBQESA-N 291.326 2.318 10 10 CECE COc1ncc(Cl)c(=N[C@@H](C)c2ccccc2O)[nH]1 1877585299 DWKIZBXNFKRSEL-QMMMGPOBSA-N 279.727 2.439 10 10 CECE C[C@@H](c1ccccc1O)N(C)Cc1cc(CO)on1 1877524341 LFNIWWGDQPVMSM-JTQLQIEISA-N 262.309 2.066 10 10 CECE O=[N+]([O-])c1cc(Cl)cc(CNCC2CSC2)c1O 895422683 NOVDTFUESPZDPH-UHFFFAOYSA-N 288.756 2.406 10 10 CECE COc1ccc(O)c(CN(C)Cc2ccns2)c1 895453264 HQRKRPYISZTRLB-UHFFFAOYSA-N 264.350 2.489 10 10 CECE C[C@]1(NC(=O)C(F)(F)F)CCN(CCCCN=[N+]=[N-])C1 1957245592 YWAPUEBCULBEDD-JTQLQIEISA-N 293.293 2.220 10 10 CECE CC(C)(C)OC(=O)NC[C@H]1CC[C@@]1(N)c1ccccc1O 1957264243 CQQRTMXJWPSGLA-BZNIZROVSA-N 292.379 2.481 10 10 CECE Nc1ccc(NC(=O)NCc2cc(C3CC3)no2)cc1 886960706 BPRRMPZDMMUQKO-UHFFFAOYSA-N 272.308 2.456 10 10 CECE C[C@H]1C[C@@H](C)CN(c2ccc3c(c2)NC(=O)[C@@H]3N)C1 36193993 SZGPEGFYGWQYJO-ISTVAULSSA-N 259.353 2.121 10 10 CECE O=C(c1cccc(O)c1O)N1CCC[C@]2(CCCOC2)C1 790843419 GBJHIDNNOQFPSR-INIZCTEOSA-N 291.347 2.131 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@@H]4C[C@H](C3)O4)ccc21 1899730917 CYWJHHIRJOHFCN-IJEWVQPXSA-N 258.365 2.261 10 10 CECE CC(C)NCc1ccc(N2C[C@@H]3C[C@H](C2)O3)c(F)c1 1899764545 WYSOWZGXMXJHIH-BETUJISGSA-N 264.344 2.301 10 10 CECE C/C(=C\c1ccncc1)C(=O)NCc1c(O)cccc1O 1156885306 CQJIKWJRLBVAKS-PKNBQFBNSA-N 284.315 2.213 10 10 CECE COc1ccc(/C=C\C(=O)NCc2cc(O)ccc2O)cc1 1303225482 JCSCJBDSJCCITG-WTKPLQERSA-N 299.326 2.436 10 10 CECE CC[C@@H](CO)CN[C@@H](C)c1ccc(N(C)C)cc1 1964486919 URTBWDCXHPSASW-QWHCGFSZSA-N 250.386 2.422 10 10 CECE Cc1cccc(CNCC2(F)CCOCC2)c1O 1964573955 WJUBGNAPKDHPDC-UHFFFAOYSA-N 253.317 2.309 10 10 CECE CC(C)C[C@@H](CO)CNCc1cc(F)ccc1O 1962902793 KZZXLDCNEBCWAP-LLVKDONJSA-N 255.333 2.276 10 10 CECE CC(C)Oc1ccc(N2CC[C@@H](CNC[C@@H](C)O)C2)cc1 76376301 HLHYBBJGWJKTPJ-CABCVRRESA-N 292.423 2.271 10 10 CECE CC[C@@H]1CN(CCCO)c2cc(OC)c(OC)cc2N1 76929958 HHURMYRQJVGVEC-LLVKDONJSA-N 280.368 2.097 10 10 CECE COc1cccc(CN2CCC[C@H](C(=O)O)CC2)c1O 1964727006 GZJCSOYUWFKMHX-NSHDSACASA-N 279.336 2.088 10 10 CECE CN(C)c1ccc(CNC(=O)c2ccc(CN)cc2)cc1 40825806 JCRHPFSPJDMDJW-UHFFFAOYSA-N 283.375 2.141 10 10 CECE C[C@H](O)c1cc(F)c(N2CC(n3ccnc3)C2)c(F)c1 2194513545 BLNFJBSSHXXEBM-VIFPVBQESA-N 279.290 2.276 10 10 CECE CCCCCNCc1ccc(N2CCNCC2)cc1 84846343 PTZPMWOOZKRILS-UHFFFAOYSA-N 261.413 2.376 10 10 CECE COCCNCc1ccc(N2CC=C(C)C2)c(C)c1 1893041201 ZDPDKHMBQJVRSM-UHFFFAOYSA-N 260.381 2.497 10 10 CECE O=C(O)c1cc(O)ccc1NS(=O)(=O)CC1CCCC1 274910041 KIVUPFSZOCSSAQ-UHFFFAOYSA-N 299.348 2.022 10 10 CECE COc1ccc(N2CCN(CC[C@@H]3CCOC3)CC2)cc1 1327952931 GHNYINANPXOIDN-OAHLLOKOSA-N 290.407 2.244 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1S(=O)(=O)C1CCCC1 692806844 PFMMZNFLKJMSAZ-VIFPVBQESA-N 258.347 2.034 10 10 CECE C[C@]1(N)CCN(Cc2c(O)cccc2Br)C1 706867029 LQYUESCEZLLGAK-LBPRGKRZSA-N 285.185 2.078 10 10 CECE CN(Cc1cc(F)cc(F)c1O)C1CCC(N)CC1 708493975 AYODXEUTHZONCR-UHFFFAOYSA-N 270.323 2.372 10 10 CECE C[C@@H]1CN([C@H](C)c2cc(F)ccc2O)C[C@H]1CN 708834124 CSFAXNJNLBXSCJ-GMTAPVOTSA-N 252.333 2.119 10 10 CECE CC(C)c1nc(SCC(=O)Nc2ccc(N)cc2)n[nH]1 713461455 BVKULYZAFHTOCX-UHFFFAOYSA-N 291.380 2.241 10 10 CECE CC(C)CNCc1ccc(N2CC([C@H](C)O)C2)c(F)c1 719744903 ZQRPKVPGWIRGLO-LBPRGKRZSA-N 280.387 2.388 10 10 CECE Cc1nn(C)c(C)c1NC(=O)N1Cc2cccc(O)c2C1 1334948728 JLLVBWSBSJOOGW-UHFFFAOYSA-N 286.335 2.290 10 10 CECE CC(C)C[C@](NCCN=[N+]=[N-])(C(N)=O)c1ccccc1 90257876 RZAIMJLJGRDPFO-CQSZACIVSA-N 275.356 2.313 10 10 CECE CN(C[C@@H]1CCCN1C)c1ccc(CNC2CC2)cc1 92633163 QMOSVVNZSXBEBP-KRWDZBQOSA-N 273.424 2.469 10 10 CECE COc1ccc(O)c([C@H](C)N2C[C@H](C)C[C@@H](N)C2)c1 94548348 BZRPTWUCDFFZRI-GRYCIOLGSA-N 264.369 2.131 10 10 CECE CC1(C)CC(CS(=O)(=O)NCC2(CN=[N+]=[N-])CC2)C1 2117726875 DBPAABXILZZKFI-UHFFFAOYSA-N 286.401 2.433 10 10 CECE CCN1CCc2cc(C3(O)CC(CCN)C3)ccc21 2120023602 LRVZMDQCUQOCMZ-UHFFFAOYSA-N 260.381 2.015 10 10 CECE CC(C)(C)OC(=O)N1CCN[C@H](c2cccc(F)c2O)C1 1535930042 RJLXDURBTLOZFL-LBPRGKRZSA-N 296.342 2.413 10 10 CECE O=C(NCc1cc(O)ccc1O)[C@H]1CCOc2ccccc21 1471661697 YSVORCQXPGWAPH-AWEZNQCLSA-N 299.326 2.280 10 10 CECE Oc1cc2c(cc1CNc1cnc(Cl)cn1)OCO2 2121641567 GRVVNZRGYNCRAI-UHFFFAOYSA-N 279.683 2.176 10 10 CECE COc1cc(N2CC[C@@H](C(=O)O)[C@H]2C)cc(OC)c1OC 1542990686 PFNWEAOSAUNEPX-MWLCHTKSSA-N 295.335 2.012 10 10 CECE CC[C@H](O)[C@@H](C)NC(=O)C=Cc1ccc(N(C)C)cc1 1911842696 HOEBQAUNQLYQFL-DOMZBBRYSA-N 276.380 2.041 10 10 CECE CCNc1ncc(C(=O)NCc2c(O)cccc2F)s1 1635367117 ZIOJUKFBUDKWLO-UHFFFAOYSA-N 295.339 2.350 10 10 CECE COC(=O)C1(CN(C)c2ccc(OC)c(F)c2)CC1 258996054 NJXZAJQWTACZHV-UHFFFAOYSA-N 267.300 2.224 10 10 CECE CCN(C(=O)Cc1ccc(O)c(O)c1)c1nc(C)cs1 1565739432 IJUUARVJBJKRIS-UHFFFAOYSA-N 292.360 2.458 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CCSC1(C)C 1912192397 FTMSGQAOGYLWFW-VHSXEESVSA-N 286.401 2.350 10 10 CECE [N-]=[N+]=NC1CCN(CC(=O)NCCc2cccs2)CC1 1912196910 NNSKEFNPIWRDDP-UHFFFAOYSA-N 293.396 2.182 10 10 CECE [N-]=[N+]=NCCCN[C@]1(C(N)=O)CCCC[C@@H]1C(F)(F)F 1912167180 HSFPYMZGGUYWHZ-WCBMZHEXSA-N 293.293 2.253 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(Cc2nnsc2Cl)C1 1912154787 IUEJEKNJGMRTCH-LURJTMIESA-N 258.738 2.466 10 10 CECE CC1(C)CC(=O)N[C@@H]1CN1CCCC[C@H](CN=[N+]=[N-])C1 1912209515 AOAPBOKKLLGVQY-VXGBXAGGSA-N 279.388 2.314 10 10 CECE CCc1cnc(CNC(=O)c2c(F)ccc(O)c2O)s1 1641334905 LLAFTVYKBIMJPJ-UHFFFAOYSA-N 296.323 2.186 10 10 CECE CC(C)c1noc(CN2CCC[C@@H](N=[N+]=[N-])C2)n1 1912205209 DVNHVOBCVWTCQL-SECBINFHSA-N 250.306 2.468 10 10 CECE Oc1cccc(F)c1CNc1cc(Cl)nnc1O 1643210328 VULFLWSRFHTXHX-UHFFFAOYSA-N 269.663 2.292 10 10 CECE COCCC1(C(=O)NCc2cc(O)ccc2O)CCCC1 1651222773 PCDNRTRSHADDNR-UHFFFAOYSA-N 293.363 2.311 10 10 CECE CC(C)N(CCN)Cc1c(O)cccc1Br 1913114346 GGXILMIAIDWJJX-UHFFFAOYSA-N 287.201 2.324 10 10 CECE O=C(NCc1cc(O)ccc1O)C1=Cc2ccccc2OC1 1651222446 GCRBZWUMSPLCKP-UHFFFAOYSA-N 297.310 2.190 10 10 CECE CCN(CC)c1ccc(CN[C@@H]2C[C@H]2[C@@H](C)O)cc1 2125867461 MKYTZQQQDQWQFT-UHOFOFEASA-N 262.397 2.392 10 10 CECE COc1ccc(CNCC[C@H]2CCC[C@@H]2O)c(O)c1 1913750895 GRLJCQIDXKEYMM-RISCZKNCSA-N 265.353 2.042 10 10 CECE C[C@H](NCc1ccc(F)cn1)c1ccc(O)cc1O 1913964334 LJWQTJNJIWGZNO-VIFPVBQESA-N 262.284 2.483 10 10 CECE CN(Cc1ccccc1O)C(=O)C[C@H]1CC(C)(C)CN1 1966848414 BCUDJDIZWRNQOG-ZDUSSCGKSA-N 276.380 2.129 10 10 CECE OCC[C@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128276633 DLYCILGCBJJZPV-MLGOLLRUSA-N 261.365 2.265 10 10 CECE C[C@H]1C[C@H](O)CCN(c2ccc3c(c2)CC[C@H]3O)C1 2128322448 OKUGJOBPCDJQDY-SGIREYDYSA-N 261.365 2.263 10 10 CECE CCCN[C@H](C)c1ccc2c(c1)CCN2CC(=O)N(C)C 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CC(=O)N1CCN([C@@H](C)c2ccc(Cl)cc2O)CC1 2138552145 FBWRENQUBRJAMP-JTQLQIEISA-N 282.771 2.271 10 10 CECE CNCc1sc(-c2ccc(O)c(O)c2)nc1COC 234396677 JWRIEXXVENQLLU-UHFFFAOYSA-N 280.349 2.087 10 10 CECE Oc1cccc(Br)c1CN[C@@H]1C[C@@H]2COC[C@H]21 1940443268 JGFQRKTULGPONL-HLUHBDAQSA-N 298.180 2.279 10 10 CECE CCNCc1ccc(N2C[C@@H](C)N(C)[C@H](C)C2)cc1 127886285 SRFFLZZMVGGQRA-ZIAGYGMSSA-N 261.413 2.325 10 10 CECE CNCc1cc(F)c(N(C)[C@H]2CCCC[C@H]2O)c(F)c1 252928400 QRCYLWZCLGLUHV-UONOGXRCSA-N 284.350 2.424 10 10 CECE O=C(O)c1cccc(NC(=O)c2ccc(O)c(O)c2)c1 236462814 AZFBRULCIWCUFI-UHFFFAOYSA-N 273.244 2.048 10 10 CECE COCCNCc1ccc(OC[C@@H]2CCCO2)c(C)c1 2143407687 SDQBCNXXRBITPL-HNNXBMFYSA-N 279.380 2.289 10 10 CECE Cc1cc(C)nc(CN[C@H](C)c2cc(O)ccc2O)n1 2149973984 QLFZKISOHOZRCE-LLVKDONJSA-N 273.336 2.355 10 10 CECE CCOC(=O)C[C@](C)(N)c1ccc(N(C)C)c(F)c1 1951879390 MMICUKDFIMQRFV-AWEZNQCLSA-N 268.332 2.019 10 10 CECE CC(C)[C@H](O)[C@H](C)NCc1ccc(F)c(F)c1O 1971019162 POSXCIDRBRRBSV-UFBFGSQYSA-N 259.296 2.165 10 10 CECE CCc1cccc(CN[C@@H]2CCS(=O)(=O)[C@@H](C)C2)c1O 2143954544 BWHXFAJQKRLOLZ-SMDDNHRTSA-N 297.420 2.010 10 10 CECE Oc1cccc(Br)c1CNCCC1COC1 1971423651 PLSCWSFXWMXCQP-UHFFFAOYSA-N 286.169 2.281 10 10 CECE CC(C)(C)OC(=O)[C@@H]1CCN[C@@H]1c1cc(O)ccc1O 1952823303 JGQSOUFEKIFEAC-MFKMUULPSA-N 279.336 2.090 10 10 CECE CN(Cc1cc2c(cc1O)OCO2)C[C@]1(C)CCCO1 1973987708 HMGAIMKQPWLUKT-HNNXBMFYSA-N 279.336 2.122 10 10 CECE CCOc1cccc(CNC[C@@H]2C[C@]23CCOC3)c1O 1974202244 OZGINCUBUPPJQC-BBRMVZONSA-N 277.364 2.307 10 10 CECE C[C@@H](COC(F)(F)F)NCc1cc2c(cc1O)OCO2 1974268047 VXSLXBGPBMXJEQ-ZETCQYMHSA-N 293.241 2.135 10 10 CECE COC(=O)CC[C@@H](N)c1cc(O)cc(C(F)(F)F)c1O 260354611 CESPNBJLQFMMRV-SECBINFHSA-N 293.241 2.070 10 10 CECE C[C@H](NC[C@@H]1C[C@H]2COCC[C@H]2O1)c1ccccc1O 2148988480 JWNFUOSJCNVMOP-WFGGJUAMSA-N 277.364 2.237 10 10 CECE CC[C@H](C)[C@@H](NCc1cccc(OC)c1O)C(=O)OC 37103066 OLOPYCSGECIGHQ-GXFFZTMASA-N 281.352 2.078 10 10 CECE CC[C@@H](C)[C@H](NCc1ccc(N(C)C)cc1)C(=O)OC 37102576 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CC(C)[C@H](Nc1c(N)cccc1Cl)C(=O)N(C)C 2038816857 ZPNVYOFGCHEPPR-NSHDSACASA-N 269.776 2.447 10 10 CECE Cc1ccc([C@H](C)N2CCN(CCF)CC2)c(O)c1 402784478 QIRZKXHPVHUMEL-ZDUSSCGKSA-N 266.360 2.349 10 10 CECE Cc1ccc(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)c(O)n1 403644892 IHDWNJMISLDQHQ-SECBINFHSA-N 261.285 2.011 10 10 CECE OCC1CCC(NCc2cccc(F)c2O)CC1 310630207 MVCMFWCUHXWYTF-UHFFFAOYSA-N 253.317 2.172 10 10 CECE CNCc1cc(F)c(N2CC[C@H](N(C)C)[C@@H]2C)c(F)c1 312646021 DSCTVMBNWFKUBE-HZMBPMFUSA-N 283.366 2.213 10 10 CECE C[C@@H](N)c1ccc(N2C[C@H]3C[C@H]2CS3)cc1O 320991645 MQERFQIPAAQTAT-DVVUODLYSA-N 250.367 2.106 10 10 CECE CC1(C)CO[C@H]1COC(=O)CCOc1ccc(N)cc1 2161331230 KYPYKSOPDXCQQA-ZDUSSCGKSA-N 279.336 2.006 10 10 CECE CCCNCc1ccc(N2CC[C@H]3C[C@]3(O)C2)c(C)c1 2171005647 RZUCBZLJRLITLK-RDJZCZTQSA-N 274.408 2.456 10 10 CECE [N-]=[N+]=NCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 701301563 SMSIVYMZIUSILR-UHFFFAOYSA-N 269.648 2.288 10 10 CECE COc1ccc(CN2CCC[C@@H]2CCN(C)C)c(O)c1 701494640 TYBPGEDUFUESBZ-CQSZACIVSA-N 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2.386 10 10 CECE COc1ncccc1CNCc1c(O)cccc1F 2104507549 OKODOXMGDVZEGN-UHFFFAOYSA-N 262.284 2.225 10 10 CECE CCCN(c1ccc(OC)c(OC)c1)[C@H]1CCNC1 2106330904 HHGLMNVXXUCBHY-ZDUSSCGKSA-N 264.369 2.282 10 10 CECE CN(C)c1ccc([C@]2(O)CCC[C@@H](N(C)C)C2)cc1 2106799959 CCDKSJGVSSOIAO-CVEARBPZSA-N 262.397 2.444 10 10 CECE CCO[C@H](C1CC1)[C@H](NN)c1ccc(N(C)C)cc1 2106856996 GRHUTZFPGPFSCL-HUUCEWRRSA-N 263.385 2.072 10 10 CECE CN(C)c1ccc([C@@H](CCc2ccco2)NN)cc1 2106828372 MCQSIDOWHXMYJQ-OAHLLOKOSA-N 259.353 2.483 10 10 CECE CCN1CCc2cc([C@@H](N)C3(O)CCCC3)ccc21 2106854037 YCMCWKWOFRKPFC-OAHLLOKOSA-N 260.381 2.374 10 10 CECE CN1CCCc2cc([C@@H](NN)c3cncs3)ccc21 2106826615 VCTLWVAJSAJJPD-CQSZACIVSA-N 274.393 2.078 10 10 CECE CCN(CC)c1ccc([C@H]2CC[C@H](C(=O)O)N2)cc1 2106832351 ZIHURQSDDOLLNX-ZIAGYGMSSA-N 262.353 2.411 10 10 CECE C[C@@H](C(=O)O)N(C1CC1)[C@@H](C)c1c(O)cccc1O 2087125862 VJQJRRFZDMKKOV-IUCAKERBSA-N 265.309 2.096 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCC[C@@H]2NCC[C@H]21 2087390253 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266.772 2.292 10 10 CECE Nc1ccc(NC(=O)CO[C@@H]2C[C@H]3CC[C@H]2C3)cc1 2231957008 OFUHIZUNYDLDHK-COPLHBTASA-N 260.337 2.413 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](CO)C[C@@H]2C)c(C)c1 2232016902 FWUIAWCERZEXKF-BFHYXJOUSA-N 262.397 2.483 10 10 CECE Cc1noc(CN(C)c2ccc([C@@H](C)O)cc2C)n1 2232098514 OTPOVWHNOXVUCC-SNVBAGLBSA-N 261.325 2.376 10 10 CECE C[C@]1(O)C[C@@H]2[C@@H]1CCN2c1ccc2c(c1)CCC[C@H]2O 2233826805 OXBLTLUHEZPKMU-HZMVEIRTSA-N 273.376 2.406 10 10 CECE Cc1cc([C@H](C)O)ccc1N(C)CCCN(C)C 2223979549 VPFGMALUGXLCLK-ZDUSSCGKSA-N 250.386 2.436 10 10 CECE CO[C@@H]1CN(c2ccc([C@@H](C)N)cc2C)C[C@H]1F 2223971460 NHFSMUBCHOEGAA-MPKXVKKWSA-N 252.333 2.188 10 10 CECE COCCn1cccc1C(=O)N[C@H]1CCC[C@@H]1N=[N+]=[N-] 2234168190 HCHIYZJDLIDLIF-QWRGUYRKSA-N 277.328 2.096 10 10 CECE CCO[C@@H]1C[C@H]2CN(CCOc3ccc(N)cc3)C[C@H]21 2234315778 PKTKONHVYKFOMS-APHBMKBZSA-N 276.380 2.004 10 10 CECE Cc1cccc(CN(C)c2cccn(C)c2=O)c1O 2224990583 MNTCCBCPVWVKPF-UHFFFAOYSA-N 258.321 2.036 10 10 CECE CC12CC(C(=O)N[C@@H]3CCC[C@@H]3N=[N+]=[N-])(CCO1)C2 2225795719 PWAQLZWSMAACQU-PGKBUCCNSA-N 264.329 2.293 10 10 CECE COc1ccc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c(F)c1 2226788520 MIVJWXFYMRCSRU-AQZXDCIVSA-N 263.312 2.040 10 10 CECE COc1ccc(N2C[C@H](O)[C@@H](O)CC2(C)C)cc1Cl 2226925053 PINLLJFJCSRLTK-RYUDHWBXSA-N 285.771 2.059 10 10 CECE CN(C)c1ccc(OCc2cccc(C(=N)N)n2)cc1 2237694383 UBMGAEHOIZLHKT-UHFFFAOYSA-N 270.336 2.011 10 10 CECE C[C@@H]1C[C@@H](O)[C@@H](C)N(CCCc2ccc(N)cc2)C1 2227611824 VTDYDRAOVZKIHO-XJKCOSOUSA-N 262.397 2.293 10 10 CECE CNCc1cc(OC)ccc1N(C)Cc1ccno1 2227679019 CWMHYWAEYWOJNF-UHFFFAOYSA-N 261.325 2.039 10 10 CECE COc1ccc(N(C)C[C@@]2(C)CCOC2)c(C=O)c1 2227703482 RFFQAGUCOSEHFH-OAHLLOKOSA-N 263.337 2.371 10 10 CECE COc1ccc(N(C)Cc2cc(C)no2)c(CO)c1 2227711024 LBSDZFXQJIBSRY-UHFFFAOYSA-N 262.309 2.120 10 10 CECE C[C@H]1C[C@@H]1CCN(C)S(=O)(=O)Cc1ccc(N)cc1 2228273685 TWEHEZPVLSKSHS-AAEUAGOBSA-N 282.409 2.077 10 10 CECE CN[C@@H](C)c1ccc(N2[C@H]3CC[C@@H](O)[C@H]2CC3)cc1 2229871886 GQHKFFJOKQIFCU-AEAUEXCSSA-N 260.381 2.459 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H](O)[C@H]2CC3)c(OC)c1 2229861530 AESLQVSQWWNZRF-MPKXVKKWSA-N 263.337 2.196 10 10 CECE C[S@](=O)CC1CN(c2ccc(CNC3CCC3)cc2)C1 2240013551 HLOAYVQRYIIWJW-FQEVSTJZSA-N 292.448 2.143 10 10 CECE C[C@@H](COC(F)F)O[C@H](C)C(=O)Nc1ccc(N)cc1 2279806601 ARFHVFDEXWKPJS-DTWKUNHWSA-N 288.294 2.240 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCCNC(=O)C1(C)C 2240834200 XGVHGGLWGRYVLN-LBPRGKRZSA-N 276.380 2.153 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCCC[C@H]1CC(N)=O 2240833367 NEDXYTWSZKJBRE-JSGCOSHPSA-N 275.396 2.249 10 10 CECE CSc1ncc(CNCC[C@H]2C[C@@H](N)C2)s1 2243855309 JYLFJTUXYRVAPQ-DTORHVGOSA-N 257.428 2.082 10 10 CECE CSc1ncc(CNC(=O)C(C)(C)C(C)(C)N)s1 2257024805 ZTZVIRQNTWDVOA-UHFFFAOYSA-N 287.454 2.245 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@H](F)C2)c(C)c1C 2257002010 SLAQCPVGVRWZCF-DGCLKSJQSA-N 253.317 2.221 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@@H](F)C2)c(C)c1C 2257002011 SLAQCPVGVRWZCF-WCQYABFASA-N 253.317 2.221 10 10 CECE CCc1c(O)c(=O)ccn1Cc1cnc(SC)s1 2257099059 FIVXWPRGQLUYMW-UHFFFAOYSA-N 282.390 2.343 10 10 CECE CSc1ncc(CNCc2cncc(CN)c2)s1 2257127750 OPUOELRCRWCFAP-UHFFFAOYSA-N 280.422 2.009 10 10 CECE COc1cc(OC)c(N2C[C@@H](C)[C@@H](O)C2)cc1Cl 2258078151 FDVJPERZNDZUTM-KCJUWKMLSA-N 271.744 2.174 10 10 CECE CCCN(C[C@@H](C)O)c1ccc([C@H](C)O)c(O)c1 2259658424 IOPNAOAMBIIMBL-MNOVXSKESA-N 253.342 2.043 10 10 CECE CNCc1ccc(N(C)Cc2nc(C)ns2)cc1 2260339400 UJHBBIWWPQEKSM-UHFFFAOYSA-N 262.382 2.202 10 10 CECE CN(C)c1ccc(CNC[C@]2(C)CCC[C@H]2O)cc1 2271303048 WGWKWDAUBWYTPY-CVEARBPZSA-N 262.397 2.393 10 10 CECE FC(F)Oc1ccc(N2CCCNCCC2)cc1 2263916461 PWXPRQQHNOYBTM-UHFFFAOYSA-N 256.296 2.478 10 10 CECE COCCNC[C@@H]1CCN1c1ccc(OC)cc1Cl 2268107758 NGGLQLMDSAVCEO-NSHDSACASA-N 284.787 2.163 10 10 CECE OC[C@@]1(NCc2c(O)cccc2F)C[C@H]2CC[C@H]1C2 2268558602 LBZPJQCNCGOANA-PGUXBMHVSA-N 265.328 2.172 10 10 CECE C[C@H](N=c1ccn(CC(F)F)[nH]1)c1ccccc1O 2278693594 VQMHMCNJSKCYEM-VIFPVBQESA-N 267.279 2.449 10 10 CECE COc1cc(N2CC(C)(C)OC[C@H]2C)ccc1CN 2268771547 GPWRPLNMTMUGEL-LLVKDONJSA-N 264.369 2.158 10 10 CECE COc1ccc(N2CC(CCCO)C2)c2c1CCC2 2269165839 CZFDYNYRQLJMIF-UHFFFAOYSA-N 261.365 2.393 10 10 CECE Cc1cc(N2CCSC[C@H]2CCO)ccc1[C@H](C)N 2269651905 QHPWZQJPCWNJCR-GXTWGEPZSA-N 280.437 2.319 10 10 CECE Cc1cc(N2CC[C@H](O)[C@H]2C2CC2)ccc1[C@@H](C)O 2269671981 CDFKMJNFIYFGLF-XFBWCDHKSA-N 261.365 2.398 10 10 CECE Cc1cc(N2C[C@H](C)C(O)[C@@H](C)C2)ccc1[C@@H](C)N 2269651837 PPFRFHCEMAJVAF-RWMBFGLXSA-N 262.397 2.468 10 10 CECE Cc1cc(N2CC3(CC3)C[C@H]2CO)ccc1[C@@H](C)O 2269696666 WTDMMRCNMARRGQ-OCCSQVGLSA-N 261.365 2.400 10 10 CECE NCc1ccc(N2CC[C@]3(O)C[C@H]3C2)cc1C(F)(F)F 2280018152 PCZODJHWCPOSEH-GWCFXTLKSA-N 286.297 2.125 10 10 CECE CN[C@@H](c1ccccc1O)[C@]1(O)CCC[C@H]2CC[C@H]1O2 2283807133 XPOKXUOGTUTROJ-MWNCTCPHSA-N 277.364 2.115 10 10 CECE Cc1cc(N2CCS(=O)(=O)[C@H](C)[C@@H]2C)ccc1[C@@H](C)N 2285128625 NCDPRSHLCDQKTG-FRRDWIJNSA-N 296.436 2.027 10 10 CECE COC[C@@]1(OC)CCN(c2ccc([C@@H](C)O)c(C)c2)C1 2285165915 SBFLAFHTWNAEHV-CZUORRHYSA-N 279.380 2.290 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@@H]3C[C@H](C2)[C@@H]3O)c(F)c1 2286200903 GDHYSYJJPZXVFX-APKCBFJXSA-N 282.334 2.062 10 10 CECE CCOC(=O)C=C(C)CN1CCC[C@H]1CN=[N+]=[N-] 2314133771 YCYROZCQHQVORB-NSHDSACASA-N 252.318 2.271 10 10 CECE Cc1nnsc1CN(C)c1ccc(CO)cc1F 2314381598 SSDTUYHHTRTESL-UHFFFAOYSA-N 267.329 2.114 10 10 CECE c1cc2c(cc1CNC[C@H]1[C@@H]3CCO[C@@H]31)CCCO2 2330706720 SYAZEKHTNGYPGP-DZKIICNBSA-N 259.349 2.136 10 10 CECE CCN(CC)c1ccc([C@@H](O)[C@@H]2CNC[C@H]2C)cc1 2330774132 DHAOPRNXYCBKBL-DAXOMENPSA-N 262.397 2.422 10 10 CECE CC[C@@H](O)c1ccc(N2[C@H]3CC[C@H](C3)[C@@H]2CO)cc1 2330991674 MBIMTBGDOSWMQR-SYAUCNOPSA-N 261.365 2.480 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@H]2OC[C@@H]3CCC[C@H]23)CC1 2333521380 XQZLBRSPMGYZSA-DCAQKATOSA-N 264.329 2.008 10 10 CECE C[C@H]1Cc2cc(N3C[C@@]4(C)C[C@@]4(CO)C3)ccc2O1 2333686932 GVQBZEKFSKHICX-XZJROXQQSA-N 259.349 2.219 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1N(c1ccc3c(c1)CC[C@@H]3O)C2 2339657199 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2.061 10 10 CECE CCOC(=O)C1=NN(c2ccccc2Cl)C(=O)[C@@H]1C 2098462384 MVCJXOCEBOQZAY-MRVPVSSYSA-N 280.711 2.242 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cc(Cl)ncn2)CC1 2099333923 QOQXGKZUMUPVTK-MRVPVSSYSA-N 280.719 2.435 10 10 CECE COc1ccc(CN[C@H](C)[C@@]23CC[C@@H](CO2)C3)c(O)c1 2201986180 UQWHYWZZWGYSJO-HSMVNMDESA-N 277.364 2.448 10 10 CECE OCC1CC(F)(CN[C@@H]2CCc3cccc(O)c32)C1 2112380121 FGDWEFRNSPELNZ-WBFHCKIUSA-N 265.328 2.080 10 10 CECE CN1CCC[C@@H]1[C@H]1CCCN1Cc1ccc(N)cc1 2114904754 SEJJTIZJJCQMRF-HZPDHXFCSA-N 259.397 2.327 10 10 CECE COc1cc(N(C)[C@@H](C)CO)ccc1CNCC(C)C 2204545350 OGRKGKMMSZUPPL-ZDUSSCGKSA-N 280.412 2.258 10 10 CECE COc1cc(N2C3CCC2([C@@H](C)O)CC3)ccc1CO 2204542176 XAYVCVOLHMXNFN-FFKNIBCLSA-N 277.364 2.070 10 10 CECE COc1cc(N2CCOCCC23CCC3)ccc1CO 2204542422 AEAIWSSCIXWRHD-UHFFFAOYSA-N 277.364 2.337 10 10 CECE N[C@H]1CN(Cc2ccc(F)cc2O)CC[C@@H]1C(F)(F)F 2204623472 DTWLCONKRCIRMR-QWRGUYRKSA-N 292.276 2.243 10 10 CECE Cc1ccc(O)c(CN[C@@]2(CO)C[C@H]3CC[C@H]2C3)c1 2268562656 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CCNCc1ccc(N2C[C@@H](F)[C@@H](CO)C2)cc1Cl 2120632113 VASXFYCYFMMMMT-BXUZGUMPSA-N 286.778 2.216 10 10 CECE C[C@H](N(C)c1ccc2c(c1)NC(=O)[C@H]2O)C(C)(F)F 2122326403 ZVBBDUXGAGTLFG-CPCISQLKSA-N 270.279 2.152 10 10 CECE Oc1cccc(CN[C@H]2COC3(CCCC3)C2)c1O 2122395375 DBEBXFSFICZDNQ-GFCCVEGCSA-N 263.337 2.289 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN1CCC(=O)N1CCCCC1 2123007009 YZPKCGVVXAYYBK-LBPRGKRZSA-N 265.361 2.164 10 10 CECE CS(=O)(=O)[C@H]1CCC[C@@H](N2CCC[C@@H]2CN=[N+]=[N-])C1 2123018816 HULMIWNNGWYVEK-UTUOFQBUSA-N 286.401 2.117 10 10 CECE CN1CCC[C@@H](CCN2CCC[C@H](N=[N+]=[N-])C2)C1 1912171443 KNTSGTNMYSQWKO-STQMWFEESA-N 251.378 2.493 10 10 CECE COc1cccc(O)c1C(=O)N(C)CCCN=[N+]=[N-] 1912173843 RKLCCKGPMQLLSJ-UHFFFAOYSA-N 264.285 2.173 10 10 CECE COc1cccc(S(=O)(=O)N2CC[C@H](CN=[N+]=[N-])C2)c1 1912197118 PBBOXOFMMTUFCS-SNVBAGLBSA-N 296.352 2.016 10 10 CECE COC(=O)C(C)(C)CN1CCC[C@H](CN=[N+]=[N-])C1 1912144615 WEUNJOCYUIRBHO-SNVBAGLBSA-N 254.334 2.208 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2c(O)cccc2O)C1 1912202363 FZSHSDSIPJYNON-SECBINFHSA-N 276.296 2.260 10 10 CECE C/C(=C/C(=O)N(C)c1ccnc(C)c1)c1cnccn1 1583385699 OCROBDJIFDCFBC-FLIBITNWSA-N 268.320 2.246 10 10 CECE COc1ccc(N(C)CC[C@@H]2CC(C)(C)NC2=O)cc1 1966145146 UACMPJSOPDAEAC-GFCCVEGCSA-N 276.380 2.436 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])[C@H]1CCC2(CC2)C1 2126474414 LYGYJUDKOWCGNW-QWRGUYRKSA-N 266.345 2.398 10 10 CECE CO[C@H]1CCN(c2ccc(CN)c(Cl)c2)[C@@H]1C 1914262118 LNTFPQLARRJINC-RNCFNFMXSA-N 254.761 2.412 10 10 CECE CCN[C@@H]1CCc2cc(N3CCO[C@H]4C[C@H]43)ccc21 2128293868 IHFBMMIYLLXSMN-OAGGEKHMSA-N 258.365 2.261 10 10 CECE C[C@H]1CN(c2ccc3c(c2)CC[C@H]3N)CC[C@H]1CO 2128296065 FGTOJDZQILHWNN-DETPVDSQSA-N 260.381 2.087 10 10 CECE CCN[C@@H]1CCc2cc(N3C[C@@H](C)[C@@H](O)C3)ccc21 2128296186 QNYRDRPJNLHLAW-LYRGGWFBSA-N 260.381 2.100 10 10 CECE Cc1cc([C@H](O)CCc2ccc(N)cc2)nc(C)n1 2127858965 QWEFAHPNTHGTLK-OAHLLOKOSA-N 257.337 2.342 10 10 CECE CC1(C)C[C@@H](O)CN1c1ccc2c(c1)CCC[C@@H]2O 2128274131 NDOWHTIMLXDTDM-HIFRSBDPSA-N 261.365 2.406 10 10 CECE N[C@@H]1CCCc2cc(N3CC(OC(F)F)C3)ccc21 2128275272 TYCHRNYQTDDAEX-CYBMUJFWSA-N 268.307 2.451 10 10 CECE COC(=O)c1cc(Cc2ccc(N)cc2)ccc1N 5141069 QEJNFWVQDMOATI-UHFFFAOYSA-N 256.305 2.228 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@@H]3O)C[C@@H](C)C1O 2128320311 BGMPUTFJQWRTKF-HFAKWTLXSA-N 261.365 2.119 10 10 CECE COC[C@]12C[C@@H]1CN(c1ccc3c(c1)CC[C@H]3O)C2 2128322834 QUZLCNSFXBNGEV-DAXOMENPSA-N 259.349 2.139 10 10 CECE CN(c1ccc2c(c1)CC[C@@H]2O)[C@H](CCO)C(F)F 2128321254 HTGSPHHEFHUXNU-OLZOCXBDSA-N 271.307 2.119 10 10 CECE C[C@H]1Cc2ccccc2N(c2ncnc3c2CNCC3)C1 169136525 QXJPYAPVTHLBAD-LBPRGKRZSA-N 280.375 2.453 10 10 CECE CSc1ncc(CN[C@@H]2CCNCC[C@H]2C)s1 2248699274 FVMBXHBPYPQOKQ-MWLCHTKSSA-N 271.455 2.343 10 10 CECE CCC[C@@H]1C[C@@](N)(c2ccc3c(c2)CCN3C)CO1 2129118695 AJWCEOCLSRFZAB-ZBFHGGJFSA-N 260.381 2.422 10 10 CECE CCc1cc(N2CC[C@H]3CCN[C@H]3C2)ccc1OC 250503004 HAVQCXQMCUWBPA-HIFRSBDPSA-N 260.381 2.446 10 10 CECE COc1ccc([C@H](C)N[C@H]2CC[C@](C)(O)C2)c(O)c1 2130303132 MKUBIWVVDRPBBY-PGUXBMHVSA-N 265.353 2.355 10 10 CECE CCN1[C@H](C)CN(c2ccc(CN)cc2F)C[C@H]1C 2130405712 UPTBLBASGPANFF-VXGBXAGGSA-N 265.376 2.203 10 10 CECE CO[C@H]1CCC[C@@H](N(C)Cc2cc(N)ccc2O)C1 2130727955 NLRUSHOOPHIFIY-KGLIPLIRSA-N 264.369 2.364 10 10 CECE Nc1ccc(NC(=O)CCCCCC(=O)O)cc1 1866065723 KTXYCIURKLPAJH-UHFFFAOYSA-N 250.298 2.242 10 10 CECE COc1cc(CN2CCc3cc(CN)ccc32)sn1 2133384998 VYPBDLOCOPIQGT-UHFFFAOYSA-N 275.377 2.173 10 10 CECE Cc1cc(N2C[C@@H](CO)C3(CCC3)C2)ccc1CO 1914526277 UQGXJROLIVSJSY-AWEZNQCLSA-N 261.365 2.086 10 10 CECE CNCc1ccc(N2CCO[C@@H](C)CC2)cc1OC 2139699015 PWMXNMIDBROLOW-LBPRGKRZSA-N 264.369 2.030 10 10 CECE CO[C@H]1CN(Cc2cccc(F)c2O)CC1(C)C 1967790577 JVLZVNCVPNOVGX-LBPRGKRZSA-N 253.317 2.388 10 10 CECE COc1ccc(O)c(CN[C@@H]2CC[C@H]3OCC[C@H]3C2)c1 1967835636 WLHVRLJXMJRITE-NORZTCDRSA-N 277.364 2.448 10 10 CECE O=C(O)c1ccnc(Sc2ncc([N+](=O)[O-])s2)c1 226765971 QYNRSVOGFIZJGG-UHFFFAOYSA-N 283.290 2.296 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H](O)C23CCC3)c(F)c1 2136739753 RXGGQSAVMNGGLA-HZMBPMFUSA-N 264.344 2.210 10 10 CECE Cc1cc(C)nc(CNCc2ccc(O)cc2O)c1 2136996691 PRYXEJTVCRNPKU-UHFFFAOYSA-N 258.321 2.399 10 10 CECE NC1(C2CN(Cc3c(O)ccc4ccccc34)C2)CC1 1924004066 NSACVARKVBBXEH-UHFFFAOYSA-N 268.360 2.469 10 10 CECE Nc1ccc(CCN=c2ncc(C3CC3)c[nH]2)cc1 2137079343 FKUGRIFGMBUIFX-UHFFFAOYSA-N 254.337 2.013 10 10 CECE COCCCCOc1ccc(N2CCC[C@H](N)C2)cc1 228715211 XTVKBKCGMBLYGP-AWEZNQCLSA-N 278.396 2.420 10 10 CECE Cc1nccn1CC(=O)N(C)[C@@H](C)c1ccccc1O 1968787977 AZFVSIMATGYAQV-NSHDSACASA-N 273.336 2.117 10 10 CECE Cc1c(CNC[C@@H]2CC[C@H]2O)n(C)c2ccccc12 2140514127 MGMPZROLFRLSSK-BLLLJJGKSA-N 258.365 2.347 10 10 CECE Cc1cc(N(CCC(N)=O)Cc2ccccc2)ccc1CO 1931977565 KXHDQRWIICJDMK-UHFFFAOYSA-N 298.386 2.369 10 10 CECE CO[C@@H]1CC[C@H](N[C@@H](C)c2cc(O)ccc2O)C1 234964628 IVIPCSRXNQPRQI-JBLDHEPKSA-N 251.326 2.316 10 10 CECE C[C@@]12CC[C@H]1CN(c1ccc(CO)c([N+](=O)[O-])c1)C2 2143191916 IWBHOIQCDVLXOX-FZMZJTMJSA-N 262.309 2.323 10 10 CECE Oc1ccc(CN[C@@H]([C@@H]2CCOC2)C(F)(F)F)c(O)c1 2143637342 DHTJRQFZASEGTJ-SKDRFNHKSA-N 291.269 2.155 10 10 CECE C[C@@H](N)c1ccc(N2CCO[C@@H]3COCC[C@H]32)c(Cl)c1 2143766384 HHIFYENDLODHRZ-VCTAVGKDSA-N 296.798 2.354 10 10 CECE COc1ccc([C@@H](CO)N=[N+]=[N-])c(C(F)(F)F)n1 1951852095 CFZAHZIZPUSLAC-ZCFIWIBFSA-N 262.191 2.453 10 10 CECE COc1ccc(CNCC[C@@H]2CCCN(C)C2)c(O)c1 2151292224 MMFOMYKSQJXYFQ-ZDUSSCGKSA-N 278.396 2.222 10 10 CECE Oc1cc2c(cc1CN[C@H]1CC[C@@H]1C1CC1)OCO2 1972281756 KPFPYNHQQZDNIN-NEPJUHHUSA-N 261.321 2.399 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@H]3C[C@H]2C[C@@H]3OC)c1 1974113051 DWTAAUGJNRBHNO-CIGZNWKYSA-N 277.364 2.304 10 10 CECE C[C@H](NC[C@]1(F)C[C@H](CO)C1)c1ccc(F)cc1O 1974378394 FDMKEPSNVHQJPH-BHDSKKPTSA-N 271.307 2.293 10 10 CECE O=C(NCCC=CBr)c1cccc(O)c1O 1980882162 KWWMIODBLSUQOL-UHFFFAOYSA-N 286.125 2.126 10 10 CECE CC(C)(CNCc1cccc(O)c1O)N1CCCCC1 2151597814 JSISXALATHZYQQ-UHFFFAOYSA-N 278.396 2.452 10 10 CECE COc1ccc(CN[C@@H]2CC[C@H]3OCC[C@@H]3C2)c(O)c1 2150465201 OVNMLUGQNZZWLM-AXAPSJFSSA-N 277.364 2.448 10 10 CECE Cc1ccccc1S(=O)(=O)NCCc1ccc(N)cc1 32147050 IIRXUZICKXIQMY-UHFFFAOYSA-N 290.388 2.098 10 10 CECE COc1cc(CNCc2cccc(F)c2O)ccn1 158764970 BWKXUVXOTGMOHQ-UHFFFAOYSA-N 262.284 2.225 10 10 CECE CC(C)N(C)C(=O)CN(Cc1ccc(N)cc1)C1CC1 35366062 UIGCRCWQDIJUCL-UHFFFAOYSA-N 275.396 2.100 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CC[C@@H](N)C(F)(F)C1 2151608182 LHJLGAPWSSDCDR-BXUZGUMPSA-N 283.366 2.482 10 10 CECE C[C@H](CNCc1ccc(N(C)C)cc1)c1ccn(C)n1 2147080154 MTLNGKYEDZGBMK-CYBMUJFWSA-N 272.396 2.379 10 10 CECE C[C@H](N)c1ccc(N2CC=C[C@H](O)C2)cc1Br 2000824694 ONRLCNNJZNYAGR-ONGXEEELSA-N 297.196 2.206 10 10 CECE c1cc2c(cc1N1CCCN3CCC[C@H]3C1)COCC2 2152795987 LMBSYPLHSIQQDO-KRWDZBQOSA-N 272.392 2.434 10 10 CECE Cc1nc(CNC(=O)CCOc2ccc(N)cc2)cs1 41010223 KAXXOKDNNCRVPK-UHFFFAOYSA-N 291.376 2.119 10 10 CECE C[C@@H](O)c1ccc(N2CC3(C2)OCCC[C@H]3O)cc1Cl 2159662510 JPLCLEKXMDSTKQ-QMTHXVAHSA-N 297.782 2.123 10 10 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252.333 2.459 10 10 CECE CCNCc1ccc(N(CCCO)C2CC2)c(F)c1 404233709 JDGVQKQOZDOJGD-UHFFFAOYSA-N 266.360 2.286 10 10 CECE CN(C)C[C@H]1CCCCN1CCc1ccc(N)cc1 404896642 AWYZJIYJHWKIAJ-MRXNPFEDSA-N 261.413 2.227 10 10 CECE CC(C)N(C)C[C@H](C)N[C@H](C)c1c(O)cccc1O 311656037 FMTCPKVVXFUYQK-NWDGAFQWSA-N 266.385 2.477 10 10 CECE COCCN([C@H](C)COC)[C@@H]1CCc2cccc(O)c21 312856363 RCEOQVBLVCSUTG-TZMCWYRMSA-N 279.380 2.363 10 10 CECE OCC1(NCc2ccc(F)c(F)c2O)CCCC1 700765777 SNAIBWQXLLFRNC-UHFFFAOYSA-N 257.280 2.065 10 10 CECE CNCc1ccc(OC)c(CN2C[C@H]3C[C@H]2[C@H]2C[C@H]32)c1 2159518148 KVPZYVRLFKBBPG-OJLVUWQFSA-N 272.392 2.255 10 10 CECE CCOc1cccc(CN[C@](C)(CO)C(F)(F)F)c1O 2161366353 RUKGWEVKFCYRNL-GFCCVEGCSA-N 293.285 2.194 10 10 CECE COCCNCc1ccc(N2CCO[C@H]3C[C@H]32)c(Cl)c1 2171804831 ILNMYCAMWKRGTL-CABCVRRESA-N 296.798 2.054 10 10 CECE CN(CC1(F)CCC1)c1ccc2c(c1)N(C)C(=O)[C@@H]2O 2177817726 QKVNGGUWIHBIJN-CYBMUJFWSA-N 278.327 2.025 10 10 CECE Cc1cc(C)n(CCC(=O)NCCCCN=[N+]=[N-])n1 701290652 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LVNWUFMJFABLMU-UHFFFAOYSA-N 271.320 2.293 10 10 CECE Cc1cc(Cl)cc([C@@H](C)NC2COCCOC2)c1O 813879487 MOAALSXHMFXQLJ-SNVBAGLBSA-N 285.771 2.420 10 10 CECE COc1ccc(N2CC[C@H](CNC(=O)CSC)C2)cc1 819580807 OPMRWXLLDXGRBE-GFCCVEGCSA-N 294.420 2.001 10 10 CECE Cc1ccc(F)c([C@H](N2CCNCC2)C(F)(F)F)c1O 575285402 RVJQCLCVYZLKEA-LBPRGKRZSA-N 292.276 2.348 10 10 CECE CNCc1ccc(N2CC=C(COC)CC2)c(F)c1 723203626 JFWNGBDKWOWFJZ-UHFFFAOYSA-N 264.344 2.328 10 10 CECE COCCCOC1CN(Cc2cc(C)c(C)cc2O)C1 839134673 SIFRVBHETCWFJK-UHFFFAOYSA-N 279.380 2.246 10 10 CECE C[C@H](CCO)CNC/C=C/c1ccc(N(C)C)cc1 835042204 HECYUMBQMZKKEY-ISZGNANSSA-N 262.397 2.374 10 10 CECE Cc1cccc(CN2CC[C@@H](Nc3ncccn3)C2)c1O 843414958 PBCJMZPKQUSRRI-CQSZACIVSA-N 284.363 2.177 10 10 CECE CN(C)C1CC(NCc2c(O)ccc(Cl)c2F)C1 848558693 SRXCIZHKGVRAOE-UHFFFAOYSA-N 272.751 2.367 10 10 CECE COC[C@@H](O)CN[C@H](C)c1ccc(Cl)c(Cl)c1O 756589559 MGNVKELTJZUHIL-SFYZADRCSA-N 294.178 2.357 10 10 CECE COC[C@H](N[C@@H]1CCc2cccc(O)c21)C1CCOCC1 850493877 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399082952 OXPBYYOPVFRFHG-ZMSDIMECSA-N 274.408 2.312 10 10 CECE COc1ccc([C@H](C)N[C@H]2CCCOC2)c(O)c1 103960283 BGFPDRAMCWVBJF-QWRGUYRKSA-N 251.326 2.230 10 10 CECE Oc1cccc(Br)c1CN[C@@H]1CCCOC1 706868364 KCZFONAXSIXZSO-SECBINFHSA-N 286.169 2.423 10 10 CECE CCNCc1ccc(N2C[C@H](CO)CC[C@@H]2C)cc1 708467620 FMPNHJJGSSIHNC-DZGCQCFKSA-N 262.397 2.393 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@](O)(C(C)C)C1 710208108 RRKMLXTZHVTKQU-MRXNPFEDSA-N 262.397 2.441 10 10 CECE COCCCN(CCOC)c1ccc(CN)cc1Cl 62793059 XAKNRZLUOSGRIW-UHFFFAOYSA-N 286.803 2.288 10 10 CECE CN(C[C@@]12COC[C@H]1C2)c1ccc(CO)cc1Cl 689308068 SAQQSLZWYWCFBU-RISCZKNCSA-N 267.756 2.305 10 10 CECE CNCc1ccc(N2CCSC[C@@H]2CCO)c(C)c1 689869168 AYRPDBTXLGIILA-AWEZNQCLSA-N 280.437 2.019 10 10 CECE O=S(=O)(CCCC1CC1)Nc1ccc(O)cc1F 714972926 QJXXIUNYNLKBHR-UHFFFAOYSA-N 273.329 2.463 10 10 CECE C[C@H](O)c1ccc(N2CC([C@H](C)O)C2)cc1Cl 719861012 OZAVJKIEKMTEIU-IUCAKERBSA-N 255.745 2.210 10 10 CECE CCc1cccc(CNCC(=O)N2CCCCC2)c1O 691459365 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Cc1cc(N2C(=O)[C@H](C)C[C@@H](C)C2=O)c(C)cc1N 2120249869 BUTRLXNYIHODFO-GHMZBOCLSA-N 260.337 2.421 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)[C@@H]2CCCC[C@H]2F)CC1 2118935286 DAVMKSIBXRAKPP-NXEZZACHSA-N 290.364 2.277 10 10 CECE Nc1ccc(NC(=O)CCOC2CC(CF)C2)cc1 2119203274 XIOKJHQMESGONN-UHFFFAOYSA-N 266.316 2.362 10 10 CECE COc1ccc([C@H](C)N[C@H]2C=C[C@H](OC)C2)c(O)c1 2119389867 HJAKCGVADPLOJG-SRVKXCTJSA-N 263.337 2.395 10 10 CECE C[C@](O)(c1cncc(Cl)c1)[C@H](N)c1ccccc1O 2119318601 DIGMSKJTLCMENO-KGLIPLIRSA-N 278.739 2.348 10 10 CECE Nc1ccc(CCOCc2n[nH]c3c2CCC3)cc1 2119738250 HGIFVECWASSOQT-UHFFFAOYSA-N 257.337 2.240 10 10 CECE Nc1ccc(CCOCCOC[C@@H]2CCCO2)cc1 2119738116 FCGYBEXZQNJJIH-HNNXBMFYSA-N 265.353 2.024 10 10 CECE CSc1ncc(CNCc2nnccc2C)s1 2248645027 DIIHZSMEQZIQQY-UHFFFAOYSA-N 266.395 2.253 10 10 CECE C[C@H]1CN(C)CCN(c2cc(Cl)c(CN)cc2F)C1 2120880102 VHGXUTNEDJXJLH-JTQLQIEISA-N 285.794 2.326 10 10 CECE C[C@H](O)c1ccc(N(C)C[C@@H]2CCO[C@@H]2C)cc1O 2121144117 UNHBBTABIMSSLF-TUAOUCFPSA-N 265.353 2.307 10 10 CECE Cc1nc(N(C)Cc2ccc(N)cc2)n2c1CCC2 2121543233 KJLCGQGKXFIHLQ-UHFFFAOYSA-N 256.353 2.356 10 10 CECE CC(C)[C@@H](C(=O)O)[S@@](=O)CCCc1ccc(N)cc1 2122977799 YYJKYKKAVZYZCA-DJJJIMSYSA-N 283.393 2.059 10 10 CECE C[C@H]1CCCC[C@@H]1NC(=O)c1cc(O)c(O)c(O)c1 1865875989 LIVZVVFLYSGBES-WPRPVWTQSA-N 265.309 2.112 10 10 CECE COc1cc2c(c(OC)c1)N(C)CC[C@H](CC(=O)O)C2 212321123 ZGXNOALJKAZYOM-JTQLQIEISA-N 279.336 2.177 10 10 CECE C[C@H](CNC(=O)Cc1ccc(O)c(O)c1)CC(F)F 1557164716 MLDGTOCRDCLRSV-QMMMGPOBSA-N 273.279 2.048 10 10 CECE CCN(CC)C1CN(c2ccc(C=CC(=O)O)cc2)C1 1911789562 DSKQAVFQUFGRIS-UHFFFAOYSA-N 274.364 2.315 10 10 CECE CCOC(=O)[C@](C)(NCCN=[N+]=[N-])C1CCSCC1 1912196536 WDMBMGQKPJNDSL-GFCCVEGCSA-N 286.401 2.351 10 10 CECE CN(CCN=[N+]=[N-])C(=O)c1cc2ccccc2c(O)n1 1912157267 QMUHATZOZQKBFZ-UHFFFAOYSA-N 271.280 2.323 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1ccc(O)cc1Cl 1912171793 AHFCTDJYGZWTRC-VIFPVBQESA-N 270.676 2.071 10 10 CECE CCc1onc(C)c1C(=O)N1CCC[C@@H](N=[N+]=[N-])C1 1912167479 LDQSSWQTWYZRJA-SECBINFHSA-N 263.301 2.460 10 10 CECE C[C@@H]1CC(C(=O)N2CC[C@@H](N=[N+]=[N-])C2)C[C@@H](C)O1 1912155302 PMUJKJIKSINJRF-FXPVBKGRSA-N 252.318 2.101 10 10 CECE COc1cc(CN2CCC[C@H](N=[N+]=[N-])C2)sn1 1912196852 NDMKUJOXNMLVFS-QMMMGPOBSA-N 253.331 2.426 10 10 CECE CCN(CC)C[C@@H](O)CN1CCCC[C@@H](CN=[N+]=[N-])C1 1912147767 ZBHBNKRYQHMFCD-UONOGXRCSA-N 283.420 2.102 10 10 CECE CN(CCCN=[N+]=[N-])C(=O)[C@H]1Cc2ccccc2CO1 1912172111 RFXGWIKMSJEOGV-CYBMUJFWSA-N 274.324 2.287 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)c2c(O)cccc2F)CC1 1912208621 VDRBIIJVIURZFX-UHFFFAOYSA-N 264.260 2.446 10 10 CECE Cn1cncc1C(=O)NCc1c(O)ccc2ccccc12 1647791778 UAFVVDVRBOVNOB-UHFFFAOYSA-N 281.315 2.209 10 10 CECE CC1(C)CN(Cc2ccc(Cl)cc2O)C[C@@H]1CN 1913100203 WIENYMFFOSQUBO-NSHDSACASA-N 268.788 2.462 10 10 CECE CCNCc1ccc(N2CCC=C[C@H]2CO)c(F)c1 2125950236 UZQZTVYSCAFNTB-ZDUSSCGKSA-N 264.344 2.062 10 10 CECE Cc1c(CN(C)CC2CNC2)n(C)c2ccccc12 1914345230 CTWTYUJAMAGWFO-UHFFFAOYSA-N 257.381 2.138 10 10 CECE Cc1cc(CN(C)c2ccc([C@@H](C)O)cc2)nn1C 2126781591 HNTNXWNSBVNEJV-GFCCVEGCSA-N 259.353 2.418 10 10 CECE N[C@]1(c2ccc(N3CCCC3)cc2)COC2CC1C2 2126726023 IQSFOEOTLLWZSQ-BCLQGDPASA-N 258.365 2.250 10 10 CECE CN1CC[C@@H]2[C@@H]1CCCN2Cc1c(O)cccc1F 2127355094 URUWQSVVPGMCBL-UONOGXRCSA-N 264.344 2.200 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H]1CCS(=O)(=O)C1 250977678 JFNJBBNIQHBKLV-GRYCIOLGSA-N 295.404 2.026 10 10 CECE CCOCC1CN(c2ccc3c(c2)CCC[C@H]3N)C1 2128279262 NTRXVANUWXJCQS-MRXNPFEDSA-N 260.381 2.495 10 10 CECE OC[C@H]1CCCCN1c1ccc2c(c1)CCC[C@@H]2O 2128268424 GPGQOKSXBAVLJO-ZBFHGGJFSA-N 261.365 2.408 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])C1CC2(CC2)C1 2128022148 LEFDTWFIXSLZPO-GFCCVEGCSA-N 266.345 2.398 10 10 CECE CN(Cc1ncno1)c1ccc2c(c1)CCC[C@H]2O 2128273884 MRWWAAOSDVUCKG-CYBMUJFWSA-N 259.309 2.076 10 10 CECE N[C@@H]1CCc2cc(N3CC[C@@]4(CCOC4)C3)ccc21 2128315821 WTYMDIJSODXORE-HZPDHXFCSA-N 258.365 2.249 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@H](COC)C3)ccc21 2128314206 CPEJQCIYGGAXEG-LRDDRELGSA-N 260.381 2.366 10 10 CECE CCN1CCO[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)C1 165250193 YWTNHINRJWXJJC-WMLDXEAASA-N 291.439 2.124 10 10 CECE Oc1ccc(F)cc1CN1CC[C@@H]2CCOC[C@@H]2C1 2129000029 XRBUPHGVMAQXCJ-YPMHNXCESA-N 265.328 2.390 10 10 CECE COCc1nocc1CNCc1cc(Cl)ccc1O 1967679711 JCAFRTWQSQRQQM-UHFFFAOYSA-N 282.727 2.470 10 10 CECE CN(C)[C@H]1C[C@@H](CN[C@H]2CCc3cccc(O)c32)C1 848558329 OSCPPNPPFODKLT-YUTCNCBUSA-N 260.381 2.309 10 10 CECE NC(=O)CN(Cc1ccc(Cl)cc1O)C1CCCC1 1659092863 YNRDCHKPFJKUSS-UHFFFAOYSA-N 282.771 2.276 10 10 CECE NCc1ccc(N2CCOCC23CC3)cc1Br 1915574641 QDKROHBMRAIZIW-UHFFFAOYSA-N 297.196 2.277 10 10 CECE CC[C@@]1(C)CN(c2ccc(CN)c(OC)c2)CCO1 2139696932 OEKDSQVGDCPFEJ-HNNXBMFYSA-N 264.369 2.159 10 10 CECE CC[C@H]1CCN(c2ccc(CN)c(OC)c2)CCO1 2139699465 WILYJHDPBMLKPF-AWEZNQCLSA-N 264.369 2.159 10 10 CECE Cc1ccc(CN2CC[C@H]3CCNC[C@@H]3C2)c(O)c1 2139755998 NCJRKPQBKBZZOH-UKRRQHHQSA-N 260.381 2.132 10 10 CECE OCCCC1(NCc2ccc3c(c2)CCCO3)CC1 1967719979 LHRIGHQJGROVKX-UHFFFAOYSA-N 261.365 2.406 10 10 CECE CO[C@@H](CNCc1cccc(C)c1O)[C@H]1CCCOC1 1967746832 NMHBYTZEUQCCRN-GJZGRUSLSA-N 279.380 2.232 10 10 CECE COc1cc(N2CC[C@H](C)O[C@H](C)C2)ccc1CO 2139700146 GFZZYGJKKWTLEP-NWDGAFQWSA-N 265.353 2.191 10 10 CECE COC[C@]1(C)CCCN1c1ccc(CN)c(F)c1F 2139818739 ZAVMEKFMZNKXJM-AWEZNQCLSA-N 270.323 2.429 10 10 CECE Oc1cc(F)ccc1CNc1cnc2nccn2c1 2139876172 OTWBDPWKRDKBNT-UHFFFAOYSA-N 258.256 2.186 10 10 CECE Cc1ncnc(CN(C)c2ccc(CO)cc2)c1C 2141572309 LFVGVAHUIHKFBL-UHFFFAOYSA-N 257.337 2.222 10 10 CECE COc1ccc(O)c(CN[C@@H]2C[C@@H]3CCCCN3C2)c1 1969659967 IZOMUPZDIMBWTL-KGLIPLIRSA-N 276.380 2.117 10 10 CECE CCC(CC)(CC(=O)NCc1ccccc1O)C(=O)O 228402108 PKWOVNCXAYNJPC-UHFFFAOYSA-N 279.336 2.290 10 10 CECE CNCCc1ccccc1C(=O)N(C)c1cccnc1 228504638 NKVDQHQJQFDNBB-UHFFFAOYSA-N 269.348 2.120 10 10 CECE CC(C)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(F)cc1O 228979028 ZEAWCSYNDLRYBV-WDEREUQCSA-N 282.359 2.343 10 10 CECE COc1cccc(CN[C@H](CO)CC2CCCC2)c1O 1926795147 YFZYDPMIBVVHLS-AWEZNQCLSA-N 279.380 2.432 10 10 CECE CN[C@@H](c1ccc2c(c1)CCN2C)[C@]12C[C@H](CO1)C2 2140265594 FJJXQELFEFMSPG-KNXALSJPSA-N 258.365 2.118 10 10 CECE C[C@@H](NCCONC(=O)OC(C)(C)C)c1ccccc1O 1928415565 VRZMGTRJNQQSLX-LLVKDONJSA-N 296.367 2.499 10 10 CECE CC(C)(C)OC(=O)NCC[C@H](N)c1ccccc1O 1928473405 AWBJAQCCVLDQII-NSHDSACASA-N 266.341 2.307 10 10 CECE CCCNCc1ccc(N2C[C@H]3C[C@H]2[C@H]3CO)cc1 2138373600 MFJGSVPPOQXTPP-KBMXLJTQSA-N 260.381 2.003 10 10 CECE CN[C@@H]1CN([C@@H](C)c2cc(C)ccc2O)CC12CC2 2140955220 PNZUSSUTKBOGBO-SWLSCSKDSA-N 260.381 2.445 10 10 CECE CCNCc1cc(F)c(N(C)C2(C)COC2)c(F)c1 2143198253 ARDWTLSGCNIAPX-UHFFFAOYSA-N 270.323 2.299 10 10 CECE CNCc1ccc(N2CC[C@]2(C)CO)cc1Cl 1947976373 KGYVEQISLRFCRS-CYBMUJFWSA-N 254.761 2.021 10 10 CECE COc1cc2c(cc1OC)N(C[C@H]1CCN(C)C1)CC2 2143445760 MSWCPLJYZUUCRJ-LBPRGKRZSA-N 276.380 2.018 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2CCSC2)CC1 1949750234 ZOUWTVUYPFXZTQ-NXEZZACHSA-N 254.359 2.431 10 10 CECE C[C@H](O)c1ccc(N2CCCC[C@H]2C(=O)N(C)C)cc1 2143664627 OYQWYXONNJBRIY-WFASDCNBSA-N 276.380 2.187 10 10 CECE C[C@@H]1c2ccccc2C[C@@]1(O)[C@H](N)c1ccccc1O 2148150840 FPXFWZVAVMXAOD-LQAWEQHXSA-N 269.344 2.483 10 10 CECE COC[C@H](NCc1cccc(F)c1O)C(F)(F)F 1973151559 LVTDVHCJTQHZQG-VIFPVBQESA-N 267.222 2.198 10 10 CECE O=C(O)[C@H]1CCN(Cc2cc(F)cc(F)c2O)C12CC2 1974100947 QIGCYWXTEBIQEZ-SNVBAGLBSA-N 283.274 2.110 10 10 CECE COc1ccc(O)c(CNCC[C@H]2C[C@@H](OC)C2)c1 1974342050 UGPBRFBKPUVBEN-VDISTLRHSA-N 265.353 2.306 10 10 CECE C[C@H]1[C@H](COc2ccc(N3CCNCC3)cc2)C1(F)F 2151823034 OAOLOMITEWRPJL-FZMZJTMJSA-N 282.334 2.376 10 10 CECE COC(=O)C(C)(C)n1cnc(-c2ccc(C)n2C)c1 260136848 VMPNCQYMZZJOEJ-UHFFFAOYSA-N 261.325 2.105 10 10 CECE C[C@H]1CN(Cc2cc3c(cc2O)OCO3)[C@H](C)CCO1 2148892236 XEOKVXXJAAYFBE-MNOVXSKESA-N 279.336 2.120 10 10 CECE COC(=O)CCCc1cc(F)cc(CN(C)C)c1O 260770598 TZTJENBWVCVHOV-UHFFFAOYSA-N 269.316 2.089 10 10 CECE CCN(Cc1ccc(N)cc1)[C@@H](C)C(=O)NC(C)(C)C 35364068 ILLAFWCYJJQPSU-LBPRGKRZSA-N 277.412 2.394 10 10 CECE O=c1c2c(ccn1CCCc1ccccc1)CCNC2 2150794727 BJMGLNSAGQGBII-UHFFFAOYSA-N 268.360 2.127 10 10 CECE O=c1c2c(ccn1C[C@@H]1CC3CCC1CC3)CCNC2 2150796620 AHZAPFQTXWACPR-PIMMBPRGSA-N 272.392 2.320 10 10 CECE Cc1oncc1CCNCc1ccc2c(c1)CCN2C 2146003846 NRFTVMRLILIMMS-UHFFFAOYSA-N 271.364 2.308 10 10 CECE CC[C@H](C)N(CC)C[C@H](O)COc1ccc(N)cc1 37112162 GKZPNCXZGFBYAL-JSGCOSHPSA-N 266.385 2.129 10 10 CECE CCNCc1ccc(N2C[C@@H]3CCC[C@H](O)[C@H]3C2)cc1 2150926625 JUHFZGALFSNJRX-XIRDDKMYSA-N 274.408 2.393 10 10 CECE Nc1ccc(N2C(=O)CC3(CCCC3)CC2=O)cc1 40223588 QTCGTBMRWWOPIZ-UHFFFAOYSA-N 258.321 2.483 10 10 CECE CN1CCCc2cc([C@H](O)C(=O)c3ccns3)ccc21 2147119412 YCQDKJOAKSYDQU-AWEZNQCLSA-N 288.372 2.442 10 10 CECE Cc1cc(CO)ccc1N1C[C@]23CCC[C@]2(COC3)C1 2153075900 XGICAHVYMOVVTG-CALCHBBNSA-N 273.376 2.494 10 10 CECE Oc1cccc(Cl)c1CNC[C@@H]1[C@H]2CCO[C@@H]12 2007576420 IECZKPUHCVOUSO-JRKPZEMJSA-N 253.729 2.170 10 10 CECE CCNCc1cnc(Sc2ncc(C)n2C)s1 2007876742 GNWJPKUNKFYQSA-UHFFFAOYSA-N 268.411 2.446 10 10 CECE CCOC(=O)[C@@]1(NCCN=[N+]=[N-])CCCO[C@]1(C)CC 2155094981 PMABEKOOYUHLJS-OLZOCXBDSA-N 284.360 2.167 10 10 CECE Oc1ccc(CN[C@@H](CF)C(F)(F)F)cc1O 2012901573 KQELWKGDWCDZFT-VIFPVBQESA-N 253.195 2.088 10 10 CECE CCNCc1ccc(N(C)Cc2cnnn2C)c(Cl)c1 2156478797 TZZVDUSDBBKRSS-UHFFFAOYSA-N 293.802 2.214 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)Cc1csc(N)n1 55272688 XLOUSWPIIVYNCI-VIFPVBQESA-N 291.376 2.193 10 10 CECE CCN[C@@](CO)(CSc1nccs1)CC1CC1 2026548701 FUJRLYPKSUZYJX-LBPRGKRZSA-N 272.439 2.376 10 10 CECE C[C@@H](O)c1ccc(N2CC[C@H](O)[C@@H](F)C2)c(Cl)c1 2027968244 CXKKEWGNDVBOAY-WLTAIBSBSA-N 273.735 2.302 10 10 CECE C[C@H]1CCOCCN1Cc1ccc(F)c(F)c1O 2031610466 POKPNPYFLRMUEB-VIFPVBQESA-N 257.280 2.281 10 10 CECE C[C@@]12CC[C@@H]1CCN2C(=O)CCOc1ccc(N)cc1 2157292505 DVMJDAWOBICVCR-MLGOLLRUSA-N 274.364 2.439 10 10 CECE C[C@@H](c1cc(F)ccc1O)N1CCNCC12CC2 2037218208 MRYXCYMEKSOELJ-JTQLQIEISA-N 250.317 2.030 10 10 CECE CCN1CCC[C@H](N[C@H](C)c2c(O)cccc2O)C1 300436088 DKKUPTRGOALWNG-NEPJUHHUSA-N 264.369 2.233 10 10 CECE COc1ccc(CN(C)[C@H]2CCCOC2)c(O)c1 401380903 AWQMNPMUFWDKBB-LBPRGKRZSA-N 251.326 2.012 10 10 CECE COc1ccc([C@H](C)N[C@@H]2CO[C@H](C)C2)c(O)c1 402259704 BQQGFOFSPXRNFX-VWYCJHECSA-N 251.326 2.229 10 10 CECE CC(=O)NCCN(C)[C@H](C)c1cc(Cl)ccc1O 308308296 POBCIUHNTVVPSN-SECBINFHSA-N 270.760 2.175 10 10 CECE C[C@@H]1C[C@H](CN(C)C(=O)CCc2ccc(N)cc2)CO1 2158027286 YWJDFEOPLIQJOT-TZMCWYRMSA-N 276.380 2.085 10 10 CECE C[C@@H]1CN([C@H](C)c2c(O)cccc2O)C[C@]1(C)CN 311766165 IXLAMSKRJMLVFU-HFAKWTLXSA-N 264.369 2.076 10 10 CECE COc1ccc(CNC[C@@]2(O)CCC[C@@H]2C)c(O)c1 328197470 RXVKYLPAJITGGE-NHYWBVRUSA-N 265.353 2.042 10 10 CECE CN[C@@H](C)c1ccc(N2CCOCCOCC2)c(Cl)c1 2159477454 DQWDUMOEOWEXBN-LBPRGKRZSA-N 298.814 2.474 10 10 CECE Cc1ccccc1OCC(=O)NCc1ccc(N)cc1 700552962 RUPMYCWVPKHIDM-UHFFFAOYSA-N 270.332 2.272 10 10 CECE CNCc1ccc(OC)c(CS[C@H]2CCOC2)c1 703102858 SGLQUXUBZFKCEL-ZDUSSCGKSA-N 267.394 2.437 10 10 CECE C[C@@H]1CN(Cc2ccc(F)c(F)c2O)C[C@@H]1N(C)C 703501958 MGRKGCBPXCSPRJ-SKDRFNHKSA-N 270.323 2.052 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@](C)(O)C1CSC1 2163144097 LFLLAVJQBSPHHT-CVEARBPZSA-N 292.448 2.053 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)c1cnc(C)n1C 2164030521 JUEBTMJPHFGNDJ-MRXNPFEDSA-N 270.380 2.030 10 10 CECE CC[C@@H]1C[C@H](NCc2ccc(OC)cc2O)CO1 711220639 UKTNMKBOMIAIQA-NWDGAFQWSA-N 251.326 2.058 10 10 CECE COc1cc(CN[C@@H](C)c2cc(C)ccc2O)nn1C 380001458 ANWALCBRHZAOPJ-NSHDSACASA-N 275.352 2.294 10 10 CECE C[C@H](N[C@@H]1C[C@@H]2C[C@]2(C(=O)O)C1)c1ccc(F)cc1O 713063947 VSHPANAVYSDTLH-GEYZGQBZSA-N 279.311 2.435 10 10 CECE CSC(C)(C)CN(C)c1ccc2c(c1)N(C)C(=O)[C@H]2N 713996713 PAWARSGXAQFHAF-ZDUSSCGKSA-N 293.436 2.241 10 10 CECE Nc1ccc(O)c(CN2C[C@H](O)C3(CCCCC3)C2)c1 2174366246 WHHJYAKOTTZVEI-HNNXBMFYSA-N 276.380 2.101 10 10 CECE Nc1ccc(OCC(=O)NCC[C@@H]2CC[C@@H]3C[C@@H]23)cc1 716950941 YFTVNWFCIYOXGT-ZOWXZIJZSA-N 274.364 2.200 10 10 CECE C[C@@H]1C[C@@H](N(C)C(=O)CCc2ccc(N)cc2)[C@@H](C)O1 384970705 TTYZIURUYYNFHR-LALPHHSUSA-N 276.380 2.226 10 10 CECE O=C(NCC[C@@H]1CC[C@@H]2C[C@@H]12)c1ccc(O)c(O)c1 717151856 DZXBNSFUFHYUJR-UMNHJUIQSA-N 261.321 2.264 10 10 CECE CC[C@@H]1CCOCC[C@H]1NC(=O)c1cccc(O)c1O 2165380611 DOYOGSKYDJZTQU-ZYHUDNBSSA-N 279.336 2.033 10 10 CECE CCNCc1ccc(N2C[C@@H](C)[C@@H](O)C2)cc1Cl 388139158 FWRSBBHWNXLLKH-YGRLFVJLSA-N 268.788 2.267 10 10 CECE CO[C@@H]1CCN(c2ccc([C@H](C)N)c(O)c2)[C@@H](C)C1 388220218 JXNDCGSOELUOHL-GMXVVIOVSA-N 264.369 2.416 10 10 CECE CCCN1CC[C@H](NCc2cccc(F)c2O)C1 389461536 SGIUFEVEVVHNMO-LBPRGKRZSA-N 252.333 2.105 10 10 CECE N=C(NO)c1cncc(CSc2nccs2)c1 721542355 YKRSRVCLQTYNPN-UHFFFAOYSA-N 266.351 2.135 10 10 CECE CC(=O)c1cc(Cl)cc(CN(C)[C@H]2CCN(C)C2)c1O 394237015 QHEHOKGWDQGMOE-ZDUSSCGKSA-N 296.798 2.384 10 10 CECE C[C@@H](N[C@H](C(=O)O)C1CCC1)c1ccc(F)cc1O 399195607 XSMDXXYKMGAUNJ-OQPBUACISA-N 267.300 2.435 10 10 CECE CN1CCc2cc([C@H](N)[C@H](O)C3(C)CC=CC3)ccc21 2166485510 JSPAXISWCJTHPO-HOTGVXAUSA-N 272.392 2.396 10 10 CECE CC[C@H]1CN(c2ccc(CNC3CC3)cc2F)C[C@@H]1O 399863715 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2.492 10 10 CECE NCc1ccc2c(c1)CCN2CCOC1CCCC1 2133392710 HNGTYUYPKQKGCL-UHFFFAOYSA-N 260.381 2.467 10 10 CECE CC(C)[C@]1(C)CCN1S(=O)(=O)Cc1ccc(N)cc1 2134699105 FFPFYWKVJKWOHF-AWEZNQCLSA-N 282.409 2.219 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H]2C(C)(C)O)cc1O 2134635078 RXQIGRMKUGLBHR-QMTHXVAHSA-N 264.369 2.022 10 10 CECE Nc1ccc(N2C(=O)[C@@H]3C4CCC(CC4)[C@H]3C2=O)cc1 1916067600 OOOVBEUHPJWMQN-TWZWYRAHSA-N 270.332 2.194 10 10 CECE C[C@H](N)[C@H]1CCCCN1[C@@H](C)c1ccc(O)cc1O 221193900 TUABCKSLILWYKW-COPLHBTASA-N 264.369 2.361 10 10 CECE CC(=O)C(=O)[C@H](O)c1cccc(NC(=O)OC(C)(C)C)c1 1919284103 FYRBWSQZSAKEOG-CYBMUJFWSA-N 293.319 2.225 10 10 CECE NC1(c2noc(C3=S=Nc4ccccc43)n2)CCCC1 1967913796 SGNRUEBXJKIWGM-UHFFFAOYSA-N 286.360 2.278 10 10 CECE Cc1ccc(CN2CC[C@@H](CC(=O)O)[C@@H]2C)c(O)c1 2139772513 PVWMTPXAEARLEJ-RYUDHWBXSA-N 263.337 2.386 10 10 CECE CC1(C)CN(Cc2ccc(F)cc2O)[C@H]2COC[C@H]21 2139787953 FPJKAKVLQDVQRK-OLZOCXBDSA-N 265.328 2.388 10 10 CECE OCCOCCCNCc1c(O)ccc2ccccc12 227335049 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2281173354 LGJBYBBDZJIAII-UHFFFAOYSA-N 272.304 2.292 10 10 CECE Nc1ccc(CS(=O)(=O)C[C@@H]2CC23CCC3)cc1 2254044449 DUWQOIRRHIYYGB-LBPRGKRZSA-N 265.378 2.374 10 10 CECE CN[C@@H](C)c1cnc(SC[C@@]2(OC)CCOC2)s1 2257675044 UBUPKSABOPIQEQ-JOYOIKCWSA-N 288.438 2.321 10 10 CECE CN[C@H](CSc1nccs1)c1cn(C)nc1C 2249740531 HQNTVAQYNGYKRF-SNVBAGLBSA-N 268.411 2.238 10 10 CECE O[C@@H]1C[C@@H]2CN(c3ccc(OCF)cc3)CC[C@H]21 2263848904 HMAVLPIRMXGKEI-LERXQTSPSA-N 251.301 2.200 10 10 CECE Cc1cc(N2CC[C@@H](N3CCC3)C2)ccc1[C@@H](C)O 2269682571 ZLQUFSDARWGBSO-UKRRQHHQSA-N 260.381 2.333 10 10 CECE N[C@@H]1CCN(Cc2cc(F)ccc2O)[C@@H](C(F)(F)F)C1 2281050286 IIUMGFGBEJIKEM-ZYHUDNBSSA-N 292.276 2.385 10 10 CECE C[C@H](NCc1ccc(N2CCNCC2)cc1)C1(C)CC1 2286065529 KFLSDEFFKVUPJT-AWEZNQCLSA-N 273.424 2.374 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@@H]3C[C@H](C2)[C@]3(C)O)cc1C 2286236517 GMZPXUPVMIUDDI-SZOQZIPDSA-N 274.408 2.483 10 10 CECE Nc1ccc(CCNCCN2CCC3(CC2)CC3)cc1 2287119724 MDYFYSUUKLDTKK-UHFFFAOYSA-N 273.424 2.277 10 10 CECE CC1=NN2C(=N)C(=Cc3ccsc3)C(=O)N=C2S1 2297499845 ACHNCMJEUMKVME-UHFFFAOYSA-N 276.346 2.387 10 10 CECE C[C@@H](O)c1ccc(N(C)C[C@@H]2C[C@H]2CF)cc1O 2310934959 IHYDZBORVHQLRE-VWYCJHECSA-N 253.317 2.487 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1C[C@H]1CC 2311447032 UOVMIGMIHLTTJN-MXWKQRLJSA-N 254.334 2.254 10 10 CECE CCN[C@](CSc1nccs1)(C(=O)O)[C@H]1C[C@H]1C 2327830786 ZNOCQCDCLJEBJM-PTRXPTGYSA-N 286.422 2.324 10 10 CECE C[C@@H](N[C@H](C)[C@@H]1C[C@H]1C(=O)O)c1cc(F)ccc1O 2330598014 PUUCWDFACQZANE-CUKVJPMHSA-N 267.300 2.291 10 10 CECE C[C@@]1(O)C[C@@H]2C[C@H]1C[C@H]2NCc1c(O)cccc1F 2330923714 UKUSFXDGIONOKA-UOJCWERNSA-N 265.328 2.170 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCC2CC1(CO)C2 2336460013 DPFVZSUYZCSUNF-VEAWUBTESA-N 260.381 2.366 10 10 CECE CN(C)CCCN(C)c1ccc(CN)c(C2CC2)c1 2339144138 UFGNYHFWZNSBGN-UHFFFAOYSA-N 261.413 2.411 10 10 CECE CCNCc1ccc(N(C)CCCO)cc1C1CC1 2339144320 VXXLSNZXZKHZFH-UHFFFAOYSA-N 262.397 2.492 10 10 CECE CC[C@@H]1[C@@H](O)CCN1c1ccc(CO)c(C2CC2)c1 2339148225 QTTJCNCBJVNTCZ-CVEARBPZSA-N 261.365 2.406 10 10 CECE NCC12CC(CCN1c1ccc3c(c1)CCCO3)C2 2340422879 YBNAOWYAFIHLMW-UHFFFAOYSA-N 258.365 2.329 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)N)c(C)c2C)C[C@@H]1F 2340861548 LEHHAFUBIHWCLZ-CORIIIEPSA-N 266.360 2.496 10 10 CECE CN(C)[C@@H]1C[C@H]2C[C@H]1CN2c1ccc(CN)c(Cl)c1 2341116163 HALAGCJCNWPLGW-NJZAAPMLSA-N 279.815 2.328 10 10 CECE CN(C)[C@@H]1C[C@H]2C[C@@H]1CN2Cc1ccc(F)cc1O 2341134271 LPHPWYMCJDPVHW-MRVWCRGKSA-N 264.344 2.056 10 10 CECE Cc1ncsc1CN1CCc2cc(O)c(O)cc2C1 2341206736 LGOVRANFQRRFDU-UHFFFAOYSA-N 276.361 2.421 10 10 CECE CC1(C)C[C@H](CN2CCC[C@@H]2CN=[N+]=[N-])OC(=O)N1 2343113168 LKVQZAYNWCUYNC-NXEZZACHSA-N 267.333 2.038 10 10 CECE Oc1cccc2c1[C@@H](NC[C@@H]1C[C@@H]3O[C@H]1[C@H]1C[C@@H]31)CC2 2353917113 BZXKIOQOJPFZRM-IGSAJFDYSA-N 271.360 2.393 10 10 CECE CN1CCc2cc([C@@H](O)[C@]34CCC[C@H]3CNC4)ccc21 2354608637 GBUORKDPRTXMMZ-UAGQMJEPSA-N 272.392 2.102 10 10 CECE Oc1cc2c(cc1CN[C@@H]1C[C@@H]3C[C@H]1[C@H]1C[C@@H]31)OCO2 2355284934 SZQSCGWLGFHJBN-DUIQVVMOSA-N 273.332 2.255 10 10 CECE COCCN=NNc1cc([N+](=O)[O-])ccc1OC 1860492227 JUAQBSUJHCGVIK-UHFFFAOYSA-N 254.246 2.029 10 10 CECE CCC[C@@H](CC)NC(=O)COc1ccc(N)cc1 50399071 WTSPIGYGAATUTO-GFCCVEGCSA-N 250.342 2.343 10 10 CECE CC(=O)NCCN=NNc1ccc(Br)cc1 1860494484 IMZYBILTKHTRDO-UHFFFAOYSA-N 285.145 2.364 10 10 CECE COc1ccc(N(C)C2C[C@@H]3CC[C@@H](C2)N3)c([N+](=O)[O-])c1 103994842 SGBLEIVGGQZCRV-QWRGUYRKSA-N 291.351 2.323 10 10 CECE C[C@@H](NCCO)c1ccc(N2CCCC2)c(F)c1 20550907 SFEUDGHWDNXNIL-LLVKDONJSA-N 252.333 2.069 10 10 CECE CN[C@H](c1ccccc1O)[C@]1(O)C[C@H]2[C@H]3CC[C@H](C3)[C@H]21 2357251913 ZFPLLKSZORCADQ-HJKKPCNESA-N 273.376 2.450 10 10 CECE COCCNCc1ccc(N(C)C[C@@H]2CCCO2)c(C)c1 62737048 ATGGEDGTFCKGRL-INIZCTEOSA-N 292.423 2.346 10 10 CECE CC(C)C[C@H](C)C(=O)NCc1ccc(O)c(O)c1 184881874 RQSMIVBXJMUTFN-JTQLQIEISA-N 251.326 2.396 10 10 CECE C[C@H]1C[C@@H](CN)CN1Cc1c(O)cccc1Cl 216027459 OYDGQIBPHNCGQM-UWVGGRQHSA-N 254.761 2.215 10 10 CECE CC1(C)[C@@H]2C(=O)N(c3ccc(N)c(Cl)c3)C(=O)[C@H]21 211515754 SNOSWLYBANGTKG-UWVGGRQHSA-N 264.712 2.068 10 10 CECE C[C@H]1OCC[C@H]1NCc1cc(Br)ccc1O 127310651 QAMOOMGIVXKVOX-LDYMZIIASA-N 286.169 2.422 10 10 CECE Cn1cc([C@@H]2CCN(Cc3cc(F)ccc3O)C2)cn1 180175647 KOZXXJKGCKGVKJ-LLVKDONJSA-N 275.327 2.254 10 10 CECE Cc1cccnc1/C=C/C(=O)NCc1ccc(O)c(O)c1 183978127 QYEIAQIYALIUTA-FNORWQNLSA-N 284.315 2.131 10 10 CECE C[C@@H](C[C@@H](C)O)NC(=O)/C=C/c1ccc(N(C)C)cc1 228175627 GVTVLFXICNGAKF-APIKWLIHSA-N 276.380 2.041 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@@H](CO)C2)c(Cl)c1 226455239 OZPWMWJDDWFZHO-GHMZBOCLSA-N 268.788 2.439 10 10 CECE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC[C@H]1N 85368068 OODVWDRXWMMMDS-HZPDHXFCSA-N 289.423 2.229 10 10 CECE CCN1CN(Cc2ccc(N(CC)CC)cc2)CC1=O 191847943 ONHQTUOSNVJNDD-UHFFFAOYSA-N 275.396 2.154 10 10 CECE CCC1C[C@H]2C(=O)N(c3ccc(N)cc3OC)C(=O)[C@@H]2C1 229873151 UKJRNTGJSWHGJF-VXGBXAGGSA-N 288.347 2.203 10 10 CECE CC(C)(C)c1cc(Br)c(O)c([C@@H](N)CN)c1 95770053 GBERBUOUHWVLEV-JTQLQIEISA-N 287.201 2.411 10 10 CECE C[C@H](N)c1ccc(N2CCOC(C)(C)C2)cc1O 93670555 HTMWUJLNOMETBU-JTQLQIEISA-N 250.342 2.027 10 10 CECE COc1ccc(Br)c([C@@H](N)CF)c1O 238432328 YRWZGKDITSWIAI-LURJTMIESA-N 264.094 2.133 10 10 CECE COc1cc(C(C)(C)N)c(O)c(Br)c1OC 258564145 OKDAHKYHSPMTHO-UHFFFAOYSA-N 290.157 2.366 10 10 CECE C[C@H](N[C@@H](C)[C@H]1CCCO1)c1ccc(O)cc1O 251515184 JJIHQFBGCMKOGY-PKFCDNJMSA-N 251.326 2.316 10 10 CECE C[C@H](N)[C@H]1c2c(c(F)cc3ccn(C)c23)CCN1C 606596443 BLCSJMDDGQNCKZ-XPTSAGLGSA-N 261.344 2.194 10 10 CECE COc1ccncc1C(=O)CCc1ccc(N)cc1 388438417 VMQTVZHOQWTHAL-UHFFFAOYSA-N 256.305 2.488 10 10 CECE COC(=O)c1cccc(N)c1N[C@@H]1CCCC[C@H]1CO 2165030561 HKUPSTLUNLHVBH-GXFFZTMASA-N 278.352 2.018 10 10 CECE CC[C@@H]1CCOCC[C@H]1NCCc1ccc(O)c(O)c1 2165358531 TUBIRVKPXTYETK-ZIAGYGMSSA-N 279.380 2.435 10 10 CECE CCO[C@H]1C[C@@H](OC)CN(c2ccc(CO)cc2C)C1 2165440009 FZTGNOHVBZKYHH-CABCVRRESA-N 279.380 2.118 10 10 CECE CC[C@H](N)[C@](O)(c1ccc2c(c1)CCN2C)C(F)(F)F 2163072738 ZGTDXWDISXEXIY-QWHCGFSZSA-N 288.313 2.166 10 10 CECE CCN1CCc2cc([C@]3(O)CNCC4(CC4)C3)ccc21 2163074748 VVAZHQSJIYJRRW-QGZVFWFLSA-N 272.392 2.030 10 10 CECE C[C@@](O)(c1ccc(N2CCCC2)cc1)[C@@H]1[C@H]2CN[C@H]1C2 2163108926 ZPTSIZSZHFELEF-VJUNAUMWSA-N 272.392 2.102 10 10 CECE COC[C@H](C)[C@@H](NN)c1ccc(N2CCCCC2)cc1 2163142870 IQEPOUGGIUWZHC-XJKSGUPXSA-N 277.412 2.464 10 10 CECE CO[C@H](C)[C@](C)(O)[C@@H](N)c1ccc(N2CCCC2)cc1 2163228867 IQPFCYQZAXTMAH-KCXAZCMYSA-N 278.396 2.073 10 10 CECE C[C@@H](NCC1(CN(C)C)CCC1)c1cc(O)ccc1O 2163649134 JHVOQAIISQTCOR-GFCCVEGCSA-N 278.396 2.480 10 10 CECE CCN1CCc2cc([C@@H](N)[C@H]3CC(C)(C)CN3)ccc21 2164050402 ZRLMPHSSJCZKKZ-GDBMZVCRSA-N 273.424 2.457 10 10 CECE CN[C@H](C)c1ccc(N(C)CC(=O)NCC(C)C)cc1 723181783 HFDIZNRBNSTAFM-CYBMUJFWSA-N 277.412 2.175 10 10 CECE COC(=O)c1sc2cc(/C=C\C(=O)O)ccc2c1O 725430462 DVUAAQGDSRWUTN-HYXAFXHYSA-N 278.285 2.491 10 10 CECE COC(=O)[C@H]1CCN(Cc2cc(Cl)c(C)cc2O)C1 824576085 ZVEUOCPUKIHGIB-JTQLQIEISA-N 283.755 2.349 10 10 CECE Oc1c(F)cc(Cl)cc1CN1CC[C@](O)(C(F)F)C1 824725940 AJRGTJJTONKCDG-GFCCVEGCSA-N 295.688 2.387 10 10 CECE Cc1cc(N(C)C)ccc1CN1CC[C@H](O)C(F)(F)C1 826952417 KLHFDQVZRPVWJA-AWEZNQCLSA-N 284.350 2.263 10 10 CECE CSCCCNC(=S)NCc1c(O)cccc1F 905661693 PEGPEAILHPNAID-UHFFFAOYSA-N 288.413 2.249 10 10 CECE Cc1nc(C2CC2)oc1C(=O)NCc1ccc(O)cc1O 910949343 JTUDAYDAPOFNBG-UHFFFAOYSA-N 288.303 2.202 10 10 CECE COCC[C@H](COC)NCc1ccc(N(C)C)cc1C 840948718 WXWRKEREFPFOPU-OAHLLOKOSA-N 280.412 2.202 10 10 CECE CN(C)c1ccc(/C=C/CN[C@H](CO)CCF)cc1 846095539 AZCJWYMMSXNCJD-XGACYXMMSA-N 266.360 2.076 10 10 CECE COc1ccc(O)c(CN2CC(CO)(c3ccccc3)C2)c1 840970909 XRYHVOXNTTXMRI-UHFFFAOYSA-N 299.370 2.147 10 10 CECE CCC[C@H]1C(=O)NCCN1Cc1c(O)cc(C)cc1Cl 840917344 SQGBMYVRAZQRLI-ZDUSSCGKSA-N 296.798 2.455 10 10 CECE Cc1cc(O)c(CNCC(C)(C)[C@@]2(O)CCOC2)cc1C 842758220 HBHKCLVBZPVFRX-QGZVFWFLSA-N 293.407 2.276 10 10 CECE Cc1cc(N(C)C)ccc1CN1CCNC[C@@](C)(F)C1 843125262 QCDUTWJWKMUBHM-MRXNPFEDSA-N 279.403 2.194 10 10 CECE CCn1ncnc1CNCc1c(O)cc(C)cc1Cl 840941319 UNLXUBDDPTWHCH-UHFFFAOYSA-N 280.759 2.255 10 10 CECE CC[C@H](C)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 855232782 UOVDGWKGQVOCSJ-STQMWFEESA-N 276.380 2.436 10 10 CECE CC(C)(CO)CCCNC(=O)NCc1c(O)cccc1F 920217169 MMRQPIQGRITUJZ-UHFFFAOYSA-N 298.358 2.129 10 10 CECE C[C@H](N[C@H](C)c1nccn1C)c1cc([N+](=O)[O-])ccc1O 850571844 CCAWWVAALRPSBS-VHSXEESVSA-N 290.323 2.446 10 10 CECE CCc1cccc(CN2C[C@H]3CCN(C)C[C@H]3C2)c1O 692090349 IZFZCHZOWMVNQG-ZBFHGGJFSA-N 274.408 2.338 10 10 CECE Cc1c(Sc2nccs2)ccnc1C(=N)N 2244982303 DKUOFYDMJYXQRH-UHFFFAOYSA-N 250.352 2.282 10 10 CECE CCOc1ccc(CN(C)C[C@H]2CCCO2)c(O)c1 761228959 PIZISMGKHIRMPH-CQSZACIVSA-N 265.353 2.402 10 10 CECE Cc1cccc(CN[C@@H]2[C@@H]3CCN[C@@H]3C2(C)C)c1O 1875715561 APZCYBUKUREKMA-VHDGCEQUSA-N 260.381 2.177 10 10 CECE CN(C)c1cc(F)c(CN2CCN(C3CC3)CC2)cc1F 862215921 FIOMNCILQGCDTN-UHFFFAOYSA-N 295.377 2.311 10 10 CECE Cc1ccc(C)n1-c1ccc(C(=O)O[C@@H]2CCNC2=O)cc1 769967621 QGZUHBDFFUZPER-OAHLLOKOSA-N 298.342 2.139 10 10 CECE Nc1cccc(NC(=O)NCc2ccccc2O)c1 1876171932 SLQKSXMYPXPVFG-UHFFFAOYSA-N 257.293 2.296 10 10 CECE CC(C)(C)OC(=O)N[C@H]1C[C@H]1CNCc1ccc(N)cc1 1955969922 SYTZFUQEDJDFKK-JSGCOSHPSA-N 291.395 2.272 10 10 CECE CCOc1ccc(O)c(CNc2n[nH]c3c2COCC3)c1 886207555 GAFOEEDOZXPTGF-UHFFFAOYSA-N 289.335 2.199 10 10 CECE CC[C@@H](C[C@@H](C)O)NCc1cc(C)cc(OC)c1O 895463766 CSEBLSVMWYKGSP-YPMHNXCESA-N 267.369 2.348 10 10 CECE COc1ccc([C@H](C)NC[C@]23C[C@H](CO2)C3)c(O)c1 1879819256 LPBFBYYMDMHMAF-ZIBATOQPSA-N 263.337 2.230 10 10 CECE O[C@@H](CCNCc1ccc2c(c1)CCCO2)C(F)(F)F 894464872 HXTGULUJSNRYGW-ZDUSSCGKSA-N 289.297 2.415 10 10 CECE C[C@H]1CCN(c2c(F)cc([C@@H](C)N)cc2F)[C@@H]1CO 1880963580 XKACUYOBUWPEGN-IGJMFERPSA-N 270.323 2.192 10 10 CECE CC[C@]1(O)CCN(c2c(F)cc([C@@H](C)N)cc2F)C1 1880927528 KZIIGNDDQOICKO-OTYXRUKQSA-N 270.323 2.336 10 10 CECE COc1cc(O)c(CN2CC(C(C)C)C2)cc1OC 793188129 CNOVNMOEGGGQJN-UHFFFAOYSA-N 265.353 2.497 10 10 CECE CN[C@@H](C)c1ccc2c(c1)CCN2CC1(C)COC1 1898534999 SLFPWFGDFJBDHX-LBPRGKRZSA-N 260.381 2.366 10 10 CECE O=C(NCc1cccc(O)c1O)c1ccnc(Cl)c1 1153792295 QQYNBDZTTOKTML-UHFFFAOYSA-N 278.695 2.076 10 10 CECE Oc1cc(F)ccc1CNCC1(O)CCCCC1 1964553176 AZUPFFAKVMTDMD-UHFFFAOYSA-N 253.317 2.316 10 10 CECE C[C@@H](O)c1nc2cccnc2n1-c1ccc(N)cc1 76080307 VKFHCQKDWILBCV-SECBINFHSA-N 254.293 2.056 10 10 CECE CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCN=[N+]=[N-] 1963698689 LMZWIIOIXAHRAX-SNVBAGLBSA-N 297.359 2.203 10 10 CECE COc1ccc2c(c1)N[C@H](C)CN2CC(=O)NCC(C)C 76927936 AMSIOEADQSAZKR-GFCCVEGCSA-N 291.395 2.088 10 10 CECE CCCOC(=O)[C@H](C)N1CCNc2cc(OC)ccc21 76926794 UQXRIJYYMKLMMM-NSHDSACASA-N 278.352 2.269 10 10 CECE CC(=O)c1sc([C@@H](N)c2cc(O)ccc2O)nc1C 83585773 AGRHYDGZNUOGGT-NSHDSACASA-N 278.333 2.113 10 10 CECE COc1cccc([C@@H]2NCCc3c2ccc(O)c3O)c1 83655956 ZDCZNTPXPHOKEI-HNNXBMFYSA-N 271.316 2.342 10 10 CECE Cc1cnccc1[C@@H]1NCCc2ccc(O)c(O)c21 83724072 GAUAZCJXYBJLSB-AWEZNQCLSA-N 256.305 2.036 10 10 CECE CN(Cc1ccc(N)cc1)C1(C(=O)O)CCCCC1 1891506539 LPNUWTVJGLWHES-UHFFFAOYSA-N 262.353 2.488 10 10 CECE C[C@H]1CN(Cc2ccc(F)c(F)c2O)C[C@@H](C)O1 703529882 KRQSYSBIRDHDDT-DTORHVGOSA-N 257.280 2.280 10 10 CECE CCCC[C@H](O)CCC(=O)NCc1c(O)cccc1F 1178413008 KHFGVHIYQLBBTA-NSHDSACASA-N 283.343 2.479 10 10 CECE CCOc1cccc(CN[C@H]2CC[C@H](OC)C2)c1O 190943500 XLMGFYXJHWIIBU-STQMWFEESA-N 265.353 2.448 10 10 CECE COc1ccc(O)c([C@H](C)N2CC(CCC(=O)O)C2)c1 709376699 RAVLVLNPPRTYJR-JTQLQIEISA-N 279.336 2.258 10 10 CECE C[C@@H](N[C@@H](CO)c1ccccc1)c1ccc(O)cc1O 62999448 TVFWQWCHOFNEPG-ABAIWWIYSA-N 273.332 2.482 10 10 CECE CC1(C)CC[C@H](CNCc2ccc(O)cc2O)OC1 711250059 MUYYPRWMQKPRSP-CYBMUJFWSA-N 265.353 2.393 10 10 CECE C[C@H](O)c1ccc(N2CC[C@@H](CC(N)=O)C2)c(Cl)c1 690712028 YWGBYSWPQRSPNA-UWVGGRQHSA-N 282.771 2.095 10 10 CECE COc1cc(N)c(N(C)C[C@@H]2CCSC2)cc1OC 718453352 AFBRXTCPUHGLHQ-JTQLQIEISA-N 282.409 2.475 10 10 CECE CN[C@H](C)c1ccc(N2CC([C@H](C)O)C2)cc1Cl 719755535 VIYSMZNBSSQYMM-ZJUUUORDSA-N 268.788 2.437 10 10 CECE CCNCc1ccc(N(C)C[C@@H]2CCN(C)C2)c(C)c1 71190083 QBMZGFDZBMAXMQ-MRXNPFEDSA-N 275.440 2.492 10 10 CECE CN(c1c(F)cc(CN)cc1F)[C@H]1CN(C)C(C)(C)C1 694141005 JAKZFNKISQISDX-LLVKDONJSA-N 283.366 2.342 10 10 CECE C[C@@H](NCC[C@H]1CCCN1C)c1c(O)cccc1O 822126747 CKDGVOACAQCTTR-VXGBXAGGSA-N 264.369 2.233 10 10 CECE CC[C@H](N)c1ccc(N2CC(N3CCCC3)C2)cc1 697768871 UGRAJNMXUBIKFB-INIZCTEOSA-N 259.397 2.381 10 10 CECE CCOC(CN[C@@H](C)c1ccc(O)cc1O)OCC 93447402 XVCUURFIZGOXHQ-JTQLQIEISA-N 269.341 2.148 10 10 CECE CN(Cc1ccc(N)cc1)[C@@H]1CCO[C@]2(CCOC2)C1 94379233 KHSCNZPNWPIONM-HZPDHXFCSA-N 276.380 2.039 10 10 CECE CC[C@@H]1CC(=O)N(Cc2cc(CNC)ccc2OC)C1 94793625 WVKSERVDOZHRKO-GFCCVEGCSA-N 276.380 2.173 10 10 CECE O=C(O)[C@@H]1CC=C[C@@H](NCc2cc(F)cc(F)c2O)C1 1332017709 QCWXWUOSOUTMRC-LDYMZIIASA-N 283.274 2.179 10 10 CECE NC(=O)[C@]12CCC[C@H]1CN(Cc1c(O)cccc1Cl)C2 897623808 KPUJHTNHANPJBR-BONVTDFDSA-N 294.782 2.133 10 10 CECE Cc1nc[nH]c1CC(=O)NCCCSc1nccs1 1443487141 GCGOGPHHCKKVSY-UHFFFAOYSA-N 296.421 2.016 10 10 CECE CCO[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CN=[N+]=[N-])C2)C1 2118211394 UHWWQTBQRHNANV-SDDRHHMPSA-N 266.345 2.350 10 10 CECE CC(C)CNC(=O)CCN1CCC[C@H](CN=[N+]=[N-])C1 2116871875 CXQPDJKITDSLJX-GFCCVEGCSA-N 267.377 2.171 10 10 CECE O=C(O)c1ccnc(NCc2ccccc2O)c1F 2116853722 RGRABFPGAVUAGZ-UHFFFAOYSA-N 262.240 2.237 10 10 CECE O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1cc(O)ccc1O 1471661056 GCZGGDQAVVQUAE-NRUUGDAUSA-N 261.321 2.150 10 10 CECE CN(C[C@H]1CCCCN1)c1ccc2c(c1)OCCO2 216799904 XZJGPRREYNBTAL-GFCCVEGCSA-N 262.353 2.036 10 10 CECE CC(C)OC(=O)CNCc1cc(Cl)ccc1O 308768225 XBHJWLIDCKNEFP-UHFFFAOYSA-N 257.717 2.087 10 10 CECE N[C@H](c1ccccc1O)c1ccnn1[C@@H]1CC1(F)F 2121750469 ZHVYRVOEJGEXFV-VXGBXAGGSA-N 265.263 2.217 10 10 CECE Cc1cc(CNC(C)C)ccc1N(C)[C@H]1C[C@H](O)C1 2122886402 OPGVXSWPIMXVRW-SHTZXODSSA-N 262.397 2.453 10 10 CECE CCCN(CC(F)(F)F)c1ccc2c(c1)NC(=O)[C@@H]2N 105486146 HXIJJDCPPORJLS-LLVKDONJSA-N 287.285 2.417 10 10 CECE Cc1ncccc1/C=C\C(=O)NCc1cccc(O)c1O 1558162319 YWSVCQQSGMWYQH-FPLPWBNLSA-N 284.315 2.131 10 10 CECE CN(CCN=[N+]=[N-])[C@@H]1CCc2ccccc2NC1=O 1912187362 JMHWJFAGYHRQSB-GFCCVEGCSA-N 259.313 2.182 10 10 CECE [N-]=[N+]=NC1CN(C(=O)Cc2cccc(Cl)c2)C1 1912200834 MATBAKRDBOHACC-UHFFFAOYSA-N 250.689 2.404 10 10 CECE [N-]=[N+]=NC1CCN(C(=O)C[C@H]2CCCOCC2)CC1 1912207191 MVOWNRCFGIBZOG-NSHDSACASA-N 266.345 2.495 10 10 CECE CCOc1ccc(C2=NC(=O)/C(=C\C(=O)O)S2)cc1 32122814 QZIMKMIEMUXFTD-JXMROGBWSA-N 277.301 2.074 10 10 CECE COc1ccc(CNCc2c(O)cccc2Cl)nn1 1913559173 KRLFGFWMQFCURT-UHFFFAOYSA-N 279.727 2.134 10 10 CECE CO[C@H]1CCN(c2c(F)cc(CN)cc2F)[C@@H]1C 1914263141 VPRXDECNGMSJND-PELKAZGASA-N 256.296 2.037 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2COC3CC2C3)c(F)c1 2126699205 VFRLRHUCTILJMG-HCWXADSOSA-N 264.344 2.459 10 10 CECE CC[C@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)C[C@H]1O 2128274677 QDJVPUBLGILGGH-KNXALSJPSA-N 261.365 2.263 10 10 CECE Nc1ccc(CC(=O)N[C@H]2C[C@H]3C[C@H]2C[C@H]3F)cc1 1967393970 XOURURQOVGZUKK-WVWOOGAGSA-N 262.328 2.064 10 10 CECE O[C@@H]1CN(c2ccc3c(c2)CC[C@H]3O)CC12CCC2 2128321570 LTSDKWSQDHOJKX-HUUCEWRRSA-N 259.349 2.017 10 10 CECE O[C@H]1CCc2cc(N3C[C@@H]4C[C@@H]3CC[C@@H]4O)ccc21 2128320249 BTQIVNGACWSSNS-MZGVZZPPSA-N 259.349 2.016 10 10 CECE C[C@@H](O)C1CCN(c2ccc3c(c2)CC[C@H]3O)CC1 2128322787 SVZKLVKRFDITTE-BDJLRTHQSA-N 261.365 2.263 10 10 CECE C[C@@H]1CN(c2ccc3c(c2)CC[C@H]3N)C[C@@H](C)N1C 2128310021 BIOHSOZBRCPHDR-XHBSWPGZSA-N 259.397 2.161 10 10 CECE CC1(C)C[C@@H](O)CCN1c1ccc2c(c1)CC[C@H]2O 2128315016 NESUZIBVPDAGHI-DZGCQCFKSA-N 261.365 2.406 10 10 CECE COc1ccc(O)c([C@H](C)N[C@@H](C)[C@H](C)CO)c1 168791635 IEDCWLYQRROGEV-VWYCJHECSA-N 253.342 2.068 10 10 CECE COC[C@H](C)CN[C@H](C)c1ccc(N2CCOCC2)cc1 155407006 XPLLTZUYEQBMEK-HUUCEWRRSA-N 292.423 2.456 10 10 CECE COc1ccc([C@@H](C)NCC2(CCO)CC2)c(O)c1 157454008 QDZKRBGJZCMXAA-LLVKDONJSA-N 265.353 2.214 10 10 CECE CN(C)c1ccc(CN[C@@H]2CC(F)(F)C[C@@H]2O)cc1 2133294029 OZDONTJEMDMEOX-OLZOCXBDSA-N 270.323 2.001 10 10 CECE CCN[C@@H]1C(=O)Nc2cc(N3CCC[C@@H]4C[C@@H]43)ccc21 1916911400 JIBSFTMVFCDMOD-ONERCXAPSA-N 271.364 2.278 10 10 CECE C[C@@H]1C[C@H]2CN(c3cc4c(cc3N)OCCO4)C[C@@H]12 2141487777 FSUFEAQPPKMUTI-VWYCJHECSA-N 260.337 2.132 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@]2(CCN2)C1 1922987356 ILWAYRAQTTVTIJ-YGRLFVJLSA-N 250.317 2.030 10 10 CECE COCc1noc(CN[C@@H](C)c2ccc(C)cc2O)n1 1926270107 NYQYOAXCYNDMGO-JTQLQIEISA-N 277.324 2.081 10 10 CECE CC1(C)[C@H](C(=O)O)CCN1Cc1cc(F)ccc1O 1968223358 KSXHVOYYFUCCGA-NSHDSACASA-N 267.300 2.216 10 10 CECE CC1(C)CCCN1C(=O)[C@@H]1CNc2ccccc2N1 229881047 NZWRYOBAFOVYBO-ZDUSSCGKSA-N 259.353 2.294 10 10 CECE C[C@@]1(O)CCCN(C(=O)Nc2ccc(N)cc2)CC1 230357269 BQBCLORIZFJXPY-CQSZACIVSA-N 263.341 2.038 10 10 CECE COc1cc(Cl)cc(CNCCn2cc(C)cn2)c1O 230934369 YWFRPYHAKKDQEA-UHFFFAOYSA-N 295.770 2.349 10 10 CECE CC[C@@H]1OCC[C@@H]1CNC(=O)CCc1ccc(N)cc1 233959290 MIWQBOQGHJQARO-HIFRSBDPSA-N 276.380 2.133 10 10 CECE C[C@H](N[C@@H]1CC[C@H](O)C1(C)C)c1cc(O)ccc1O 2142130046 QDZOOKKFVICCPT-FZZIBODNSA-N 265.353 2.298 10 10 CECE CO[C@H]1CN(c2ccc3c(c2)CC[C@@H](C)N3)C[C@H]1OC 234863954 IXUFNDULVDBBCO-LYRGGWFBSA-N 276.380 2.283 10 10 CECE CS[C@H]1CCCC[C@@H]1NC(=O)COc1ccc(N)cc1 235058749 ITLFLYNRPYTNGL-KBPBESRZSA-N 294.420 2.438 10 10 CECE CN1C(=O)[C@H](O)c2ccc(N3CCCCC3(C)C)cc21 2150016743 SHUFVIDRXSYPGP-CQSZACIVSA-N 274.364 2.465 10 10 CECE Cc1nc(CNCc2ccc(N3CCCC3)cc2)no1 236025853 SBBAIILFAQJPAG-UHFFFAOYSA-N 272.352 2.268 10 10 CECE CN1CCCc2cc(CN[C@@H]3C[C@H](O)C3(C)C)ccc21 129443946 VAEPDSDXQPHHKT-CVEARBPZSA-N 274.408 2.318 10 10 CECE O=C(O)CNC(=O)N=NC1C2CC3CC(C2)CC1C3 1951313065 IVLOQYUYFRYMRQ-UHFFFAOYSA-N 265.313 2.058 10 10 CECE COC[C@H](CNC(=O)CCc1ccc(N)cc1)C(C)C 2143872423 GCJJQAABEHSMCH-AWEZNQCLSA-N 278.396 2.236 10 10 CECE CN(C(=O)Nc1ccc(N)cc1)[C@H]1CCCC[C@H]1O 131908840 VWPMXEVSHUXUMJ-QWHCGFSZSA-N 263.341 2.036 10 10 CECE C[C@H](NC[C@]1(F)C[C@H](CO)C1)c1ccccc1O 1974382396 YHFLXPAGTWRWHS-MJVIPROJSA-N 253.317 2.153 10 10 CECE CC(C)(F)[C@@H]1CCN(C(=O)COc2ccc(N)cc2)C1 2145581450 PQVWMNOAYDYCFY-LLVKDONJSA-N 280.343 2.244 10 10 CECE CCOC(=O)CC[C@H](N)c1cc(C)c(C)c(O)c1O 260353308 XOFJTDKQPGCHDE-NSHDSACASA-N 267.325 2.058 10 10 CECE CCOC(=O)C[C@H](N)c1c(O)cccc1SC 260585164 ZWCNYKKJFRWBAX-QMMMGPOBSA-N 255.339 2.067 10 10 CECE Nc1ccc(CCCN2CCN(CC3CC3)CC2)cc1 158202561 RPGOVRJKNHJZBI-UHFFFAOYSA-N 273.424 2.229 10 10 CECE CCCN(CC(=O)N[C@@H](C)CC)Cc1ccc(N)cc1 35364795 IINCCNDPRFCPRC-ZDUSSCGKSA-N 277.412 2.396 10 10 CECE NCc1ccc(N2CC[C@@H](N3CCCCC3)C2)cc1F 160485683 LEBHYCFDUZOHRL-OAHLLOKOSA-N 277.387 2.349 10 10 CECE COC(=O)[C@H](CC(C)C)N[C@@H](C)c1cc(O)ccc1O 36980765 QOPAXIDDAYYHRB-GWCFXTLKSA-N 281.352 2.336 10 10 CECE Cc1occc1-c1cc(N)n(-c2ccc(Cl)nn2)n1 37291275 TVDFXYSNYDIYIZ-UHFFFAOYSA-N 275.699 2.466 10 10 CECE CNCc1ccc(N2CC[C@H](CO)C(F)(F)C2)c(C)c1 2146382148 FMZIJWABZGZHBM-CYBMUJFWSA-N 284.350 2.168 10 10 CECE CN1CCCN(c2ccc(CN)cc2C(F)(F)F)CC1 163661687 YCBBCFPZAIJWMC-UHFFFAOYSA-N 287.329 2.306 10 10 CECE Cc1n[nH]c(C(=O)N(C)Cc2ccccc2O)c1C 265406168 KIWPAKAYYKGNOH-UHFFFAOYSA-N 259.309 2.004 10 10 CECE Cc1nn(C)c(C)c1[C@@H](O)c1ccc2c(c1)CCN2C 2146945955 JBRAJAIRQQMBCQ-INIZCTEOSA-N 271.364 2.111 10 10 CECE CC[C@@H](C)[C@H](NCc1ccc(OC)cc1O)C(=O)OC 40906495 DPZDVGLFBVLCAF-YGRLFVJLSA-N 281.352 2.078 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2N)[C@@H]1CCC[C@H]2C[C@H]21 2155395313 PEAHGNXZTARUGE-ZEQHWRKHSA-N 271.364 2.263 10 10 CECE Oc1cc(Cl)ccc1CN[C@H]1CO[C@H]2C[C@@H]1C2 2011805082 YGECAGLBJFEPIC-WCQGTBRESA-N 253.729 2.313 10 10 CECE CN1CCCc2cc(CN[C@H]3CC(C)(C)[C@@H]3O)ccc21 2161385589 QPUUFENOWFBCDV-GOEBONIOSA-N 274.408 2.318 10 10 CECE C[C@H](Sc1cnn(C)c1)C(=O)Nc1ccc(N)cc1 48772278 ROIQHPCCVGTAAX-VIFPVBQESA-N 276.365 2.122 10 10 CECE C[C@H]1SCCC[C@@H]1NCc1ccc(O)c(O)c1 2020607006 HKCMZVWTRPSBJW-KOLCDFICSA-N 253.367 2.472 10 10 CECE C[C@@]1(CCO)CCN1c1ccc(CN)cc1Br 2025228180 NJSUZYAUGNNEPV-ZDUSSCGKSA-N 299.212 2.259 10 10 CECE Oc1ccc(F)cc1CN1CC[C@@H]2COCC[C@H]21 2028340317 IAAWDVIZWHVYBJ-ZWNOBZJWSA-N 251.301 2.142 10 10 CECE Oc1c(Cl)cc(Cl)cc1CNCCc1cnn[nH]1 2029272643 XJHHQBJFPSDEPP-UHFFFAOYSA-N 287.150 2.149 10 10 CECE CC(C)[C@@H](O)CCN[C@@H](C)c1c(O)cccc1O 2029927969 NUOLENFSRWQKMC-QWRGUYRKSA-N 253.342 2.155 10 10 CECE CC(C)[C@H](C)[C@@H](N)[C@H](O)c1ccc(N(C)C)cc1 2031041030 BQPLZNGYLZKNME-NILFDRSVSA-N 250.386 2.405 10 10 CECE C[C@H]1[C@@H](N)[C@H](C)CCN1Cc1cc(F)ccc1O 2034568819 YHGOBEFRARXOAF-BFVZDQMLSA-N 252.333 2.089 10 10 CECE CC[C@@]1(C)CN(c2ccc(OC)cc2N)CCO1 2035254358 KDAGKOWMYXZZQV-AWEZNQCLSA-N 250.342 2.283 10 10 CECE COc1ccc([C@H](C)N2C[C@H]3C[C@@H](C2)N(C)C3)c(O)c1 2160648976 WQGRKGGFISYMFG-AVGNSLFASA-N 276.380 2.098 10 10 CECE COc1ccc(CNC[C@H]2[C@H](C)C2(F)F)c(O)c1 2035998665 GEDXIXZMBWTOFU-KWQFWETISA-N 257.280 2.392 10 10 CECE COc1cc(Cl)cc(CNCC(=O)OC(C)C)c1O 308751775 AWLOYKFGWLWHKT-UHFFFAOYSA-N 287.743 2.095 10 10 CECE C[C@@H](c1ccccc1O)N1C[C@H]2C[C@@H](C1)[C@H](C(=O)O)C2 2160894432 FUGRUSYPUXMHHT-ZJQBRPOHSA-N 275.348 2.496 10 10 CECE OC[C@@H]1CCC[C@@H](CNCc2cccc(F)c2O)C1 312002331 RQNSLSGTBBBEIF-VXGBXAGGSA-N 267.344 2.420 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CN3CCC2CC3)c(F)c1 312405315 PSSGHSQXBCBMSR-ZBEGNZNMSA-N 277.387 2.376 10 10 CECE Cc1cnn(CCN2CCc3cc([C@H](C)N)ccc32)c1 312649623 KQHLVXOIINYRTO-ZDUSSCGKSA-N 270.380 2.274 10 10 CECE O=C(N[C@H]1CCC(F)(F)C1)[C@@H]1CNc2ccccc2N1 313493008 HVYRPGICRVRGDX-CABZTGNLSA-N 281.306 2.197 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1cnc(F)cc1C 2161763609 DBRUSEBLUAQYAL-LSDHHAIUSA-N 276.311 2.229 10 10 CECE CN(CC(=O)c1ccc(O)c(O)c1)C[C@@H]1C[C@H]1C(F)F 2159863329 AAJVNIZEXTURNJ-VHSXEESVSA-N 285.290 2.114 10 10 CECE CCCO[C@H]1CCN(c2ccc(CN)c(F)c2)C1 701674850 VQAPCBWSHZGCFW-ZDUSSCGKSA-N 252.333 2.290 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H](N)CC(F)(F)F)ccc21 2163091148 DMBVEXABFULEOL-AAEUAGOBSA-N 288.313 2.382 10 10 CECE CCC1(O)CCN(CCCOc2ccc(N)cc2)CC1 707253475 HAJLOCDOEOUKRS-UHFFFAOYSA-N 278.396 2.275 10 10 CECE CN[C@@H](C)c1ccc(N2CC(O)C2)cc1C(F)(F)F 707814029 CRQUTVKQDUMOJP-QMMMGPOBSA-N 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CC1(C)OCCO[C@H]1Cn1ccc2cc(N)ccc21 2130409240 AWMUIULYWCHKRT-AWEZNQCLSA-N 260.337 2.418 10 10 CECE COc1ccc([C@@H](C)N[C@H]2COCC2(F)F)c(O)c1 2131101144 VSAXSGGXALESNG-PELKAZGASA-N 273.279 2.086 10 10 CECE C[C@@H]1CCN(CC2=C[C@@H](O)[C@@H](N)C2)c2ccccc21 2131478956 UMUPBEYYPDFBIW-DIOULYMOSA-N 258.365 2.019 10 10 CECE COC[C@@H]1C[C@@H]1C(=O)N(C)[C@H](C)c1ccccc1O 2133494298 WMEDKJSPVGDYSL-MDZLAQPJSA-N 263.337 2.194 10 10 CECE CC[C@H]1CCCCN1C[C@@H](O)COc1ccc(N)cc1 222009721 IIVAEFLYUZMNAC-LSDHHAIUSA-N 278.396 2.273 10 10 CECE C[C@H](NC[C@H]1CCS(=O)(=O)C1(C)C)c1ccccc1O 1967553057 JVQLUXRMYCRFIG-NWDGAFQWSA-N 297.420 2.256 10 10 CECE CC[C@@H](NC[C@]1(C)COCCO1)c1ccccc1O 1967513890 ACBXDYVBAPNRKY-UKRRQHHQSA-N 265.353 2.238 10 10 CECE C[C@@H]1CCO[C@H]1Cc1noc(-c2ccc(O)c(O)c2)n1 1918138548 CHKDQFFWUBQIPQ-PELKAZGASA-N 276.292 2.115 10 10 CECE Cc1cccc(CNC(=O)C[C@@H]2CCCCO2)c1O 2139751114 QAVNIONSKNVWTP-ZDUSSCGKSA-N 263.337 2.276 10 10 CECE CCc1cccc(CNC[C@@H]2C[C@H](O)C2(C)C)c1O 1967878134 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APLRJTVOCWFKLF-SSDOTTSWSA-N 282.394 2.070 10 10 CECE CN1CCCc2cc(CNC[C@H]3CC[C@H](O)C3)ccc21 300697258 ASGBWQBBACUTGP-HOCLYGCPSA-N 274.408 2.320 10 10 CECE Nc1ccc(CN(C2CC2)[C@H]2CCC(F)(F)[C@@H]2O)cc1 2160109139 PWPDSGPFIGYWQQ-UONOGXRCSA-N 282.334 2.392 10 10 CECE CCCOc1cc(N(C)CCNC)ccc1[N+](=O)[O-] 70987717 WGOHNGAQGYYZSO-UHFFFAOYSA-N 267.329 2.039 10 10 CECE CC(=O)NCCN(C)c1ccc(CNC(C)C)c(C)c1 308191310 NVCGFUBUMFJBRG-UHFFFAOYSA-N 277.412 2.065 10 10 CECE CO[C@@H]1CN(c2ccc([C@H](C)N)cc2Cl)[C@H]2COC[C@@H]12 2158352944 JPLKOUGCQJPBFI-OCVOHJKQSA-N 296.798 2.210 10 10 CECE CS[C@H]1CCCN(c2ccc3c(c2)NC(=O)[C@H]3N)CC1 312541898 IHBAQPBFZFHJHF-FZMZJTMJSA-N 291.420 2.360 10 10 CECE COc1cc(N)c(N2CC(OCC(C)C)C2)cc1OC 2158703878 AFDCPDUJYGRRAA-UHFFFAOYSA-N 280.368 2.147 10 10 CECE CC[C@H](NC)c1ccc(N(C)[C@@H]2CN3CC[C@H]2C3)cc1 2158735180 OJWUSTUVIGURKU-BHYGNILZSA-N 273.424 2.497 10 10 CECE CN[C@@H](C)c1ccc(N2C[C@H]3C[C@H]2CS3)cc1O 322110245 ONKDLZYAPJGGLE-ZMLRMANQSA-N 264.394 2.367 10 10 CECE 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10 10 CECE C[C@H](N[C@@H]1CC2(CCC2)[C@@H]1O)c1cc(O)ccc1O 2140683852 OZWDAKGZAIUPBD-MRCXROJRSA-N 263.337 2.052 10 10 CECE CN(C)c1ccc(CN[C@H]2CC3(CCC3)[C@@H]2O)cc1 2140685152 XWHZVPIYFCNAHQ-LSDHHAIUSA-N 260.381 2.146 10 10 CECE Cc1cc(N(C)CC23COC(C)(C2)C3)ccc1CO 2138072363 FOYXRNBXJCTKIU-UHFFFAOYSA-N 261.365 2.493 10 10 CECE CN(Cc1cc(N)ccc1O)Cc1ccncc1F 2138233904 GBXKZIVJUKRHMM-UHFFFAOYSA-N 261.300 2.141 10 10 CECE CNCc1ccc(N(C)CCN(C)C)cc1Cl 234403095 CUZVGIKXCINZDU-UHFFFAOYSA-N 255.793 2.057 10 10 CECE OCc1ccc(N2CCC3(CCC3)[C@H](CO)C2)c(F)c1 2151657736 VMSLZSCSMQIBOS-ZDUSSCGKSA-N 279.355 2.307 10 10 CECE Nc1ccc(CNC(=O)c2ccc(F)cc2O)cc1 236357122 KDVWZYHJUXEYPH-UHFFFAOYSA-N 260.268 2.044 10 10 CECE CCOc1cccc(CN2CCC[C@@H]3NCC[C@H]32)c1O 2143699934 IKCVTCHKAZXFOV-UONOGXRCSA-N 276.380 2.117 10 10 CECE C[C@@H](O)c1ccc(N2CCC[C@@H](C(=O)N(C)C)C2)cc1 2143664010 FCCDDYMFZKTDDH-TZMCWYRMSA-N 276.380 2.045 10 10 CECE CC[C@H](Nc1c(N)cccc1Cl)C(=O)N(C)C 1950455583 WLDLNBQSWRBTQM-JTQLQIEISA-N 255.749 2.201 10 10 CECE CCOC(=O)[C@H](CCCc1ccc(N)cc1)OC 1951490465 IWFRLVZXKKIFRX-ZDUSSCGKSA-N 251.326 2.170 10 10 CECE O=C1CCN[C@H](c2ccc(C(F)(F)F)cc2O)C1 1951728398 MTPLSKQSBKUIAZ-JTQLQIEISA-N 259.227 2.405 10 10 CECE CC(C)(C)OC(=O)N[C@]1(c2cccc(F)c2O)CCNC1 1952174023 GCAPJRCFPUNFJW-OAHLLOKOSA-N 296.342 2.245 10 10 CECE COc1cccc(CN2CCCC[C@H](C(=O)O)C2)c1O 1972886438 WZEALTXEHALEKA-LBPRGKRZSA-N 279.336 2.088 10 10 CECE CCN[C@@H](C)c1cnc(Sc2nc[nH]n2)s1 1976508792 HJTAAOHTSULAMW-LURJTMIESA-N 255.372 2.083 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H]3CC(=O)N[C@@H]3C2)cc1Cl 2145056639 CLMAQIHWBYNVBK-PKFCDNJMSA-N 293.798 2.075 10 10 CECE CCOC(=O)[C@@]1(c2ccc(O)c(O)c2)CC1(C)C 260859277 WZXGLMHYJYKXKR-AWEZNQCLSA-N 250.294 2.329 10 10 CECE CCCN1CCN(c2ccc(CNCC)cc2F)CC1 34824197 PEHUGNVRQITSBX-UHFFFAOYSA-N 279.403 2.467 10 10 CECE CO[C@@H]1CCN(Cc2cc(C(C)=O)ccc2O)C[C@@H]1C 2149338588 LTHSUQFZHIBXGJ-MEDUHNTESA-N 277.364 2.452 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](C)n1cccn1 38089722 NZYMLQMFDROJAT-RYUDHWBXSA-N 273.336 2.369 10 10 CECE COCCOCCCCNCc1cccc(F)c1O 166080900 XAWVZYHNIQAEPL-UHFFFAOYSA-N 271.332 2.064 10 10 CECE Nc1ccc(NC(=O)CC[S@](=O)c2cccs2)cc1 40967854 CKQXFMBABNPSFP-LJQANCHMSA-N 294.401 2.467 10 10 CECE Nc1ccc(CCC(=O)OCCc2ccncc2)cc1 41101839 AQQNHOKWYJTUMD-UHFFFAOYSA-N 270.332 2.382 10 10 CECE CSC[C@H](C)N(C)[C@@H](CN)c1ccc(N(C)C)cc1 167393722 WWJHDVVTWRLFLP-WFASDCNBSA-N 281.469 2.436 10 10 CECE OCc1ccc(N2CCCC[C@@H](O)C2)cc1Cl 2003384870 QNIGJPMBVQSCJV-GFCCVEGCSA-N 255.745 2.184 10 10 CECE Nc1ccc(NC(=O)N2CCOCCC23CCC3)cc1 2154152488 NIZMJGXCUPZPIN-UHFFFAOYSA-N 275.352 2.446 10 10 CECE CCCn1ccnc1[C@@H](N)c1ccc2c(c1)CCN2C 2154614304 BYDSNPOYMYQOKQ-HNNXBMFYSA-N 270.380 2.334 10 10 CECE OCc1ccc(N2CC3(C=CCO3)C2)cc1Br 2012119395 VHRXYOKMWJFQIK-UHFFFAOYSA-N 296.164 2.087 10 10 CECE CS[C@H]1C[C@@H](CNCc2cccc(O)c2O)C1 2016148486 ZYMPANCHMXCOFV-JGZJWPJOSA-N 253.367 2.329 10 10 CECE CCNCc1ccc(OC)c(Cn2ccccc2=O)c1 50125463 NOQJXQDBNLSJDP-UHFFFAOYSA-N 272.348 2.015 10 10 CECE C[C@H](NCc1cc(F)ccc1O)c1nncs1 2020936693 VIJRZAZYBHUOKP-ZETCQYMHSA-N 253.302 2.234 10 10 CECE CC[C@@H](CN(C)C)N[C@H](C)c1cc(O)ccc1O 2029868997 BPNVEHPQRCQQGS-MNOVXSKESA-N 252.358 2.089 10 10 CECE C[C@H](N[C@@H]1CCCn2ncnc21)c1ccc(F)cc1O 185662656 RKDVTOLVZTYJPZ-JOYOIKCWSA-N 276.315 2.309 10 10 CECE C[C@H](NC[C@@H]1OCC[C@@H]1C)c1cc(O)ccc1O 2034988175 YZCLQWTVEYAQRD-BHDSKKPTSA-N 251.326 2.173 10 10 CECE OCc1ccc(N2CC([C@H]3CC3(F)F)C2)c(F)c1 2036009709 HAUBNZGKQVTMSC-SNVBAGLBSA-N 257.255 2.409 10 10 CECE CC1(C)C[C@H](C[C@H](NN)c2ccccc2O)CO1 2041419086 HIMCBORFWJZNQH-JQWIXIFHSA-N 250.342 2.102 10 10 CECE O=C(NC[C@@H]1CC[C@H]2[C@H]1C2(F)F)c1ccc(O)c(O)c1 2158390610 YLTOSJGJIPSYBM-AUTRQRHGSA-N 283.274 2.119 10 10 CECE Nc1ccc(CCCN2CCC[C@@]23CC[S@@](=O)C3)cc1 2158460524 ULRFVMFZNFMPGI-OXJNMPFZSA-N 292.448 2.188 10 10 CECE COc1ccc([C@@H](C)NCCc2cncn2C)c(O)c1 401883614 RUFOZFGTQZZUOZ-LLVKDONJSA-N 275.352 2.028 10 10 CECE CCOC(=O)[C@]1(NCCCN=[N+]=[N-])C[C@H](C)[C@H]1C 311086989 NDKXJPKYFHAFRJ-UMNHJUIQSA-N 254.334 2.254 10 10 CECE C[C@H]1CCCC[C@H]1S(=O)(=O)NCCc1ccc(N)cc1 407393522 PYNRTQLKIWTTAN-SWLSCSKDSA-N 296.436 2.309 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCCN(C[C@H]2CC[C@@H](CO)CO2)C1 2159025455 PSOQMTNLYKADCA-MELADBBJSA-N 282.388 2.186 10 10 CECE COc1ccc([C@H](C)N[C@@H]2COCC2(C)C)c(O)c1 313053343 GNEYIPLEZRYBNY-IINYFYTJSA-N 265.353 2.476 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N(C)[C@H]1[C@@H]2CNC[C@@H]21 2159782356 QZXBTOXZZKQHLS-QHRNJGFCSA-N 272.392 2.399 10 10 CECE CC[C@@H]1CC[C@@H]1N(C)c1cc2c(cc1F)[C@@H](O)C(=O)N2 2161956280 XKWYWLWRUIIVFT-CWONEXCFSA-N 278.327 2.436 10 10 CECE CO[C@@H]1C[C@H](C)CC[C@H]1NC(=O)c1cccc(O)c1O 2162072140 DOTCDLCRLVYPJK-IRUJWGPZSA-N 279.336 2.031 10 10 CECE CC[C@@](O)(C(F)F)[C@H](NC)c1ccc2c(c1)CCN2C 2178795360 VIAYOSKQUFSVAN-HIFRSBDPSA-N 284.350 2.346 10 10 CECE CN1CCc2cc([C@H](O)[C@@]34CC[C@@H](C[C@@H]3N)C4)ccc21 2163075658 GSNVAXWXVGBZTE-GNCDUGFZSA-N 272.392 2.230 10 10 CECE CN1CCCc2cc([C@H](O)C[C@@]3(N)CCSC3)ccc21 2163112337 ATSXDRPWXWUNGG-CVEARBPZSA-N 292.448 2.327 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H](O)c3ccns3)ccc21 2163145620 QXJXFKVXWCGKGD-GJZGRUSLSA-N 289.404 2.259 10 10 CECE CC[C@@H]1CCNC[C@H]1N(C)Cc1c(O)cccc1OC 2163612191 HNUPOASTKNDFHX-TZMCWYRMSA-N 278.396 2.221 10 10 CECE CN[C@H](C)c1ccc(N2CC(OCC(F)F)C2)cc1 707656624 GHKYYZSKXZGBRE-SNVBAGLBSA-N 270.323 2.437 10 10 CECE CN(c1ccc(CO)cc1Cl)[C@@H]1CCC[C@@H]1O 708575355 BTKZCXPHKWFAFM-OLZOCXBDSA-N 255.745 2.182 10 10 CECE CO[C@H]1C[C@@H](CN[C@@H](C)c2ccc(O)cc2O)C1 708677576 JJFZZUKQYCXCTJ-JBLDHEPKSA-N 251.326 2.173 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1cnc(O)[nH]1 379737504 SDFAUYGIJLCCGH-ONGXEEELSA-N 273.336 2.467 10 10 CECE CCCOc1cc(N(CC)C[C@H](C)O)ccc1N 691397676 KOAFORLDYCEYQB-NSHDSACASA-N 252.358 2.265 10 10 CECE C[C@@H](O)CN(c1ccc(CN)c(Cl)c1)C1CC1 691424269 KDNQQGPLDLBLKR-SECBINFHSA-N 254.761 2.148 10 10 CECE CCOC(=O)[C@]1(NCCN=[N+]=[N-])C[C@@H]2CCCC[C@H]21 712413547 GUCQZZADLGXUIY-LOWVWBTDSA-N 266.345 2.398 10 10 CECE Nc1ccc(CC(=O)NC[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1 693321682 XGZCYQSVFOZCDQ-LMKPVCQUSA-N 280.318 2.219 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@H]2CNC[C@H]2C1 382421784 BTZVVSVEHLYULO-WOPDTQHZSA-N 264.344 2.134 10 10 CECE Nc1ccc(CC(=O)N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3C2)cc1 382881900 SCSCHJXZEQIOPS-SDADXPQNSA-N 268.360 2.092 10 10 CECE CS[C@@H]1CCN(c2ccc([C@@H](C)N)c(O)c2)C1 382985001 VNROLQKVTDEPIB-MWLCHTKSSA-N 252.383 2.354 10 10 CECE CCCOCCN[C@@H](C)c1cc(OC)ccc1O 715002812 YCBLXURIPWHGBD-NSHDSACASA-N 253.342 2.478 10 10 CECE COc1ccc([C@H](C)NCCn2ccnc2C)c(O)c1 383584845 PTCMIJPILPUQOT-NSHDSACASA-N 275.352 2.257 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC(O)(C2CC2)C1 383944831 AEGZHCBWRDCKNF-UHFFFAOYSA-N 272.392 2.208 10 10 CECE C[C@@H]1C[C@@H](N(C)c2c(F)cc(CN)cc2F)[C@@H](C)O1 384997845 VRCYSHQMJWPPEG-JRKPZEMJSA-N 270.323 2.426 10 10 CECE C[C@@H]1[C@@H](CO)CCN1c1ccc(CN)cc1Br 385587498 AKGBRGXRVYCTJI-MWLCHTKSSA-N 299.212 2.115 10 10 CECE CCNCc1cc(F)c(N2C[C@H]3C[C@H]2CO3)c(F)c1 387260235 GIFRABKWAKKJLD-WDEREUQCSA-N 268.307 2.052 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H]3C[C@H](N)[C@H]4C[C@@H]43)ccc21 2166246589 TZQBGVRXLKRSEB-JBXGNFEISA-N 272.392 2.086 10 10 CECE C[C@H](O)c1ccc(N2CCS[C@H](CO)C2)cc1Cl 720032594 PQSCJYAGAXWVRF-ONGXEEELSA-N 287.812 2.307 10 10 CECE CO[C@H]1C[C@@H]([C@@H](N)c2ccc(N(C)C)cc2)C[C@H]1OC 2174915792 PVUQYYNHMUSKNT-UKMLZYKCSA-N 278.396 2.192 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@H]1CC[C@H]1C(=O)O 397119922 ZXQNHEZPICCCID-ADEWGFFLSA-N 277.320 2.022 10 10 CECE CN(C(=O)c1cc2c(ncn2C)s1)c1ccc(N)cc1 2175232711 XZJMPXSJRXSXGO-UHFFFAOYSA-N 286.360 2.494 10 10 CECE C[C@@H](O)c1ccc(N2C[C@@H](S(C)(=O)=O)CC2(C)C)cc1 2179917554 RGWPQVZNPHCXQY-RISCZKNCSA-N 297.420 2.142 10 10 CECE Cc1cc(C(=O)O)n(Cc2c(O)cccc2Cl)n1 2069982153 OGZYJAUOSPVART-UHFFFAOYSA-N 266.684 2.297 10 10 CECE Cc1nn(Cc2ccc(Cl)cc2O)cc1C=O 2070278256 AMHCBCIFKCWPLH-UHFFFAOYSA-N 250.685 2.411 10 10 CECE COc1ccc(O)c(Cn2cc(Br)c(O)n2)c1 2070619254 WFOJBUATLWVGAG-UHFFFAOYSA-N 299.124 2.114 10 10 CECE 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CECE C[C@H](O)[C@H]1CCN(c2ccc(CO)c(C3CC3)c2)C1 2339146251 PRMFKLYERLIMBD-AAEUAGOBSA-N 261.365 2.263 10 10 CECE Cc1c([C@@H](C)N)ccc(N2C[C@H](C)[C@@H](CO)C2)c1C 2341065940 ZZDGDGRTHQDDHS-ZLKJLUDKSA-N 262.397 2.388 10 10 CECE CN[C@](CSc1nccs1)(C(=O)O)[C@@H]1CC12CCC2 2344987812 BDLUMCNQWANBOZ-RNCFNFMXSA-N 298.433 2.468 10 10 CECE C[C@@H]1C[C@](C(=O)O)(N(C)Cc2ccccc2O)[C@@H]1C 2347931670 HDTKDVWHKSNZQA-HFAKWTLXSA-N 263.337 2.323 10 10 CECE CSc1cc(N2CC(C[C@H](C)CO)C2)ccc1CN 2353855030 DKBGPFZLRBRTOG-NSHDSACASA-N 280.437 2.322 10 10 CECE CSc1cc(N2CC3(CCOCC3)C2)ccc1CN 2353858938 UCODYWWBIVVMLR-UHFFFAOYSA-N 278.421 2.484 10 10 CECE CSc1cc(N(C)C[C@H]2OCC[C@H]2F)ccc1CN 2353861375 XOPKZDIEDJDCFA-CHWSQXEVSA-N 284.400 2.430 10 10 CECE C[C@H](c1ccc(F)cc1O)N1C[C@@H]2CC[C@H]1[C@H]2C(=O)O 2354638865 OZVWJLZMLRKOKR-YYESSMSJSA-N 279.311 2.387 10 10 CECE CC[C@@H](N[C@@H]1CCCC[C@@H]1C(N)=O)c1ccccc1O 2355405152 VUYRYMWGQJEMEV-BFHYXJOUSA-N 276.380 2.477 10 10 CECE O[C@H]1C[C@@H]2[C@H]1CCN2c1ccc(CNC2CC2)cc1F 2355698802 YQWRBWVGBRLQEU-WQVCFCJDSA-N 276.355 2.037 10 10 CECE CN[C@H]1CCCc2cc(N3CC[C@@H](C)[C@@H](O)C3)ccc21 2356170432 GLZBUKONTOIHID-DQYPLSBCSA-N 274.408 2.491 10 10 CECE O=C1c2cc(O)c(O)cc2OC[C@@H]1c1ccc(O)cc1 6093290 ZAIJTQZQMCNJHG-LLVKDONJSA-N 272.256 2.162 10 10 CECE endogenous,in-man CC(C)(C)NC(=O)CNCc1ccc(N2CCCC2)cc1 107792797 PDRZPBHQHCBUPV-UHFFFAOYSA-N 289.423 2.291 10 10 CECE CC1(C)CN(c2ccc(CO)c([N+](=O)[O-])c2)CCS1 2132055565 URNIWFZNPIRTKI-UHFFFAOYSA-N 282.365 2.419 10 10 CECE C[C@H]1CN(c2ccc3c(c2)OCCCO3)C[C@H](C)N1 1152673099 KCNSAVBPWQFSSQ-RYUDHWBXSA-N 262.353 2.035 10 10 CECE C[C@H](O)c1cc(F)c(N(C)C[C@H]2[C@@H]3CCO[C@@H]32)c(F)c1 2357380869 JXLCVWKNSCAHOG-KNSQEALPSA-N 283.318 2.489 10 10 CECE C[C@@H](Nc1ccccc1CC(N)=O)c1ccc(O)cc1O 37125137 OISVGCYFBZBKHS-SNVBAGLBSA-N 286.331 2.299 10 10 CECE COc1cc(NCc2c(O)cccc2Cl)nn1C 301886296 DRLGQJJNDBRJKY-UHFFFAOYSA-N 267.716 2.400 10 10 CECE COc1cccc(CN[C@@H](C)[C@H]2C[C@@H]3CCO[C@@H]32)c1O 2358117730 IROHRBPQWIZCOZ-NLZNIHBBSA-N 277.364 2.304 10 10 CECE Cc1nnc(SCC(=O)Nc2ccc(N)cc2)s1 37668851 OPEJEQTYVBEVHN-UHFFFAOYSA-N 280.378 2.160 10 10 CECE CC[C@H]1C[C@@H](NCCc2ccc(O)c(O)c2)CCO1 1170171682 YXPZLHGOONKMEN-STQMWFEESA-N 265.353 2.188 10 10 CECE O=C1CCN(C(=O)c2cccc(O)c2O)c2ccccc21 126164373 IBFYPWYSBSJGFE-UHFFFAOYSA-N 283.283 2.331 10 10 CECE COc1ccc(CN2CC[C@H](c3cnn(C)c3)C2)c(O)c1 128541136 LSZYGGIRPRWRST-LBPRGKRZSA-N 287.363 2.124 10 10 CECE Oc1cc2c(cc1CN1CCN(CC3CC3)CC1)CCC2 193427128 AFXUVKJOKNBJIG-UHFFFAOYSA-N 286.419 2.409 10 10 CECE CCC[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 195171748 FIOSBEFKSQOWGW-HNNXBMFYSA-N 275.396 2.030 10 10 CECE Cc1ccc(O)c([C@@H]2N[C@@H](C(=O)O)C(C)(C)S2)c1 83237015 ZAMDQYVUXZXEDW-WDEREUQCSA-N 267.350 2.267 10 10 CECE O=C1CC[C@@H](c2cc(F)cc(Br)c2O)N1 238710422 RTQPSQIXNSTENS-QMMMGPOBSA-N 274.089 2.245 10 10 CECE CCC[C@@H](O)[C@@H](N)c1c(F)ccc(Br)c1O 95804269 ALUQNLBMVMHHIU-PSASIEDQSA-N 292.148 2.455 10 10 CECE CNC[C@H]1CCCCN1Cc1cc(F)ccc1O 234393777 UCIMUJLGTHUUKD-CYBMUJFWSA-N 252.333 2.105 10 10 CECE Oc1c(Br)cccc1CNCc1cccnn1 236588196 RILNVEANOUFIAE-UHFFFAOYSA-N 294.152 2.235 10 10 CECE CNCc1ccc(N2CC[C@@H](OC)C2)c(Cl)c1 234373589 RWGGGKKLVWGBQE-LLVKDONJSA-N 254.761 2.285 10 10 CECE COc1ccc(N2CCC(C)(OC)CC2)c(N)c1 386207292 XHKRLKGPOYXGQB-UHFFFAOYSA-N 250.342 2.283 10 10 CECE CN(C)c1ccc(/C=C/CN)cc1Br 258555367 GPXREUFQHWFQAL-ONEGZZNKSA-N 255.159 2.487 10 10 CECE C[C@H](c1ccc(N(C)C)cc1)N1CCC[C@H]2CNC[C@@H]21 299918601 KEVXEXMMYCTGTL-KMFMINBZSA-N 273.424 2.497 10 10 CECE CN(c1ccc2c(c1)CCC(C)(C)O2)C1[C@@H]2CNC[C@@H]12 2166548147 XPBPDIVRCAIMLH-ZIAGYGMSSA-N 272.392 2.444 10 10 CECE Cc1cc(Cl)cc([C@@H](C)NCc2cnn(C)n2)c1O 808719558 WDQNQIBEAFTSCJ-SECBINFHSA-N 280.759 2.333 10 10 CECE C[C@@H](NCC1CC2(CC(O)C2)C1)c1cc(O)ccc1O 2164529103 YAOMKFYIIBLSLY-KJLLJONBSA-N 277.364 2.300 10 10 CECE CCN[C@@H](CC)c1ccc(N2CC[C@H](C(N)=O)C2)cc1 723176620 MYOKJBRGQJODDB-ZFWWWQNUSA-N 275.396 2.059 10 10 CECE O=C(COC(=O)[C@@H]1CC[C@H]2C[C@H]2C1)c1ccc(O)c(O)c1 817200477 HMXYPVTWLYJJLG-WCQGTBRESA-N 290.315 2.260 10 10 CECE CCCN(CC(=O)NC)c1ccc([C@H](C)NCC)cc1 723182675 KKIKTTRJAGDRMX-ZDUSSCGKSA-N 277.412 2.320 10 10 CECE Cc1cccc(CN2CCC[C@](O)(C3CC3)C2)c1O 827151503 CVHGLVKVFJQMDO-MRXNPFEDSA-N 261.365 2.438 10 10 CECE CN(C)c1ccc(CN2C[C@H]3COC[C@]3(C)C2)cc1F 827279934 CAHGDDRLCWWXEV-BBRMVZONSA-N 278.371 2.360 10 10 CECE CCO[C@@H]1CN(Cc2c(O)cc(C)cc2Cl)C[C@H]1CN 844903942 SLISRXVNWMLJPL-IAQYHMDHSA-N 298.814 2.150 10 10 CECE C[C@@H](NCC[C@]1(O)CCOC1)c1cc(Cl)ccc1O 846192186 FWZLZQPPULXMAJ-YGRLFVJLSA-N 285.771 2.238 10 10 CECE CN(C/C=C\c1ccc(N(C)C)cc1)CC(C)(C)N 849349685 DXXNTCXXPPQLTQ-SREVYHEPSA-N 261.413 2.435 10 10 CECE CCOC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H](C)c1ccccc1O 913763432 GSIIWJODGBNUFB-WCFLWFBJSA-N 291.347 2.159 10 10 CECE COc1ccc(N2CC[C@H](NC[C@H](N)CC(C)C)C2)cc1 849350315 NPABNJXOCIWEJP-CABCVRRESA-N 291.439 2.237 10 10 CECE C[C@H](O)c1ccc(NCCOc2ccc(N)cc2)nc1 686060367 GOMFTYYDJHWEFP-NSHDSACASA-N 273.336 2.208 10 10 CECE CCN(C)c1ccc(CN2CCc3nccnc3C2)cc1 852697580 GCPYDVWWZYVAON-UHFFFAOYSA-N 282.391 2.491 10 10 CECE C[C@@H](c1cc(F)ccc1O)N(C)[C@H]1C[C@@H](C(=O)O)C1 693014243 QIGFVIDILFZKJP-ATZCPNFKSA-N 267.300 2.387 10 10 CECE COC[C@H](CCNCc1c(O)ccc(Cl)c1F)OC 850345750 JPRAXAUWFLBVDJ-VIFPVBQESA-N 291.750 2.326 10 10 CECE NCc1ccc2c(c1)CCCN2[C@H]1CCN(C2CCC2)C1=O 866659012 GJJMFNNIDUODBI-KRWDZBQOSA-N 299.418 2.051 10 10 CECE CC(=O)N1CCN(Cc2cc(Cl)ccc2O)[C@@H](C)C1 769447752 KWLPMHXQTNDLPB-JTQLQIEISA-N 282.771 2.098 10 10 CECE COC[C@@H](C)OC(=O)NCc1ccc2c(c1)CCCN2C 866674414 ZGZNYJLNPHRRMC-GFCCVEGCSA-N 292.379 2.330 10 10 CECE CCCN(Cc1ccccc1O)C(=O)CC1COC1 769708651 BBYTYHZQZGSSRT-UHFFFAOYSA-N 263.337 2.167 10 10 CECE CC(=O)c1cc(F)cc(CN2CC[C@@H]3CC[C@@H](O)[C@@H]32)c1O 860129396 PTYZZRKJJYLMBY-COLVAYQJSA-N 293.338 2.079 10 10 CECE CC[C@@H]1[C@@H](C(=O)N(C)Cc2ccccc2O)CCN1C 866596738 IYCUKRIVAANXPZ-UONOGXRCSA-N 276.380 2.081 10 10 CECE C[C@@H]1CC[C@H](NCc2ccc(N(C)C)c(F)c2)CN1 863484252 IOYIEKYRHGTKBV-YPMHNXCESA-N 265.376 2.122 10 10 CECE COC[C@H](C)OC(=O)N(C)Cc1ccc(N(C)C)cc1 866417987 DIMQWDOAAATUEW-LBPRGKRZSA-N 280.368 2.356 10 10 CECE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1 866766680 ANXYRBTVLHCUAL-SZWDSURNSA-N 287.359 2.309 10 10 CECE CCc1cccc(CNCCOC(=O)N(C)CC)c1O 1876014985 JDTJFCBYFGUISF-UHFFFAOYSA-N 280.368 2.133 10 10 CECE COc1ccc(O)c(CNC[C@@H]2C[C@@H](O)C23CCC3)c1 1875433531 TVTIHOXPWBVGHH-SWLSCSKDSA-N 277.364 2.042 10 10 CECE O=C1OCC[C@@H]2CN(Cc3cc(Cl)ccc3O)CCN12 770391106 LASUETFLHWTQCI-GFCCVEGCSA-N 296.754 2.072 10 10 CECE NCc1ccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(F)F)c(F)c1F 1877071439 GTNBCUHPRJIOKD-MBTKJCJQSA-N 274.261 2.371 10 10 CECE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H]1CO[C@H](C)C1 132765730 CWOVGBCJNUCAGX-GRYCIOLGSA-N 263.337 2.337 10 10 CECE CC1(C)CC[C@@H](C(=O)O)CN1Cc1ccccc1O 1879081552 NQPAJHUYRBPZBT-GFCCVEGCSA-N 263.337 2.467 10 10 CECE CN[C@H](C)c1cc(F)c(N2C[C@@H](C)[C@@H](O)C2)c(F)c1 1880932399 UFTAQDJUFYAMOT-KKFJDGPESA-N 270.323 2.062 10 10 CECE CCc1cccc(C(=O)NCc2ccc(O)cc2O)c1O 1142533475 LTIGIBYNYUGVJY-UHFFFAOYSA-N 287.315 2.296 10 10 CECE O=C(C[C@H]1OCc2ccccc21)NCc1cc(O)ccc1O 1153886180 ZHWZJCGOHIVALQ-MRXNPFEDSA-N 299.326 2.376 10 10 CECE COc1cccc(F)c1CNC(=O)c1cccc(O)c1O 1157515497 MQEIKVJPAJVVKY-UHFFFAOYSA-N 291.278 2.176 10 10 CECE CN(C)c1ccc([C@@](C)(NCC2CC2)C(=O)O)cc1 37967147 MNEAAULYWKHDNZ-OAHLLOKOSA-N 262.353 2.052 10 10 CECE CN(C)[C@@H]1CCCN(CCCc2ccc(N)cc2)C1 134714034 IVTYDAJAJFUYHH-MRXNPFEDSA-N 261.413 2.227 10 10 CECE CO[C@@H](CO)CN[C@H](C)c1ccc2ccccc2c1O 1964493391 KDACCUHQFXKMER-DGCLKSJQSA-N 275.348 2.203 10 10 CECE COCC[C@H]1CN(Cc2ccc(Cl)cc2O)CCO1 1963475134 IJBPEDVDDYSCSM-ZDUSSCGKSA-N 285.771 2.283 10 10 CECE Cc1ccc([C@@H](N)c2nnc(CC3CC3)o2)c(O)c1 83432231 ALEHDBRSMRESRA-CYBMUJFWSA-N 259.309 2.084 10 10 CECE COc1ccc(O)c(CNc2cccc(OC)n2)c1 83439590 ICPOILKQHFOOLB-UHFFFAOYSA-N 260.293 2.417 10 10 CECE Cc1cc2[nH]c(=O)[nH]c2cc1NCc1ccccc1O 83513338 QATSFLGAGITBPY-UHFFFAOYSA-N 269.304 2.482 10 10 CECE CC(C)[C@@](O)(C(F)F)[C@H](N)c1ccc(N(C)C)cc1 1893287140 BTTDCHWNOHKXLC-OCCSQVGLSA-N 272.339 2.405 10 10 CECE COc1cccc(S(=O)(=O)N(C)c2ccc(N)cc2)c1 702073131 JQQAZOUKYPCUKT-UHFFFAOYSA-N 292.360 2.103 10 10 CECE Oc1c(Cl)cccc1CNCc1csnn1 398215561 ADFPPSUXTWKENK-UHFFFAOYSA-N 255.730 2.187 10 10 CECE CO[C@H](CNCc1ccc(F)c(F)c1O)C1CC1 703341315 NTKSVFMKXSAWBS-LLVKDONJSA-N 257.280 2.185 10 10 CECE COc1cccc(CNC[C@@H](C(C)C)N(C)C)c1O 20145643 TUYLYIDPFBUUQI-ZDUSSCGKSA-N 266.385 2.077 10 10 CECE Oc1ccc(CNCCCN2CCCCC2)c(O)c1 20128747 RSKKJHRCYIPUOP-UHFFFAOYSA-N 264.369 2.063 10 10 CECE Oc1cc(Br)ccc1CNCc1cnccn1 691439268 CRCATKQYBWLPOS-UHFFFAOYSA-N 294.152 2.235 10 10 CECE O=C1Nc2cc(N3CCc4ccsc4C3)ccc2[C@H]1O 712321070 ZADRBMZWCMGYQG-CQSZACIVSA-N 286.356 2.296 10 10 CECE NC(=O)c1cccc(N)c1N[C@@H]1C[C@@H]2CCCC[C@H]21 712614536 JRIPMAWHPLYASV-OPQQBVKSSA-N 259.353 2.358 10 10 CECE CCCn1cc([C@H](C)NCc2ccccc2O)nn1 715839651 DIMBEBCXAZPCDQ-NSHDSACASA-N 260.341 2.245 10 10 CECE 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APUBROJTHLLZMP-HRCADAONSA-N 278.396 2.073 10 10 CECE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@](C)(O)C(F)F 2163131644 SSLJYDPVXNBNTM-ZFWWWQNUSA-N 284.350 2.346 10 10 CECE CCc1nnsc1[C@@H](NC)c1ccc2c(c1)CCN2C 2163139355 AHJHORCBNZXOCI-AWEZNQCLSA-N 288.420 2.402 10 10 CECE Cc1cccc(O)c1CN(C)C[C@@H]1C[C@@H]2OCC[C@@H]2O1 2163203445 QLICRUDWOGCMMD-RCBQFDQVSA-N 277.364 2.079 10 10 CECE CO[C@@H]1CC[C@@H]1N(C)Cc1cc(C(C)=O)ccc1O 724159255 PGFFNXCSEWSJOR-DZGCQCFKSA-N 263.337 2.204 10 10 CECE CCCN[C@@H](c1ccc2c(c1)CCN2C)C1(NC)CC1 2164275540 YUGKPJILLTYWSF-INIZCTEOSA-N 273.424 2.472 10 10 CECE C[C@@H](N[C@H]1CC12CCNCC2)c1cc(F)ccc1O 817975743 AMNCNNYFAWEEAW-YGRLFVJLSA-N 264.344 2.324 10 10 CECE C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@H]1CCN 723882796 KZRADMGBJYCRIB-NXEZZACHSA-N 270.323 2.087 10 10 CECE CN1CCCc2cc(CNC(=O)N[C@H]3CC34CC4)ccc21 823868226 ZVNYAOLKBIUFPX-HNNXBMFYSA-N 285.391 2.421 10 10 CECE CN(C/C=C/c1ccc(N(C)C)cc1)Cc1nc[nH]n1 835025630 IEADYVXCWNLXGD-SNAWJCMRSA-N 271.368 2.016 10 10 CECE Cc1ccn([C@H](C)CC(=O)NCc2ccccc2O)n1 830527177 WDHLCOKWOPHNII-GFCCVEGCSA-N 273.336 2.165 10 10 CECE CN(Cc1ccccc1O)C(=O)c1cc2c([nH]1)CCOC2 837468800 UEGDMMZRPJKANO-UHFFFAOYSA-N 286.331 2.065 10 10 CECE Cc1nonc1CNC/C=C\c1ccc(N(C)C)cc1 835054678 XDMVXBXXGHVZPU-PLNGDYQASA-N 272.352 2.247 10 10 CECE C[C@H](NC[C@H]1CN(C2CC2)C(=O)O1)c1ccc(F)cc1O 848569128 CDTHTLSARJDQON-CABZTGNLSA-N 294.326 2.165 10 10 CECE C[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H](C)N1C 840088567 ODRGZARPIDUOQV-BETUJISGSA-N 274.408 2.405 10 10 CECE C[C@@H](N[C@@H]1CNC[C@H]1C)c1ccc(Br)cc1O 925783313 JRRSSDZXMGIWNM-KBVBSXBZSA-N 299.212 2.413 10 10 CECE CC[C@H](NC(=O)c1ccc(C)c(O)c1O)[C@H]1CCCOC1 922133826 CGDABOKBYXFENB-AAEUAGOBSA-N 293.363 2.341 10 10 CECE CC[C@H](N[C@H]1CNOC1)c1ccc(C(F)(F)F)cc1O 925867379 RWTRPTOCEHRKHG-ONGXEEELSA-N 290.285 2.355 10 10 CECE CO[C@@H]1CCCN(c2cc3c(cc2N)OCCO3)CC1 692004279 DBFWJGIHGQEQQR-LLVKDONJSA-N 278.352 2.045 10 10 CECE CCCNC[C@@H]1CCN1c1ccc2c(c1)CN(C)C2 696332207 IQFWESCBNUVJPE-INIZCTEOSA-N 259.397 2.210 10 10 CECE CN(CC(C)(F)F)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 692856855 UGFHAIRLQJYSCQ-SNVBAGLBSA-N 289.713 2.383 10 10 CECE O=C(NCCCSc1nccs1)NC1CCC1 759582805 PJIUAIYNNMQDCR-UHFFFAOYSA-N 271.411 2.477 10 10 CECE COc1cccc(O)c1CN(C)CCOC(C)C 1875895595 UFETWBQADMHMLA-UHFFFAOYSA-N 253.342 2.258 10 10 CECE CCc1cc([C@@H](O)CCc2ccc(N)cc2)n(C)n1 1877132537 KAFQSACAQUUUSC-HNNXBMFYSA-N 259.353 2.231 10 10 CECE Nc1ccc(CCNc2ccc(N)c(N)c2F)cc1 1876396240 RXURSRRJCXDPHN-UHFFFAOYSA-N 260.316 2.227 10 10 CECE Nc1cccc(C(=O)O)c1NCc1ccccc1O 1876468261 VPMHISSDWBNAKM-UHFFFAOYSA-N 258.277 2.285 10 10 CECE CC(C)(C)OC(=O)N1CCN(c2ccc(N)cc2)[C@H]2C[C@@H]21 1955944091 YCOBARKYGXHMAG-KBPBESRZSA-N 289.379 2.467 10 10 CECE C[C@H](N)c1ccc(N2CC[C@H](C)[C@](C)(O)C2)c(F)c1 1876950346 QSUFTWVCSHDXOJ-ZIBATOQPSA-N 266.360 2.443 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@H]2C[C@]1(C(=O)O)C2 1877470536 HBQGZNVKBAUFHF-ZIBATOQPSA-N 261.321 2.392 10 10 CECE CC(=O)CCC(=O)NCc1cccc(Cl)c1O 890758947 ZZVSMZJAPPYKPX-UHFFFAOYSA-N 255.701 2.031 10 10 CECE COc1cc(O)c(CN2[C@@H](C)C[C@H]2C)cc1OC 793221027 URPUPQBTGJRMAK-AOOOYVTPSA-N 251.326 2.392 10 10 CECE C[C@H](N)c1cc(F)c(N(CCO)[C@@H]2C[C@H]2C)c(F)c1 1880930338 AJCQKMLIMCLULJ-VYUIOLGVSA-N 270.323 2.192 10 10 CECE CO[C@@H]1CCN(c2ccc(CO)cc2F)[C@@H]1C1CC1 1882896307 BGQZJACODQGBCB-HUUCEWRRSA-N 265.328 2.322 10 10 CECE CCNC(=O)CN(CC)[C@H](CC)c1ccccc1O 133617685 HWXMPWAFRVFWGW-CYBMUJFWSA-N 264.369 2.301 10 10 CECE COc1ccc(O)c(CN2CCN3CCCC[C@H]3C2)c1 245961752 UZEXRZPHJRUQQM-AWEZNQCLSA-N 276.380 2.071 10 10 CECE C[C@H](O)[C@H](NCc1cc(F)cc(F)c1O)C(F)(F)F 1882640369 SQPWOHORDQXFNB-RRAGMBSWSA-N 285.212 2.072 10 10 CECE COc1ccc(C(=O)NCc2ccc(O)cc2O)cc1 1142531384 ZZFNBJDGBMUSSS-UHFFFAOYSA-N 273.288 2.036 10 10 CECE C[C@@H]1CC[C@@H](CN)CN1c1ccc2c(c1)OCCCO2 1145058313 QEMWSYIDVFGOGI-OLZOCXBDSA-N 276.380 2.412 10 10 CECE CCOC(=O)[C@H](C)N[C@@H](C)c1cc(C)ccc1O 49370018 BLUSDPWHGDUJQE-QWRGUYRKSA-N 251.326 2.303 10 10 CECE O=C(CCc1ccccc1F)NCc1cc(O)ccc1O 1303223572 VQGLSTSZTWMJOE-UHFFFAOYSA-N 289.306 2.486 10 10 CECE CCc1cccc(CN[C@H](C(=O)N(C)C)C(C)C)c1O 1963201914 NHOWQFVGBIAVOH-AWEZNQCLSA-N 278.396 2.157 10 10 CECE CCSCC(=O)NCc1ccc(N(C)C)cc1 1963308426 JYTCBCIJQRGSAB-UHFFFAOYSA-N 252.383 2.122 10 10 CECE CCC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NCCN=[N+]=[N-] 1963809037 KMEGRJXLIHHCHU-ZDUSSCGKSA-N 299.375 2.496 10 10 CECE COc1ccc(N2CC[C@H](CNCCCO)C2)cc1Cl 76355953 XOMRLVSVWWFDPR-GFCCVEGCSA-N 298.814 2.147 10 10 CECE c1cc(CN2CCNc3cc4c(cc32)OCCO4)ccn1 76936666 ROOPEBQNWXSNHO-UHFFFAOYSA-N 283.331 2.285 10 10 CECE C[C@H]1CCC[C@H](CNCc2ccc(O)cc2O)O1 701492637 HLSIFNDYWBHDGI-GXFFZTMASA-N 251.326 2.145 10 10 CECE Cc1cccc([C@@H](N)C(=O)NCCC(C)(C)C)c1O 83479284 OWYRROQMVXOARB-GFCCVEGCSA-N 264.369 2.253 10 10 CECE CN(C)c1ccc([C@@H](N)c2nnc(C(C)(C)C)o2)cc1 83541401 QRUYOIDGDIUJSG-GFCCVEGCSA-N 274.368 2.481 10 10 CECE C[C@H](N)c1ccc(N2C[C@H]3CN(C)C[C@@]3(C)C2)c(F)c1 702366957 DWKHLZLGDJIXPR-GHJWDPDVSA-N 277.387 2.233 10 10 CECE Oc1c(F)cc(F)cc1CN[C@@H]1C[C@H]2CC[C@H]1O2 708550955 ZFNKTTFFYXBVLJ-YUSALJHKSA-N 255.264 2.080 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CCC[C@H]2O)c(F)c1 708591420 UPSHLNUJUNWBMP-CUOATXAZSA-N 253.317 2.229 10 10 CECE CC[C@@H]1COC[C@@H]1N(C)C(=O)Nc1ccc(N)cc1 688166106 MCJARJAHKVVAPJ-MFKMUULPSA-N 263.341 2.158 10 10 CECE CCN1CC[C@H](N(C)c2ccc(CO)cc2Cl)C1 688457398 FGNZVPZFTROXSC-LBPRGKRZSA-N 268.788 2.363 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCc1ncn[nH]1 80577161 DPKNWTLQRRJIJB-GHMZBOCLSA-N 272.352 2.199 10 10 CECE C[C@@H]1CN(CC(=O)N(C)c2ccc(N)cc2)C[C@@H](C)S1 70381958 POEICFXPCDIERG-VXGBXAGGSA-N 293.436 2.057 10 10 CECE C[C@H]1C[C@@H](N(C)C(=O)CCc2ccc(N)cc2)CCO1 721376200 WGGNQGLVYVGOTE-WFASDCNBSA-N 276.380 2.227 10 10 CECE CC(C)N(CCCOc1ccc(N)cc1)C[C@H](C)O 691424255 JYTDPIIVBICOCD-ZDUSSCGKSA-N 266.385 2.129 10 10 CECE CN(C[C@@]12CCCN(CC1)C2)c1ccc(CN)c(F)c1 691496070 FLMPZJQHCSNSEF-MRXNPFEDSA-N 277.387 2.207 10 10 CECE C[C@H](CCNCc1ccc2c(c1)CCN2C)N(C)C 697902163 CUJQHWMJZZFGGC-CYBMUJFWSA-N 261.413 2.109 10 10 CECE COc1ccc(CN[C@H](C)CNC(=O)C(C)(C)F)cc1C 1265746941 WIHSXSBECIAUPU-GFCCVEGCSA-N 296.386 2.346 10 10 CECE CCCCOCCN(C)c1ccc(OCC(=O)OC)cc1 1193294123 YAJQMKUMNTWUKW-UHFFFAOYSA-N 295.379 2.491 10 10 CECE COc1ccc(CN[C@@H](C)CNC(=O)CC2CC2)cc1C 1266918320 WGJZRVNJJCESRB-ZDUSSCGKSA-N 290.407 2.398 10 10 CECE CCc1nc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)n[nH]1 1350040376 ZQARTELZGGKXOS-QMMMGPOBSA-N 291.307 2.005 10 10 CECE C[C@H](N)c1ccc(N(C)C[C@@H]2[C@@H]3CCO[C@H]32)c(F)c1 2119943026 QBHRAINDMINSFG-APAOZMKASA-N 264.344 2.317 10 10 CECE CN(CCCc1ccc(N)cc1)C[C@@H]1[C@H]2CCO[C@@H]12 2119934638 QDUVSUUZHKYBMH-BZUAXINKSA-N 260.381 2.168 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N(C)C3CC=CC3)ccc21 2118510222 JXLHLTCGPUJVFS-AWEZNQCLSA-N 257.337 2.054 10 10 CECE CC(C)(C)OC(=O)Nc1ccc([C@@H]2COCCN2)c(O)c1 1536003725 BQWRXDWIDLZPKV-LBPRGKRZSA-N 294.351 2.400 10 10 CECE Cc1c(CN(C)CC2(N)CC2)n(C)c2ccccc12 2121649589 JVYVBQFDCFCZGD-UHFFFAOYSA-N 257.381 2.410 10 10 CECE CN(Cc1cccs1)C(=O)Cc1ccc(O)c(O)c1 1540732828 QGUHAADPMPAABN-UHFFFAOYSA-N 277.345 2.360 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(CCC(=O)NC2CCCCC2)C1 1912156812 QGHSKOJYQQZVJY-LBPRGKRZSA-N 279.388 2.458 10 10 CECE [N-]=[N+]=NC[C@@H]1CCCN(CCO[C@@H]2CC2(F)F)C1 1912210493 KFODYWUDXIDCBV-VHSXEESVSA-N 260.288 2.433 10 10 CECE CCOc1cccc([C@H](CCO)N2CCCC2)c1O 107556591 NZPKZEXYRPBNFT-ZDUSSCGKSA-N 265.353 2.310 10 10 CECE Cc1cccc(CNCCN=S2(=O)CCCC2)c1O 1913850555 IAIPYCHUFHRNBV-UHFFFAOYSA-N 282.409 2.052 10 10 CECE C[C@H](N)c1ccc(N(C)C2CC(O)C2)cc1Br 1914590861 SCZJFEMEOTUTGW-PUSIOWJLSA-N 299.212 2.428 10 10 CECE Oc1cccc(CNCc2c[nH]nc2C(F)F)c1O 2126650002 IBDMUFLHZICMRY-UHFFFAOYSA-N 269.251 2.048 10 10 CECE CN(C)c1ccc([C@@H](CN)N2[C@H]3CC[C@H]2CSC3)cc1 1914589632 VTOIAFRWVCEMDV-HRCADAONSA-N 291.464 2.332 10 10 CECE CC[C@@H](O)c1ccc(N2C[C@H]3CC(O)C[C@@H]3C2)cc1 2128630547 GHJZJRLZLRWGIL-XJKCOSOUSA-N 261.365 2.337 10 10 CECE CCOc1ccc(CNC(C)(C)C(=O)OC)cc1C 258747786 IKBLFBLNPYWCIY-UHFFFAOYSA-N 265.353 2.435 10 10 CECE COc1ccc(N2CCCC[C@H]2CCN)c(OC)c1 259230824 KYJHLAYERMWKCF-LBPRGKRZSA-N 264.369 2.412 10 10 CECE CCN1[C@@H](C)CN(c2ccc(CN)c(F)c2)C[C@H]1C 2130404971 NPVILVDIPUZSPD-TXEJJXNPSA-N 265.376 2.203 10 10 CECE CC(C)N(C[C@H]1[C@@H]2COC[C@@H]21)c1ccc(CN)cc1 2132396858 JKFAJMIQNXYCQF-PHZGNYQRSA-N 260.381 2.253 10 10 CECE OC[C@@H](CC(F)F)NCc1ccc(Cl)cc1O 1560755808 SZYMIBYWAVTHJK-SECBINFHSA-N 265.687 2.151 10 10 CECE CN(c1ccc(CO)c([N+](=O)[O-])c1)[C@H]1CCCSC1 2132055582 UUXOFANBTOSFJC-LBPRGKRZSA-N 282.365 2.419 10 10 CECE C[C@H](c1c(O)cccc1O)N1C[C@H](CN)CC1(C)C 2132470591 FJCOAQPCVFFSED-MNOVXSKESA-N 264.369 2.218 10 10 CECE Oc1cccc(F)c1CNC[C@@H]1C[C@@]12CCCOC2 1894090063 YHHGYJPRBGYDAR-XHDPSFHLSA-N 265.328 2.438 10 10 CECE COC1CC(N(C)c2ccc(CN)c(Cl)c2)C1 1914763994 CBYCAXCBXUYMSS-UHFFFAOYSA-N 254.761 2.412 10 10 CECE Nc1ccc(OC[C@H](O)CO[C@@H]2CC[C@@H]3C[C@H]3C2)cc1 1917478121 WFKRPOLJFZYOQT-TWJWRFFLSA-N 277.364 2.214 10 10 CECE COC[C@@H]1CC[C@H](NCc2cc3c(cc2O)OCO3)C1 1918601158 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CN(C[C@H]1CCCN1)c1ccc2c(c1)CCCN2C 2106827720 GFKTYPBEVCHPQB-CQSZACIVSA-N 259.397 2.257 10 10 CECE CN1CCCc2cc([C@H](NN)[C@@]3(C)C[C@H]3F)ccc21 2106868645 WDLUYNHFVLZVJA-ILXRZTDVSA-N 263.360 2.322 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CCC[C@H]2NCC[C@@H]21 2087389927 PQEMRTAIGZRDCJ-HONMWMINSA-N 264.344 2.419 10 10 CECE Nc1ccc(N2CCN([C@H]3C[C@@H]4C[C@@H]4C3)CC2)cc1 2107534015 DEOMCPSCVBDVLN-YWVIFJGQSA-N 257.381 2.189 10 10 CECE O=C(O)[C@@]12C[C@H]1CCCN2Cc1cc(Cl)ccc1O 2087620772 DWSCVIGWOZIEFE-QMTHXVAHSA-N 281.739 2.485 10 10 CECE C[C@@H]1C[C@@H](C)N([C@H](C)c2ccc(O)cc2O)CCN1 2108183584 XMVOJMLOYHZAOK-IJLUTSLNSA-N 264.369 2.231 10 10 CECE COC[C@]12C[C@H]1CN(c1ccc([C@@H](C)O)cc1F)C2 2109168648 HFNCGKMGIAZHPK-IFUGULHKSA-N 265.328 2.352 10 10 CECE CC1(OC[C@H](O)COc2ccc(N)cc2)CCCC1 2089179671 OEFDSCKECXZJJL-CYBMUJFWSA-N 265.353 2.358 10 10 CECE C[C@@H](O)c1ccc(N2CCCNC(=O)CC2)cc1Cl 2089100423 AADAYYGDFWRWTH-SNVBAGLBSA-N 282.771 2.110 10 10 CECE CN(Cc1ccc(=N)[nH]c1)Cc1ccc(Cl)cc1O 2109350138 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263.337 2.198 10 10 CECE CCOCCN(C)c1ccc(OC)cc1C[C@@H](C)N 2227680204 UCFDDVLDMRXUBD-GFCCVEGCSA-N 266.385 2.058 10 10 CECE COc1ccc(N(C)Cc2cnco2)c(C(=O)O)c1 2227671632 DUOYSNZROREORE-UHFFFAOYSA-N 262.265 2.018 10 10 CECE COc1ccc(N(C)[C@H]2COCC[C@@H]2C)c(CO)c1 2227711705 RRGSZBJRSRTWRG-NHYWBVRUSA-N 265.353 2.049 10 10 CECE C[C@H](N[C@H](C(F)F)[C@@H]1CCOC1)c1cc(O)ccc1O 2239526582 ZLYORZSLLGTFLB-RWEMILLDSA-N 287.306 2.419 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@@H]2CCN(C)C[C@@H]2C1 2240830200 MIPPZJCTFCCWSC-VNQPRFMTSA-N 274.408 2.436 10 10 CECE CSc1ncc(Cn2cccc2C(=O)O)s1 2243772412 AQTNZYJFCSJOBB-UHFFFAOYSA-N 254.336 2.413 10 10 CECE CCC[C@@H](NCc1cnc(SC)s1)C(=O)O 2243767484 JDSXXUWYLZIUTH-MRVPVSSYSA-N 260.384 2.208 10 10 CECE CSCC[C@H](N)CNCc1cnc(SC)s1 2243856100 MNNSXMKZRNJVDT-QMMMGPOBSA-N 277.484 2.035 10 10 CECE CSc1ncc(CNCCC2(N)CCC2)s1 2243844912 RQMVITALXWZTQA-UHFFFAOYSA-N 257.428 2.226 10 10 CECE CC1CN(C(=O)N2CCCC[C@H](CN=[N+]=[N-])C2)C1 2254020296 PHQHGCYMUOTLOR-LLVKDONJSA-N 251.334 2.471 10 10 CECE Oc1cc(Br)ccc1CNCC[C@@H]1CCO1 2246224721 IYNLJZOMBWIVGI-LLVKDONJSA-N 286.169 2.423 10 10 CECE COC[C@]1(C)C[C@H]1N[C@H](C)c1ccc(O)cc1O 2257026484 MKDIWRQMDHZBMD-FZQKWOKYSA-N 251.326 2.173 10 10 CECE CCN[C@@H](C)c1ccc(N(C)[C@H](C)CO)cc1C 2257464788 FZFSNQBVTSHWRL-OLZOCXBDSA-N 250.386 2.483 10 10 CECE CC[C@H]1CCN[C@H]1CNCc1cnc(SC)s1 2248740921 FPWYWPNBTKLWDD-ONGXEEELSA-N 271.455 2.343 10 10 CECE COCCN(C[C@H](C)O)c1ccc([C@@H](C)N)c(Cl)c1 2272391591 LYQJEQPIXFSFTE-WDEREUQCSA-N 286.803 2.193 10 10 CECE CCCc1cnnc(C(=O)Cc2ccc(N)cc2)c1 2272976304 ODHKBEGGRSBSAU-UHFFFAOYSA-N 255.321 2.437 10 10 CECE C[C@@]1(O)[C@H]2C[C@@H]1CN(c1ccc(OCF)cc1)C2 2263940158 XUSHMJSOROEIDI-YABSGUDNSA-N 251.301 2.200 10 10 CECE CN(C)CCCN(CCN)c1ccc2c(c1)CCCC2 2280543216 UASKIMDDYDNCQY-UHFFFAOYSA-N 275.440 2.282 10 10 CECE Nc1ccc(C[C@@H](O)c2ccc3c(n2)CCOC3)cc1 2294886849 NTEADWSFGMYDPY-MRXNPFEDSA-N 270.332 2.013 10 10 CECE COc1cc(COc2cc(F)cnc2N)cc(OC)c1 2295065183 IVDCIGYVDWFFCN-UHFFFAOYSA-N 278.283 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10 10 CECE CC1(C)CCCN(Cc2ccc(N)cc2)[C@H]1C(=O)O 1891347052 KYHGSRFIOKTPGL-ZDUSSCGKSA-N 262.353 2.344 10 10 CECE CCCN(CCC(=O)OCC)C(=O)Cc1ccc(N)cc1 84875974 MPNIUJFVJIYDOL-UHFFFAOYSA-N 292.379 2.003 10 10 CECE [N-]=[N+]=NCCNC(=O)c1ccc(C(F)(F)F)cn1 166163297 FQTSMPAEECJNKM-UHFFFAOYSA-N 259.191 2.141 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@H](N2CCC2)C1 702232714 RCSFZIUBBGEEPI-OAHLLOKOSA-N 259.397 2.128 10 10 CECE C[C@@H]1C[C@@H](CNCc2ccc(F)c(F)c2O)CN1C 703214442 MORBUPYOQAKHHD-ZJUUUORDSA-N 270.323 2.100 10 10 CECE Nc1cc2c(cc1N1CC[C@H](C(F)F)C1)CCC(=O)N2 706351095 OAFIXAHSWUTZLZ-VIFPVBQESA-N 281.306 2.245 10 10 CECE C[C@@H](CO)[C@@H](C)NCc1c(O)cccc1Br 706871965 UIGGEXIAPKYMGQ-DTWKUNHWSA-N 288.185 2.261 10 10 CECE CC(C)OCCCOc1ccc(N2CCNCC2)cc1 690430613 BLQVRJWWHKFYGP-UHFFFAOYSA-N 278.396 2.290 10 10 CECE CNCc1ccc(N2CC[C@@H](N(C)C)[C@H](C)C2)cc1 693662037 PJDWWSXOTZLFPM-CZUORRHYSA-N 261.413 2.182 10 10 CECE CC[C@H](NCC[C@H]1CCCS1(=O)=O)c1ccccc1O 714353738 ZRIJVKSYMFAOPL-OCCSQVGLSA-N 297.420 2.400 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Oc1ccccc1CN1CCC(c2cnc[nH]2)CC1 361064558 AIMAGZWEYFZKJO-UHFFFAOYSA-N 257.337 2.495 10 10 CECE C[C@@H]1C[C@@H]1N1C[C@H](NCc2cc(Cl)ccc2O)CC1=O 361388547 FQPPOPGMNJMXEQ-WQAKAFBOSA-N 294.782 2.145 10 10 CECE Cc1cc(Cl)cc(CN2CC[C@@]3(CNC(=O)C3)C2)c1O 369397468 GZOIPBXZJAFVNR-OAHLLOKOSA-N 294.782 2.066 10 10 CECE CCOC(=O)COCCN1CCCc2cc(OC)ccc21 809934519 VLEHFWVVZMHLCV-UHFFFAOYSA-N 293.363 2.028 10 10 CECE CCN(C(=O)c1ccnc(OC)c1)c1ccc(N)cc1 2166934508 HGWZEJBGRZNPIU-UHFFFAOYSA-N 271.320 2.339 10 10 CECE O=C1C[C@H]2C[C@H]1C[C@]2(O)c1ccc(N2CCCC2)cc1 2167086053 YUTFGXXKOAAAMO-QEORTHHSSA-N 271.360 2.473 10 10 CECE CCOc1cnc(N(CC)Cc2ccc(N)cc2)nc1 2165617062 HYPDDRUJHGIKJF-UHFFFAOYSA-N 272.352 2.484 10 10 CECE CCN1CCc2cc(N3CC[C@H]4CNC[C@H]4C3)ccc21 2163072823 CYHJVRCJTXTZQA-GJZGRUSLSA-N 271.408 2.115 10 10 CECE CN1CCc2cc([C@H](N)[C@]3(O)CC[C@H]4C[C@@H]4C3)ccc21 2163122847 FSNIHWISAMZXFD-ISGYEWALSA-N 272.392 2.230 10 10 CECE CN1CCc2cc([C@H](N)[C@](C)(O)c3nccs3)ccc21 2163126770 LDIQNMWEQJGFGH-ZFWWWQNUSA-N 289.404 2.043 10 10 CECE CCN1CCc2cc([C@H](NC)[C@]3(O)CCSC3)ccc21 2163136541 UMXFSQQMHONCQB-HOTGVXAUSA-N 292.448 2.198 10 10 CECE CCN1CCc2cc([C@H](N)[C@@H](O)CC(F)(F)F)ccc21 2163141809 YJXKQJXAJCRCKQ-STQMWFEESA-N 288.313 2.382 10 10 CECE CCN(CC)c1ccc([C@H](N)[C@@H](O)[C@H](C)COC)cc1 2163147207 KUMLWVFLWXYIJZ-KCXAZCMYSA-N 280.412 2.176 10 10 CECE C[C@@H]1CO[C@H]([C@@H](NN)c2ccc(N3CCCC3)cc2)C1 2163161422 WGGZONNEQYIYPU-RCBQFDQVSA-N 275.396 2.216 10 10 CECE CC(=O)C(=O)COC(=O)[C@@H](c1ccc(F)cc1)C(C)C 808531821 YIWBJEHZUJFESQ-CQSZACIVSA-N 280.295 2.267 10 10 CECE CN(C)c1ccc([C@@H](NN)c2nc(C3CC3)ns2)cc1 2163426659 ZGGBVNYQCCLCBM-GFCCVEGCSA-N 289.408 2.034 10 10 CECE COc1c([N+](=O)[O-])ccc(CN2CC(C3CC3)C2)c1O 812775204 JAPCVUVKPWCPKV-UHFFFAOYSA-N 278.308 2.151 10 10 CECE C[C@@]1(C(=O)NCCc2ccc(O)c(O)c2)C[C@@H]2C[C@@H]2C1 815833780 DKAICVFGBXGTKB-ATCWAGBWSA-N 275.348 2.193 10 10 CECE Cc1cc(CN2C[C@H](C(N)=O)CC[C@@H]2C)ccc1N(C)C 815037330 IAHLZBTUZUFCLK-DZGCQCFKSA-N 289.423 2.147 10 10 CECE OCCC1(CNCc2cc(Cl)c(F)cc2O)CC1 816575670 VNHAWLWKPWSOMH-UHFFFAOYSA-N 273.735 2.437 10 10 CECE Cc1cc(Cl)cc(CNC[C@H](C)N(C)C)c1O 824988380 KZVXXWYJMBQZFF-JTQLQIEISA-N 256.777 2.394 10 10 CECE CCN[C@H](C)c1ccc(N(C)C2CC(C(N)=O)C2)cc1 723159459 CKZDVRBIFDDWBQ-NUYPLMSZSA-N 275.396 2.057 10 10 CECE CN(C)c1ccc(/C=C\CNC[C@H]2CCOC2)cc1 835036074 NAHMWWUVPZHEAB-ABCZVMIZSA-N 260.381 2.392 10 10 CECE CSCCCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832272503 GHXFXDRBFFDWHY-CQSZACIVSA-N 295.452 2.012 10 10 CECE CC[C@@H](N[C@H]1C[C@@H](C(N)=O)C1)c1ccc(C)cc1O 846187510 ANALSRYRDFMGNL-NTZNESFSSA-N 262.353 2.005 10 10 CECE O=C([C@H]1CC[C@H]2CCCCN21)N1Cc2cccc(O)c2C1 913726563 RNZPJNCBNDHOJV-UKRRQHHQSA-N 286.375 2.251 10 10 CECE O=C(NCc1c(O)cccc1F)[C@H]1CCN1C1CCCC1 928711381 NZMGSOAHGPJYEI-CQSZACIVSA-N 292.354 2.164 10 10 CECE NCc1ccc2c(c1)CCCN2CCOC1CCOCC1 863539333 ABEKCDSLMBLIHB-UHFFFAOYSA-N 290.407 2.094 10 10 CECE CCNCc1cnc(SCCC(=O)OCC)s1 2247589544 JYFIWYWQEQANGD-UHFFFAOYSA-N 274.411 2.298 10 10 CECE C[C@H]1CCCN(CCc2ccc(N)cc2)[C@H]1CCO 697213823 UDNLEACKXOZNAX-BBRMVZONSA-N 262.397 2.294 10 10 CECE Cc1ccc(O)c(CNC(=O)c2cnn3c2CCCC3)c1 862758258 UUYOHUPPTADPCU-UHFFFAOYSA-N 285.347 2.163 10 10 CECE Nc1ccc(CN(C(=O)[C@H]2C[C@H]2CF)C2CC2)cc1 1875810796 GRBHMOOSHFIGGI-FZMZJTMJSA-N 262.328 2.365 10 10 CECE CCOc1ccc(CN2CCC[C@H](C(=O)OC)C2)c(O)c1 768231548 VWCGEQNMOBYWFS-ZDUSSCGKSA-N 293.363 2.176 10 10 CECE COCC1(C(=O)N2Cc3cccc(O)c3C2)CCCC1 871205538 GRHRTAWGFWFRHM-UHFFFAOYSA-N 275.348 2.441 10 10 CECE CC1(C)CCC(=O)N1C(=O)CCc1ccc(N)cc1 1876421341 JRWUTMHDSQWDQM-UHFFFAOYSA-N 260.337 2.129 10 10 CECE C[C@H](NC(=O)/C=C/c1cnccn1)c1ccc(N(C)C)cc1 775403267 IMYUZUYORWVHAM-PPGNKHEKSA-N 296.374 2.433 10 10 CECE C[C@H](NS(=O)(=O)[C@@H]1CCC[C@@H]1F)c1ccccc1O 1877587518 FSDKVCXSRXMBAB-XHVZSJERSA-N 287.356 2.263 10 10 CECE CC1(C)[C@H](O)CCN1Cc1cc(F)cc(F)c1O 894816415 VFLNNNGIJXJTFT-LLVKDONJSA-N 257.280 2.016 10 10 CECE C[C@@H]1CCc2[nH]nc(C(=O)N3Cc4cccc(O)c4C3)c2C1 899172913 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CCCNCc1ccc(N(C)[C@H]2C[C@H](O)C2)cc1C 2122886360 NXOMCDJNRZCHAF-WKILWMFISA-N 262.397 2.454 10 10 CECE Cc1cc(CO)ccc1N(C)C[C@@H]1C[C@@H]2C[C@@H]2CO1 2122825691 DQDHWHPCYYQXBJ-ZNMIVQPWSA-N 261.365 2.349 10 10 CECE COc1cccc(CNC(=O)Cc2ccc(C=O)cc2)c1O 1622779804 WQYXWLZOKRNWEZ-UHFFFAOYSA-N 299.326 2.072 10 10 CECE NC(=O)N=Nc1ccc(C(=O)NOC/C=C/Cl)cc1 1629186012 PSWUKEVBEMCWFV-NPLKHIETSA-N 282.687 2.263 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1ccc2[nH]ccc2c1 1912157339 SFRLUBTZNWQLJE-GFCCVEGCSA-N 273.296 2.282 10 10 CECE [N-]=[N+]=NCCCN[C@@]1(C(=O)O)CCOCC12CCCC2 1912162524 XAYWKBGBVWVYOE-CYBMUJFWSA-N 282.344 2.081 10 10 CECE COc1ccc(N(C)Cc2cc(=O)n3ccccc3n2)cc1 1559969339 AFKSXOYOURFFOV-UHFFFAOYSA-N 295.342 2.340 10 10 CECE NN1C(=O)C(=Cc2cccc(Cl)c2)SC1=S 1911827639 FVNWBTNOMANCCW-UHFFFAOYSA-N 270.766 2.415 10 10 CECE COc1cccc(C(=O)NCc2cc(C)ccc2O)c1O 1633283266 XTRJAYPMSSBDIC-UHFFFAOYSA-N 287.315 2.345 10 10 CECE [N-]=[N+]=N[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)o2)C1 1912158252 VVRNGEFUNRRVGJ-ZETCQYMHSA-N 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2.100 10 10 CECE CC(C)CN(C)C1CN(c2ccc3c(c2)CC[C@H]3O)C1 2192536898 GQTNXSUSMWIDCW-QGZVFWFLSA-N 274.408 2.443 10 10 CECE CN(Cc1ccccc1O)Cc1cccnc1C(N)=S 2192591035 CDUTVHYCBNKEMN-UHFFFAOYSA-N 287.388 2.053 10 10 CECE C[C@]12CN(C(=O)c3cccc(O)c3O)CC[C@H]1C2(F)F 2187911491 GOJFEGVKDVILTB-MFKMUULPSA-N 283.274 2.215 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H]2CCOC[C@@H]2F)cc1 2066653703 UGUYZQDSYGUJCL-LEWSCRJBSA-N 253.317 2.303 10 10 CECE C[C@H](N)c1ccc(N(C)[C@H]2CCOC[C@@H]2F)cc1 2066656287 LOIJPRBSHZEUJQ-BPNCWPANSA-N 252.333 2.270 10 10 CECE CC1(C)OCCC[C@@H]1C(=O)NCCCCN=[N+]=[N-] 2066887563 CEPQXPAZPQAPKI-SNVBAGLBSA-N 254.334 2.398 10 10 CECE CCc1nc(N)c(C)c(=N[C@H](C)c2ccccc2O)[nH]1 2192628717 ZRHCYXOUQFJYTR-SNVBAGLBSA-N 272.352 2.230 10 10 CECE OC[C@]12C[C@H]1CC[C@H]2NCc1ccc(Cl)cc1O 2068393765 ILIMNHIWWGAZRR-LERXQTSPSA-N 267.756 2.296 10 10 CECE CO[C@H]1C[C@H](CF)N(Cc2c(O)cccc2F)C1 2069995321 FXCRWABWQRMCBY-ZJUUUORDSA-N 257.280 2.090 10 10 CECE Cc1nc(NC(=O)c2ccc(O)c(O)c2)nc(Cl)c1C 2196375108 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261.365 2.456 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@H]2OCCO[C@@H]2C)c1 2087422940 ADHORMFQOHTMQJ-YWPYICTPSA-N 265.353 2.155 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)[C@H]2C[C@H]3[C@@H](C2)C3(F)F)C1 2107615968 WNJVZWIUGXRAHZ-AATLWQCWSA-N 270.283 2.437 10 10 CECE COc1ccc(O)c([C@H](C)N2CCC[C@@](C)(N)C2)c1 2087764231 SPDKQUZNFOBRGF-XHDPSFHLSA-N 264.369 2.275 10 10 CECE CC[C@@]1(N)CCCN(Cc2ccc(N(C)C)cc2)C1 2087763047 GLHGHWSPBJXJCB-MRXNPFEDSA-N 261.413 2.456 10 10 CECE COc1nsc(OC)c1[C@H](O)Cc1ccc(N)cc1 2087957938 ADLZHVKHDWAASZ-SNVBAGLBSA-N 280.349 2.019 10 10 CECE CN(CCc1ccc(N)cc1)C1(CO)CC(C)(C)C1 2108323725 GUPLUZFTMXNFCU-UHFFFAOYSA-N 262.397 2.294 10 10 CECE C[C@@H](NC[C@@H]1CC2(CC2)CO1)c1c(O)cccc1O 2110095632 DMRMBKIDQRAHII-MNOVXSKESA-N 263.337 2.318 10 10 CECE COCC[C@@H]1CN(c2ccc(CO)c(Cl)c2)CCO1 2091823572 RPZMRRNXCBFNHP-CYBMUJFWSA-N 285.771 2.074 10 10 CECE CCCNCc1ccc(N2C[C@H](O)[C@H](F)C2)cc1C 2092822243 KQXYOTAGJDHBIJ-CABCVRRESA-N 266.360 2.014 10 10 CECE CC[C@@H](O)c1ccc(N(C)CCn2ccnc2)cc1 2093011950 SLGBOMMZVPIJBQ-OAHLLOKOSA-N 259.353 2.463 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)C3(CC3)C2)c(F)c1 2093335388 IHELJWUHADMGHA-QMTHXVAHSA-N 264.344 2.067 10 10 CECE CN(Cc1cnsc1)c1ccc(CO)cc1[N+](=O)[O-] 2093901338 DGLHXYHHZJZVNM-UHFFFAOYSA-N 279.321 2.180 10 10 CECE Cc1nscc1CN(C)C(=O)c1cccc(O)c1O 2093903761 LABPVTCFYNWHIR-UHFFFAOYSA-N 278.333 2.135 10 10 CECE Nc1ccc(C[C@@H](O)c2cnc3n2CCCC3)cc1 2094778176 IFKTWLKDMMZAHY-CQSZACIVSA-N 257.337 2.078 10 10 CECE Cc1sccc1C(=O)NCCOc1ccc(N)cc1 2095660097 VCHZVIJJWNVOOB-UHFFFAOYSA-N 276.361 2.448 10 10 CECE CC[C@@H]1CCOC[C@@H]1NCCc1ccc(O)c(O)c1 2096178725 IOTJXTSVZSDKMY-OLZOCXBDSA-N 265.353 2.045 10 10 CECE CN[C@@H](C)c1ccc(N2CC[C@@]3(CCO3)C2)c(F)c1 2097006354 GJSWXBZQHBKVQQ-XHDPSFHLSA-N 264.344 2.475 10 10 CECE COc1cc(N)ccc1N1C(=O)CCCCCC1=O 2097352377 FKJBHLOYEKXPLR-UHFFFAOYSA-N 262.309 2.101 10 10 CECE CCN(C)[C@@H]1CCN(c2ccc(CNC)c(C)c2)C1 2097716906 CGQUTFLAVIYJGU-MRXNPFEDSA-N 261.413 2.245 10 10 CECE CC[C@@H](c1ccccc1O)N1CCO[C@H](C)[C@H]1C(=O)O 2201098920 BSALSHDLZXZUJP-OSMZGAPFSA-N 279.336 2.017 10 10 CECE Nc1ccc(O)c(CNC(=O)[C@@]23CCC[C@H]2CSC3)c1 2201878518 OQETWMBWXFQFBE-XHDPSFHLSA-N 292.404 2.124 10 10 CECE OCc1ccc(N2C[C@H](O)C23CCC3)cc1C(F)(F)F 2201408548 QYUOZEGAYUAVJM-LBPRGKRZSA-N 287.281 2.301 10 10 CECE Cc1ncc(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])s1 2213585692 QHCQJANAIOYPSW-YUMQZZPRSA-N 251.315 2.413 10 10 CECE Nc1ccc(CCN2CC[C@@H]3CC[C@H](O)C[C@@H]3C2)cc1 2204103613 FIPAIMORDPQDFV-UXLLHSPISA-N 274.408 2.294 10 10 CECE CC[C@H]1COC[C@H]1N(C)c1ccc(CNC)c(OC)c1 2204536049 LFTLHSHHIIBEPD-SWLSCSKDSA-N 278.396 2.276 10 10 CECE CCN1[C@@H](C)CN(c2ccc(CN)c(OC)c2)C[C@H]1C 2204550896 YYZMXFONGLOKLU-BETUJISGSA-N 277.412 2.073 10 10 CECE CO[C@H](CNCc1ccc(C)cc1O)C1CCOCC1 2204623583 FUYMCCPKCJAVSC-MRXNPFEDSA-N 279.380 2.232 10 10 CECE CN1C[C@H]2C[C@H](NCc3ccc(F)cc3O)CC[C@H]2C1 2204746900 LFWHDBZOVKFQOZ-GZBFAFLISA-N 278.371 2.351 10 10 CECE CSc1ncc(CNC[C@@H]2COCC(C)(C)O2)s1 2208573140 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COc1ccc(N(C)C2CC(F)(F)C2)c(CCN)c1 2227686274 QGZLTQYTYUPHLA-UHFFFAOYSA-N 270.323 2.430 10 10 CECE CCNCc1cc(OC)ccc1N1CC2(CSC2)C1 2227681340 IGLAKBQUIPHZIU-UHFFFAOYSA-N 278.421 2.358 10 10 CECE CC[C@@H]1COC[C@@H]1N(C)c1ccc(OC)cc1CN 2227680536 YANYSHOEKPLIOB-ABAIWWIYSA-N 264.369 2.015 10 10 CECE Nc1cc(NS(=O)(=O)C2CC3(CCC3)C2)ccc1O 2227844916 VELITVGGGWLOHL-UHFFFAOYSA-N 282.365 2.049 10 10 CECE C[C@@H]1CC[C@@H]1CN(C)CC(=O)c1ccc(O)c(O)c1 2227876392 ANTDVHUJTAZNOZ-ZYHUDNBSSA-N 263.337 2.258 10 10 CECE Nc1ccc(OC[C@@H](O)COC[C@H]2C[C@H]3C[C@@H]2C3)cc1 2238222813 MUTCMSJKXHHZDP-COMQUAJESA-N 277.364 2.071 10 10 CECE CC1(C)[C@H](O)CN1c1ccc(CNC2CCC2)cc1F 2240088147 NYIPNXCKESTPHO-OAHLLOKOSA-N 278.371 2.427 10 10 CECE CCCN(Cc1ccc(N)cc1)c1cnc(OC)cn1 2280769868 RJDMDHSBAXJJNW-UHFFFAOYSA-N 272.352 2.484 10 10 CECE CCCN(C[C@@H](C)O)c1ccc(CO)c(Cl)c1 2250511690 QFJAHGRDQZXQIE-SNVBAGLBSA-N 257.761 2.430 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CC[C@H](O)[C@H]3C2)c(C)c1 2240825507 VYGSWAQOVFYERL-DYWXZXKOSA-N 274.408 2.483 10 10 CECE CCCN(CC(N)=O)c1ccc([C@H](C)NCC)cc1C 2240833818 SCJHODRHJAOIDV-ZDUSSCGKSA-N 277.412 2.367 10 10 CECE O[C@@H]1CN(c2ccc3c(c2)OCCO3)C2(CCCC2)C1 2241085628 DVMWTDAYBYYMBZ-ZDUSSCGKSA-N 275.348 2.342 10 10 CECE CC[C@H]1NCC[C@H]1NCc1cnc(SC)s1 2243825719 MVUOOBUPYCYCHX-NXEZZACHSA-N 257.428 2.095 10 10 CECE c1nc(SCC2COC2)sc1CNC1CC1 2244508010 RGVWKLGJLKHVRW-UHFFFAOYSA-N 256.396 2.134 10 10 CECE CO[C@H]1C[C@H](OC)CN(c2ccc([C@@H](C)N)c(C)c2)C1 2285135454 FVFSPENFMONXLZ-SNPRPXQTSA-N 278.396 2.255 10 10 CECE CC[C@H]1[C@H](O)CCN1c1ccc2c(c1)CC[C@H]2NC 2273224380 JHQDIQYTMUXWTA-OWCLPIDISA-N 260.381 2.243 10 10 CECE CN(CC[C@@H]1CCO1)c1ccc(CN)c(F)c1F 2263972891 SNLLQIAOTXOTSV-SNVBAGLBSA-N 256.296 2.039 10 10 CECE C[C@H]1CCN(CCN[C@@H](C)c2cc(O)ccc2O)C1 2274584535 UPXXFHKLTUOYKM-RYUDHWBXSA-N 264.369 2.090 10 10 CECE COC1(CNCc2c(O)cccc2F)CC(CF)C1 2274655849 APDWOUWLYFCAMM-UHFFFAOYSA-N 271.307 2.386 10 10 CECE COc1ccc(N2CCOC(C)(C)[C@H]2CO)cc1Cl 2267745498 XJRLZPAVNRYQHM-CYBMUJFWSA-N 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2.242 10 10 CECE CCOc1cccc(CN2[C@@H](C)CC[C@H]2C(=O)O)c1O 844935704 SNIIFYUIADZQTF-JQWIXIFHSA-N 279.336 2.228 10 10 CECE O=C(NCc1ccc(O)cc1O)[C@H]1CCCC12CC2 910958016 VSHSTOROAPSNIO-GFCCVEGCSA-N 261.321 2.294 10 10 CECE O=C(NCc1c(O)cccc1F)N[C@@H]1C[C@H]1C1CC1 922307708 JCEDWCSIWSTVSC-JOYOIKCWSA-N 264.300 2.129 10 10 CECE C[C@H]1CCC[C@@H](CNCc2cc([N+](=O)[O-])ccc2O)O1 850379809 YKBKTJSCCLVBGY-GWCFXTLKSA-N 280.324 2.348 10 10 CECE CC(C)CN1CCC2(CC1)CC(=O)O[C@@H]2CN=[N+]=[N-] 757217370 JTHQQSXQACBAFN-LLVKDONJSA-N 266.345 2.350 10 10 CECE CC(=O)C(=O)COC(=O)[C@H]1CCC[C@H]1Cc1ccccc1 850332992 ARTMNFUFNOQJCM-GJZGRUSLSA-N 288.343 2.347 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@H](OC)[C@H]2CCOC2)c1 850484215 FIYNEEPBISZILD-MKBNYLNASA-N 295.379 2.103 10 10 CECE CN(C)c1ccc([C@H](O)CC2=CSC3=NCCN23)cc1 699223775 QOAQSHVHWVYJCM-CQSZACIVSA-N 289.404 2.436 10 10 CECE C[C@@]1(C(F)F)CN(c2ccc(CN)cc2)CCO1 698729062 MEVFOXIWWIKYOV-ZDUSSCGKSA-N 256.296 2.006 10 10 CECE Nc1ccc(C[C@@H](O)[C@H]2CCc3cccnc32)cc1 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10 10 CECE COC(=O)c1ccc2c(cnn2Cc2ccc(N)cc2)c1 75944827 ZIQYUJUASUYIQP-UHFFFAOYSA-N 281.315 2.453 10 10 CECE N=C(N)Cc1nc2ccc(F)cc2n1-c1ccc(N)cc1 76001877 TXWIDAZROUHITA-UHFFFAOYSA-N 283.310 2.225 10 10 CECE CC(C)CN(CC(=O)O)Cc1c(O)cccc1F 1964703232 HPOVLIAPHIOTQF-UHFFFAOYSA-N 255.289 2.074 10 10 CECE C[C@H]1CCS[C@H]1C(=O)N(C)Cc1ccccc1O 1964873226 FONGTGJAUCZHBH-GXFFZTMASA-N 265.378 2.492 10 10 CECE C[C@@H]1O[C@H](C)[C@H](CNCc2ccc(O)c(O)c2)[C@@H]1C 701015995 GUAMXMDPLDVYEQ-LSCVPOLPSA-N 265.353 2.247 10 10 CECE COC(=O)CCCCCNCc1cccc(F)c1O 83513809 BFGYPPIIMUXZRY-UHFFFAOYSA-N 269.316 2.354 10 10 CECE COc1cc(Cl)cc(CNc2nnn(C)c2C)c1O 701739588 RECYHAALEMOKFA-UHFFFAOYSA-N 282.731 2.103 10 10 CECE CN(C)c1ccc(CN2CC(C)(CC(=O)O)C2)cc1 1892442630 AIALBSOKKBCOLL-UHFFFAOYSA-N 262.353 2.049 10 10 CECE NNc1cc(Sc2nccs2)nc(C2CC2)n1 87917153 OPVJSUUEQSZGKM-UHFFFAOYSA-N 265.367 2.247 10 10 CECE Cc1ccc(CNN(C)C)c(O)c1Br 1893705137 XGJUIJLTQSLKOH-UHFFFAOYSA-N 259.147 2.029 10 10 CECE CN1CCCc2cc(CN[C@@H]3C[C@H]4CC[C@H]3O4)ccc21 250415443 XPWLYSYEQDLVNN-BFYDXBDKSA-N 272.392 2.479 10 10 CECE COc1cccc(CNC[C@H]2CCC(C)(C)O2)c1O 189725461 XNGOCIIVJYRLJG-GFCCVEGCSA-N 265.353 2.448 10 10 CECE Nc1ccc(OCCNc2ncnc3c2CCC3)cc1 61277811 HPIQUANNFMIGMC-UHFFFAOYSA-N 270.336 2.038 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H]2[C@H]3CC[C@@H](NC3)[C@H]2C1 709172219 FNGCKUCKQLEEPV-XHXGSEDSSA-N 272.392 2.383 10 10 CECE C[C@@H](O)c1ccc(N2CCC(=O)N(C)CC2)c(Cl)c1 688914987 LDUWVSAPAOCPTB-SNVBAGLBSA-N 282.771 2.062 10 10 CECE COCCNCc1ccc(N2CC[C@@H](F)C2)cc1C 689825324 OYIOXPWWEBXAAU-CQSZACIVSA-N 266.360 2.279 10 10 CECE Oc1c(CN[C@H]2C[C@H]3CCCN(C2)C3)ccc(F)c1F 717157851 VEZWCXUSNQHWLQ-PWSUYJOCSA-N 282.334 2.244 10 10 CECE OC[C@@H](CC(F)(F)F)NCc1ccc(F)c(F)c1O 717712294 DKNSBAYAXWOFTH-SSDOTTSWSA-N 285.212 2.073 10 10 CECE CC[C@@H]1CCCCC[C@]1(NCCCN=[N+]=[N-])C(N)=O 691142747 VXPJHIIERWQBDL-DGCLKSJQSA-N 267.377 2.491 10 10 CECE Cc1cc(CNC2CC2)ccc1N1CC2CC1(CO)C2 694521882 ARFOWOOZQZVOFO-UHFFFAOYSA-N 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10 10 CECE CCc1sc(-c2ccc(O)c(O)c2)nc1CCN 2044964553 WSOHCCDEELAOEV-UHFFFAOYSA-N 264.350 2.285 10 10 CECE CN(Cc1cc(F)ccc1O)[C@H]1CCCCNC1 2050023648 MBJYJLRYXDJRAR-ZDUSSCGKSA-N 252.333 2.105 10 10 CECE Nc1ccc(NC(=O)[C@@H]2[C@@H]3CCC(F)(F)[C@H]32)cc1 2051235741 RDUIULSWOYAPNN-HBNTYKKESA-N 252.264 2.499 10 10 CECE CC1(C)CSCCN1CCOc1ccc(N)cc1 2051329808 FZHUMTMOFJOEJF-UHFFFAOYSA-N 266.410 2.475 10 10 CECE CO[C@@H]1CC[C@H](CNCc2c(O)cccc2F)C1 2054473874 GEENMFIYNPOWNV-WDEREUQCSA-N 253.317 2.436 10 10 CECE CN1CCCc2cc(CN[C@H]3C[C@H](CCO)C3)ccc21 2199114816 KJVGFISXJURMFC-SAZUREKKSA-N 274.408 2.320 10 10 CECE Cc1cccc(CN(C)C[C@@H]2OCC[C@@H]2F)c1O 2058672903 PJFLEDMLPYPYNG-STQMWFEESA-N 253.317 2.259 10 10 CECE CCN(CC)C(=O)OCCNc1ccc(N)cc1 2058773428 UNJDMVZSSMOCHT-UHFFFAOYSA-N 251.330 2.159 10 10 CECE O=C(CN1[C@H]2CC[C@@H]1C[C@@H](F)C2)c1ccc(O)c(O)c1 2192128203 BNNXMWOGBDYBSV-CNDDSTCGSA-N 279.311 2.245 10 10 CECE C[C@@H](N)c1ccc(N2CCOC[C@H]2CF)c(F)c1 2062396222 IHRSRLLKFWVMCI-MWLCHTKSSA-N 256.296 2.020 10 10 CECE Nc1ccc(CCNC(=O)c2cnc(Cl)s2)cc1 2062466358 MBHQPBAATFBMSO-UHFFFAOYSA-N 281.768 2.351 10 10 CECE CN(Cc1cnsn1)c1ccc2c(c1)CC[C@@H]2O 2065080334 IHPLLMKIWBCUMA-ZDUSSCGKSA-N 261.350 2.154 10 10 CECE C[C@H](COC(F)F)N[C@H](C)c1cc(O)ccc1O 2067272361 VEBVGLVYHZKTLW-HTQZYQBOSA-N 261.268 2.376 10 10 CECE CC[C@]1(C)C[C@H](NCc2ccc(O)c(O)c2)CO1 2069117468 LKHXHMXGYIQWHN-SMDDNHRTSA-N 251.326 2.145 10 10 CECE C[C@@H](O)c1cc(F)c(N(C)CCCCO)c(F)c1 2074085857 BUQVLMZCSGGTHJ-SECBINFHSA-N 259.296 2.227 10 10 CECE COC[C@](C)(CN1CCC[C@H](CN=[N+]=[N-])C1)OC 2077549263 UOWVBKOSFYCYJQ-NEPJUHHUSA-N 256.350 2.060 10 10 CECE OC[C@H](F)C1CC(NCc2cccc(Cl)c2O)C1 2078431413 ZBHQQAIXUHRYLB-CBINBANVSA-N 273.735 2.244 10 10 CECE C[C@H](NC[C@@H]1C[C@]12CCOC2)c1ccc(O)cc1O 2100480024 PFPCAGHUOFARNE-PGUXBMHVSA-N 263.337 2.175 10 10 CECE CN1CCc2cc(CNC34COC(C)(C3)C4)ccc21 2100450886 ZFDDEIZSNJPTLP-UHFFFAOYSA-N 258.365 2.090 10 10 CECE COc1ccc([C@H](C)N[C@H]2CC[C@H]2N(C)C)c(O)c1 2101500782 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Oc1ccc(CNC[C@H]2C[C@H]3[C@@H](C2)C3(F)F)cc1O 2107762337 PVMOCCAALIWPSN-RTCCRHLQSA-N 269.291 2.479 10 10 CECE CC[C@@]1(N)CCCN([C@H](C)c2c(O)cccc2O)C1 2087766407 OKWSIPNEJHCNKM-IAQYHMDHSA-N 264.369 2.362 10 10 CECE COc1ccc(N2CCO[C@@H](C3CC3)CC2)c(N)c1 2088560868 VUKQNVXFPICSCH-OAHLLOKOSA-N 262.353 2.283 10 10 CECE Cc1ccc(O)c2c1[C@H](C)C[C@H]2N(C)OCC(=O)O 2089753486 VYGUHZVKRVUFMS-NXEZZACHSA-N 265.309 2.197 10 10 CECE C[C@@H](N)c1ccc(N2CC(CO)C2)cc1C(F)(F)F 2092543172 YQZPAMPLGBIUSV-MRVPVSSYSA-N 274.286 2.154 10 10 CECE C[C@H](c1c(O)cccc1O)N1CCN(C)CC1(C)C 2094037632 WTJIJUBPKPEYTD-LLVKDONJSA-N 264.369 2.185 10 10 CECE CCNCc1ccc(N2C[C@@H](O)C(F)(F)C2)c(Cl)c1 2095742932 ARRJSLHTWAYCHL-GFCCVEGCSA-N 290.741 2.266 10 10 CECE Cc1cc(N2CCCN(C)CCC2)ccc1CCN 2096281398 AYNOQXCGHZWGTM-UHFFFAOYSA-N 261.413 2.028 10 10 CECE C[C@H](c1cncs1)N(C)C(=O)Cc1ccc(N)cc1 2099531842 VBWIMGACCLDCPL-SNVBAGLBSA-N 275.377 2.487 10 10 CECE COc1ccc(N2CCNC[C@H]2CC(F)F)c(F)c1F 2201642934 TVYMOCRSZBIFIL-MRVPVSSYSA-N 292.276 2.407 10 10 CECE CCCN(C(=O)c1cccc(O)c1O)[C@H]1CCSC1 2113796772 LGQQFPOXZGUNCE-JTQLQIEISA-N 281.377 2.456 10 10 CECE CC[C@H](NC)c1ccc(N2CC[C@@H]3C[C@@]3(O)C2)cc1 2114561085 RAKPPIGWJNWSJQ-VNQPRFMTSA-N 260.381 2.318 10 10 CECE CCN(Cc1ccc(Cl)cc1O)[C@H]1CCCNC1=O 2114773685 YBCZTBSUIPPVNI-LBPRGKRZSA-N 282.771 2.146 10 10 CECE CC1(C)[C@@H]2[C@H](CCN2c2ccc(CO)c(Cl)c2)[C@H]1O 2121667592 JWGLZRBHZVILIC-FPMFFAJLSA-N 281.783 2.428 10 10 CECE C[C@@H](N)c1ccc(N(C)CC23COC(C)(C2)C3)cc1O 2202875813 ZUSZIPKXFIHXHS-VHWKEVPUSA-N 276.380 2.417 10 10 CECE CN(CCOc1ccc(N)cc1)Cc1ccncc1F 2202990967 TVKWYQARJKULMN-UHFFFAOYSA-N 275.327 2.314 10 10 CECE COCCNCc1ccc(N2C[C@@H](C)[C@@H]2C)cc1OC 2204544551 CPWCSGCVPZGYNV-OLZOCXBDSA-N 278.396 2.276 10 10 CECE CCN(CC)C1[C@H]2CN(Cc3ccc(C)cc3O)C[C@H]12 2204662486 JAGNUQRIFGQAHE-GJZGRUSLSA-N 274.408 2.473 10 10 CECE Cc1cccc(CNC(=O)[C@H]2NCCCC2(C)C)c1O 2204609172 FVPMUHDRIJWOQQ-CQSZACIVSA-N 276.380 2.095 10 10 CECE Cc1cccc(CNCc2cncc(C(=O)O)c2)c1O 2204625064 NRHGQXOCJJBXFT-UHFFFAOYSA-N 272.304 2.084 10 10 CECE C[C@H](NC(=O)CC1CCC(N)CC1)c1ccccc1O 2205413753 DUKWHYCLPQAOFX-HIFPTAJRSA-N 276.380 2.477 10 10 CECE CCNCc1ccc(N2CC[C@]2(C)CCO)cc1OC 2205509974 HWUWSLIKUAEKKO-MRXNPFEDSA-N 278.396 2.156 10 10 CECE C[C@H](O)c1ccc(N2Cc3cc(O)nnc3C2)c(Cl)c1 2206105446 XCKXCKAGSGVIFJ-QMMMGPOBSA-N 291.738 2.409 10 10 CECE CNCc1ccc(N(C)[C@@H]2[C@H]3[C@@H]4C[C@@H]5[C@@H]([C@H]34)[C@@H]52)c(F)c1 2208388987 NXXVJSLJQZVTDR-NHHMPUFOSA-N 272.367 2.492 10 10 CECE CN(Cc1ccc(N)cc1)c1ccnc2c1CCO2 2270790082 DILCDOVFJFZONK-UHFFFAOYSA-N 255.321 2.235 10 10 CECE COc1ccc(N2C[C@H]3CC[C@]3(CO)C2)c(F)c1 2219612750 PGHPMQJSBXANGL-QMTHXVAHSA-N 251.301 2.043 10 10 CECE C[C@@H](CN(C)C)CN1CCc2cc(N(C)C)ccc21 2224604438 INTLMBMLAHDBNG-ZDUSSCGKSA-N 261.413 2.313 10 10 CECE CCOc1ncc([C@H](O)c2ccc(N(C)C)cc2)cn1 2234832473 DBYBKQVPBNVLNW-CQSZACIVSA-N 273.336 2.023 10 10 CECE C[C@H](c1ccccc1O)N(C)c1cn2c(n1)COCC2 2235082486 INRBCIWDDHJHFZ-LLVKDONJSA-N 273.336 2.316 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)[C@H]1CC12CCOCC2 2225792685 PFZFSIRPTCJWJZ-OUAUKWLOSA-N 264.329 2.151 10 10 CECE CCN1CCC[C@@H](N(C)c2ccc(OC)cc2CN)C1 2235954073 JUGPPUXQSRBDQW-CQSZACIVSA-N 277.412 2.074 10 10 CECE COc1ccc(N2CCC[C@@](C)(OC)C2)c(CCN)c1 2235971374 APBJFEVUQBWCHN-MRXNPFEDSA-N 278.396 2.202 10 10 CECE COc1ccc(N2CCCO[C@H](C)C2)c(C[C@H](C)N)c1 2235968805 WBSXRKHUSIZERT-QWHCGFSZSA-N 278.396 2.200 10 10 CECE CCO[C@@H]1C[C@@H]2CN(c3ccc(OC)cc3N)C[C@H]21 2225940942 MQWYLTGOZODWEI-IXPVHAAZSA-N 262.353 2.139 10 10 CECE C[C@H]1C[C@H]1CCN(C)CC(=O)N(C)c1ccc(N)cc1 2236497049 RWDSVNOVPAELGU-QWHCGFSZSA-N 275.396 2.210 10 10 CECE C[C@@H]1Cc2cc(N3CCSC[C@@H]3CCO)ccc2O1 2226702807 ITAMPKGJWQNPGB-RISCZKNCSA-N 279.405 2.314 10 10 CECE COc1ccc(N2CC[C@@H]3[C@H](CO)[C@@H]3C2)c(F)c1F 2226922429 NVIPFIQLRIWZKG-AEJSXWLSSA-N 269.291 2.038 10 10 CECE C[C@H](N)c1cc(F)c(N2CC=C[C@@]2(C)CO)c(F)c1 2228874613 FZVAXEALAUWAGZ-XPTSAGLGSA-N 268.307 2.112 10 10 CECE COCCNCc1ccc(N2CC[C@H]3C[C@]3(F)C2)cc1 2239016561 NTISYKNCJGTNSU-HOCLYGCPSA-N 278.371 2.361 10 10 CECE CC[C@H](C)NCc1ccc(N2C[C@H]3C[C@@]3(CO)C2)cc1 2240053620 SGPKMGJUTPJENB-LXZKKBNFSA-N 274.408 2.393 10 10 CECE C[C@@H]1[C@@H](O)CN1c1c(F)cc(CNC2CCC2)cc1F 2240036701 ZTLMZXWBOQSQFM-OTYXRUKQSA-N 282.334 2.176 10 10 CECE CO[C@@]1(CO)CCCN(c2ccc([C@@H](C)O)cc2C)C1 2240838422 ZMZXSJLNQBQBJT-CJNGLKHVSA-N 279.380 2.026 10 10 CECE COCCO[C@@H]1CCN(c2ccc([C@H](C)O)cc2C)C1 2240838331 SXCFVBUWRKCWQS-DZGCQCFKSA-N 279.380 2.290 10 10 CECE CCc1nn(C)c(C(=O)NCC2(CN=[N+]=[N-])CC2)c1Cl 2240934347 HGEGXKVVNMEKLM-UHFFFAOYSA-N 296.762 2.456 10 10 CECE CSc1ncc(CN[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2O)s1 2248613315 ULGCRRCJBQJGGW-UUTMEEIUSA-N 270.423 2.114 10 10 CECE Cc1cccc(CN[C@@H]2CCCN(C3CC3)C2)c1O 2273145843 ILBJTYYQATZFIZ-CQSZACIVSA-N 260.381 2.417 10 10 CECE CCO[C@H]1C[C@@H](NC(=O)N(CC)c2ccc(N)cc2)C1 2280147061 ZTBBJTMNOMGJJH-XBXGTLAGSA-N 277.368 2.372 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)[C@@]23CC[C@@](CF)(C2)OC3)CC1 2290498851 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10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1C[C@@H]2C[C@H]1CO2 2328572485 GNYIOLYKMQWEKC-STQMWFEESA-N 259.305 2.070 10 10 CECE Cc1cc(N(C)C[C@H]2[C@@H]3CCCO[C@@H]32)ccc1CN 2330710279 WNSXXEJWYIBSHR-JYJNAYRXSA-N 260.381 2.315 10 10 CECE CO[C@H]1C[C@@H]2C[C@H](NCc3c(O)cccc3F)C[C@@H]21 2331960851 QYAREBJPPPHQJM-VEABSNGSSA-N 265.328 2.434 10 10 CECE Nc1ccc(CCC(=O)OCC2(O)CCCC2)cc1 2335615104 AHIQCSSFHYBHDZ-UHFFFAOYSA-N 263.337 2.050 10 10 CECE CN[C@H]1CN(c2ccc3c(c2)CCN3C)CC1(C)C 2336293630 GYKPLAVWZNGMJI-HNNXBMFYSA-N 259.397 2.113 10 10 CECE CN(C)C[C@@H]1CCN1c1ccc(CN)c(C2CC2)c1 2339144120 TYNONCIJNOXPQD-HNNXBMFYSA-N 259.397 2.163 10 10 CECE CN(c1ccc(CN)c(C2CC2)c1)[C@@H]1CCC[C@H]1O 2339162294 YDZRTMYEJPZZCR-HZPDHXFCSA-N 260.381 2.372 10 10 CECE Cc1c([C@H](C)N)ccc(N2C[C@H](F)[C@@H](CO)C2)c1C 2340847635 GYHDOGKJOJNCEI-SCRDCRAPSA-N 266.360 2.090 10 10 CECE Cc1c([C@H](C)N)ccc(N2CC=C[C@]2(C)CO)c1C 2341063888 JNAUYKCHIZHYGT-XJKSGUPXSA-N 260.381 2.450 10 10 CECE COC(=O)[C@@](N)(CSc1nccs1)[C@@H]1CC12CCC2 2345027024 IKJHYXBABSXBMD-NOZJJQNGSA-N 298.433 2.296 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1C[C@H]2CC[C@H]1[C@@H](O)C2 2349959305 GSPARFHUMYOBRO-KNPMLCFXSA-N 260.381 2.364 10 10 CECE C[C@@H](C[C@H]1CCOC1)N1CCc2cc(CN)ccc21 2353014913 ZDCDRJUZQAPJEK-GXTWGEPZSA-N 260.381 2.323 10 10 CECE CN(C)c1ccc([C@@H](O)[C@]23CCC[C@@]2(F)CNC3)cc1 2355209249 XTEGFYBXZZTNID-BZUAXINKSA-N 278.371 2.268 10 10 CECE Oc1cc2c(cc1CNC[C@@H]1C[C@H]3C=C[C@@H]1C3)OCO2 2355459870 GZIJIGLODKIBOW-TUAOUCFPSA-N 273.332 2.423 10 10 CECE CSCC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 172230055 SOOWLMDTLGTTOL-CYBMUJFWSA-N 295.404 2.263 10 10 CECE Cc1cc(CNCC(C)C)ccc1N(CC(N)=O)C(C)C 62737563 IVBMZKQVOWOQSK-UHFFFAOYSA-N 291.439 2.441 10 10 CECE C[C@H](c1ccc(O)cc1O)N1[C@@H]2CC[C@@H]1CC(N)C2 104009665 VOKHOHNEUBXCPJ-YUSALJHKSA-N 262.353 2.113 10 10 CECE COc1cc(Cl)cc(CN2C[C@@H]3C[C@H]2C[C@H](N)C3)c1O 2357166999 RLGZWNUKWGGAFB-BIMULSAOSA-N 296.798 2.366 10 10 CECE O=C1NCCCC[C@@H]1NCc1c(O)ccc2ccccc12 36977279 VTBCBQCMPJCLMG-HNNXBMFYSA-N 284.359 2.304 10 10 CECE CNCc1ccc(N2CCC2)c(Br)c1 307564741 ZVTJHOHHABIUFX-UHFFFAOYSA-N 255.159 2.379 10 10 CECE COCCN(c1ccc([C@H](C)N)c(O)c1)C(C)C 123167398 WBETYTFGTIKTOG-NSHDSACASA-N 252.358 2.273 10 10 CECE C[C@@H](N[C@H](C)c1cc(O)ccc1O)C(=O)N1CCCCC1 37784260 MPRTXNJGGIPLAQ-VXGBXAGGSA-N 292.379 2.149 10 10 CECE CC(C)OC(=O)Cc1nnc2cc(Cl)ccc2n1 75284334 WCAIPOKSYPRUBO-UHFFFAOYSA-N 265.700 2.172 10 10 CECE [N-]=[N+]=NCCCn1cc(I)cn1 70678338 QLDXCSLEVMRSOX-UHFFFAOYSA-N 277.069 2.188 10 10 CECE Cc1cc(Cl)cc(CN(CCO)CC(F)F)c1O 193020580 ZJMBBYUIUBJSDQ-UHFFFAOYSA-N 279.714 2.413 10 10 CECE CCN[C@H](C)c1ccc(N2CCC[C@@H](C(N)=O)C2)c(F)c1 222114946 SAHVQXKAEADXMM-DGCLKSJQSA-N 293.386 2.198 10 10 CECE CCOc1cccc(CN(C)C2CCN(C)CC2)c1O 131734737 XVXAPMSFIQMNDW-UHFFFAOYSA-N 278.396 2.317 10 10 CECE CCOc1cccc(CN[C@@H](C)CN2CCCC2)c1O 49149448 LPONIVPVSOGKHU-ZDUSSCGKSA-N 278.396 2.365 10 10 CECE C[C@H]1CN[C@H](C)CN1[C@H](C)c1cc(F)ccc1O 227385047 QUNMRTCCAFQVLI-OUAUKWLOSA-N 252.333 2.275 10 10 CECE [N-]=[N+]=NCCN[C@H](C(=O)O)c1ccc(Br)cc1 90256521 LCZIZGZKJBYTNQ-VIFPVBQESA-N 299.128 2.475 10 10 CECE Oc1ccc(CNc2ccnc(Cl)c2)c(O)c1O 236600704 OQZQQDKARFYDSQ-UHFFFAOYSA-N 266.684 2.464 10 10 CECE Cc1cccc(CN2CCS[C@H]3COCC[C@H]32)c1O 245870136 RHFWDEYAKFTKBH-KGLIPLIRSA-N 279.405 2.407 10 10 CECE CC(C)CN1CC[C@@H](N)[C@H]1c1ccc2c(c1)CCN2C 250601674 SDTBFOGGRWIFJJ-NVXWUHKLSA-N 273.424 2.409 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@H](C(=O)O)[C@H]1C 252651226 DCOHASJNFRMJTJ-KKZNHRDASA-N 267.300 2.387 10 10 CECE C[C@@H]1CCSCCN1c1cc2c(cc1N)OCCO2 385382989 YZUPBAWWMXAUAS-SNVBAGLBSA-N 280.393 2.372 10 10 CECE CN(CCF)C(=O)NCc1ccc(N2CC=CC2)cc1 297436959 ZMOIWPZJEWEFNZ-UHFFFAOYSA-N 277.343 2.174 10 10 CECE CCN[C@@H](C)c1ccc(N(OC)[C@H]2CCOC2)cc1O 2164736911 HEOXPYWEODFKES-AAEUAGOBSA-N 280.368 2.219 10 10 CECE C[C@@H](CCCN)NC(=O)/C=C/c1ccc(N(C)C)cc1 701401691 ZDZNCHNTIXUSIX-YKWSONSWSA-N 275.396 2.009 10 10 CECE C[C@H]1C[C@](N)(c2ccc3c(c2)CCN3C)c2nccn21 2163065939 GGZNCNJCCNTWTQ-ZBEGNZNMSA-N 268.364 2.042 10 10 CECE CN(C)c1ccc([C@@]2(O)[C@@H](CN)CCC23CCC3)cc1 2163068172 FFRYFLOWXWKZFY-RHSMWYFYSA-N 274.408 2.479 10 10 CECE COC[C@H](N)C[C@@H](O)c1ccc(N2CCCCC2)cc1 2163107186 NLPQKTGYPVTWNU-GDBMZVCRSA-N 278.396 2.074 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)C1(O)CC=CC1 2163232269 YIXLODAJPAQKBJ-MRXNPFEDSA-N 272.392 2.411 10 10 CECE C[C@@H](O)c1ccc(N(C)Cc2cnn(C)c2Cl)cc1O 2166118849 WGQMBIFPKKGMHW-SECBINFHSA-N 295.770 2.469 10 10 CECE CN[C@H](c1ccc2c(c1)CCCN2C)c1ncc(C)[nH]1 2164032628 YTOKIVAAGGXBPB-OAHLLOKOSA-N 270.380 2.409 10 10 CECE C[C@H](N[C@@H]1CNCC[C@@H]1C)c1cc(F)cc(F)c1O 817968861 NWGKYYKKBWPDOQ-MWODSPESSA-N 270.323 2.319 10 10 CECE CCOc1ccc(O)c(CN2CCN(C)C[C@H]2CC)c1 816660345 ACNMUUIQHZTHFT-CQSZACIVSA-N 278.396 2.317 10 10 CECE Cc1c(C)n(C)c2ccc(OS(C)(=O)=O)cc12 817151922 GTXHZVUODIBXFO-UHFFFAOYSA-N 253.323 2.134 10 10 CECE CCc1ccc2scc(O)c2c1[C@H](O)C(=O)O 725301482 TVSJQUJNPVZUOT-NSHDSACASA-N 252.291 2.287 10 10 CECE CC(C)(C)c1nnc(C(=O)NCc2c(O)cccc2F)o1 902943651 ACDFERBXHRUYLO-UHFFFAOYSA-N 293.298 2.142 10 10 CECE CCCCOCCCNC(=O)/C=C\c1ccc(O)c(O)c1 588403667 UIVZOLAKLWWGCP-VURMDHGXSA-N 293.363 2.434 10 10 CECE C[C@@H]1CNCC[C@H]1NCc1c(O)ccc(Cl)c1F 841063241 GUKKFPVJXUEWPP-LDYMZIIASA-N 272.751 2.272 10 10 CECE CCCN(Cc1cc(OCC)ccc1O)[C@@H]1CCNC1 843051753 DCOKBKBIUVVHCI-CQSZACIVSA-N 278.396 2.365 10 10 CECE Nc1ccc(NC(=O)N2CCOC[C@@H]2CC2CC2)cc1 926140477 AUOYUDBPCKGOTJ-AWEZNQCLSA-N 275.352 2.302 10 10 CECE Cc1ccc(C(=O)N[C@@H](c2ncccn2)C2CC2)c(O)c1O 928580010 WXOLTFZGPQXDOW-GFCCVEGCSA-N 299.330 2.077 10 10 CECE CC[C@H](NC[C@H]1COCCN1C)c1cccc(Cl)c1O 858523508 RDGDGSBVOZDQSB-FZMZJTMJSA-N 298.814 2.417 10 10 CECE Cc1cc(N(C)C)ccc1CN[C@H]1CN(C)C[C@@H]1C 756118305 LZZSEFVHJQLXAQ-BBRMVZONSA-N 261.413 2.101 10 10 CECE CCn1cc(CNC(=O)N[C@@H](C)c2ccccc2O)cn1 868602889 AWVPMJXSBVLCOL-NSHDSACASA-N 288.351 2.169 10 10 CECE Nc1ccc(NC(=O)NC[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1 873329269 XTGJUZMNLIBYEO-LEWSCRJBSA-N 275.352 2.348 10 10 CECE CC(C)CNC[C@H]1CCN1c1ccc2c(c1)OCCO2 696323639 ZLESRFJYMATAAB-CQSZACIVSA-N 276.380 2.282 10 10 CECE C[C@@H](NC(=O)c1ccc(Cl)nn1)c1ccccc1O 1457973267 POGIVEYSQGKHRR-MRVPVSSYSA-N 277.711 2.327 10 10 CECE COc1ccccc1NC[C@@H](O)C[C@](C)(O)C1CC1 872210207 QIANPIGRPXYZCF-WFASDCNBSA-N 265.353 2.019 10 10 CECE CO[C@H](CC(=O)N1Cc2cccc(O)c2C1)C(F)(F)F 871205618 IRIIGQIGNNAQRQ-LLVKDONJSA-N 289.253 2.202 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)CC[C@@H]3N)C[C@]1(C)O 1876955040 DNXKBVZMZAVJGL-RLCCDNCMSA-N 260.381 2.230 10 10 CECE CO[C@]1(C(F)(F)F)CCN(C(=O)c2cc(O)cs2)C1 881681946 BLVHNGFTAVDRME-SNVBAGLBSA-N 295.282 2.247 10 10 CECE CN[C@@H]1CCc2cc(N3CCC[C@H]3[C@@H](C)O)ccc21 1879180421 CNRNVLGBLDKIKS-LYRGGWFBSA-N 260.381 2.243 10 10 CECE Cc1ccc(C(=O)N2CCC[C@@H]3COCC[C@H]32)c(O)c1O 780967990 ZHJADXGUZGGELS-DGCLKSJQSA-N 291.347 2.047 10 10 CECE Cc1cc(Br)cc(CN2C[C@H]3C[C@@]3(O)C2)c1O 895654536 SIULTKMKBOGMPL-ZWNOBZJWSA-N 298.180 2.030 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@H]4COCC[C@@H]43)ccc21 1878824294 LRAWOYBRFAIYHR-MAZHCROVSA-N 258.365 2.118 10 10 CECE CC[C@@H]1[C@H](CO)CCN1Cc1cc(C)cc(OC)c1O 894881358 OPJQKFYAMPCUFL-GXTWGEPZSA-N 279.380 2.302 10 10 CECE C[C@H](O)c1cc(F)c(N(C)CC2(O)CCC2)c(F)c1 1880484756 AJNCQQYVYWDBDE-VIFPVBQESA-N 271.307 2.369 10 10 CECE c1cc2c(cc1CN[C@H]1CCC3(C1)OCCO3)CCO2 1201714287 LEILHDVUIIAHDL-AWEZNQCLSA-N 275.348 2.007 10 10 CECE COc1cccc(O)c1CN(C)C[C@H]1CC[C@@H](C)O1 1885290353 YAICEKNVSYDEDD-VXGBXAGGSA-N 265.353 2.400 10 10 CECE CN(C)c1ccc2c(c1)CCN2Cc1cnccn1 1884261052 XCGSSIRYVBKSRH-UHFFFAOYSA-N 254.337 2.105 10 10 CECE Cc1cc(CO)ccc1N1CC[C@H](c2nncs2)C1 1886566971 CVLDDQTXJZHRAO-LBPRGKRZSA-N 275.377 2.333 10 10 CECE NC(=O)[C@@H]1CCC[C@H](NCc2cc(Cl)ccc2O)C1 1964557191 YZSWRNFHIFGUAG-SKDRFNHKSA-N 282.771 2.179 10 10 CECE Cn1nc(C(=O)NCCCCN=[N+]=[N-])cc1C(F)(F)F 1963732387 MXGVSDXJTWVNKK-UHFFFAOYSA-N 290.249 2.259 10 10 CECE CC[C@]1(c2cc(F)c(F)c(F)c2O)COCCN1 83443504 GBNUZZXKVSBDFH-GFCCVEGCSA-N 261.243 2.035 10 10 CECE CCOC1(CN(C)c2ccc(N)cc2)CCOCC1 702699395 PAFLQMPFKFFBOH-UHFFFAOYSA-N 264.369 2.291 10 10 CECE COCCn1cccc1C(=O)N1CCC[C@@H]1CN=[N+]=[N-] 692854576 LINIVFDFTTXUCI-LLVKDONJSA-N 277.328 2.049 10 10 CECE CCOc1cccc(CNCc2cnc(C)cn2)c1O 61320156 NNGXNBVSVOEVHA-UHFFFAOYSA-N 273.336 2.179 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@H]2[C@H]1C(C)(C)[C@@H]2O 693168016 SIWFXFDNWNPNQT-CWRNSKLLSA-N 274.408 2.439 10 10 CECE CC[C@H]1C[C@@H](N(C)c2c(F)cc(CO)cc2F)CO1 688501524 IDNMGOMLRCZGHO-MNOVXSKESA-N 271.307 2.461 10 10 CECE C[C@H](O)[C@H]1CCCCN1c1ccc(CN)cc1F 688677860 YMFNOGYUAOJRRF-GXFFZTMASA-N 252.333 2.024 10 10 CECE CCc1cccc(CN(C)CC23CCN(CC2)C3)c1O 715575084 JXWBHWPFCDZENK-UHFFFAOYSA-N 274.408 2.482 10 10 CECE Oc1ccc(Cl)cc1CNCC[C@@H](O)C(F)(F)F 717409417 TXYRTFZGKXPXDT-SNVBAGLBSA-N 283.677 2.449 10 10 CECE Cc1cnc(CNCc2ccc(Br)cc2O)[nH]1 693535660 UBFOLAYJSVPHJB-UHFFFAOYSA-N 296.168 2.476 10 10 CECE COC[C@H](CCNCc1cccc(Cl)c1O)OC 694289327 SDYFKMSPGKXFPU-NSHDSACASA-N 273.760 2.187 10 10 CECE Nc1ccc(CC(=O)Nc2cncc(Cl)c2)cc1 690358671 ACYFGWAHMHGEGQ-UHFFFAOYSA-N 261.712 2.498 10 10 CECE CCO[C@H]1CCC[C@](NCCCN=[N+]=[N-])(C(=O)OC)C1 721164972 UXOXVZBFEKSFDB-WCQYABFASA-N 284.360 2.167 10 10 CECE COC[C@@H](CN(C)[C@H](C)c1ccc(C)cc1O)OC 691292517 IIWOISZRHILRFR-CHWSQXEVSA-N 267.369 2.355 10 10 CECE Cc1cn(C)nc1CN1CCCc2cc(CN)ccc21 723976802 QCNVHMLFEDKFEF-UHFFFAOYSA-N 270.380 2.140 10 10 CECE C[C@@H](N)c1ccc(N2CCC(CN(C)C)CC2)cc1O 93670988 CPUAOTLTYJFOBL-GFCCVEGCSA-N 277.412 2.190 10 10 CECE COc1ccc(N(CCO)CC(C)C)cc1OC 197920077 QTYDRECTMWRQBV-UHFFFAOYSA-N 253.342 2.159 10 10 CECE CCNCc1ccc(N2CC[S@](=O)C[C@@H]2C)cc1C 2115335654 SHVCQINNKYGXDM-DJJJIMSYSA-N 280.437 2.062 10 10 CECE C[C@@H]1OCC[C@H]1CN(C)c1ccc(CN)c(F)c1F 2121124661 CDUYUGINRUXECN-ONGXEEELSA-N 270.323 2.285 10 10 CECE CCc1ccc(C(=O)NCc2cc(O)ccc2O)c(O)c1 1471661718 ZRINQMGTSRYGGN-UHFFFAOYSA-N 287.315 2.296 10 10 CECE CO[C@@H]1C[C@@H]2[C@H]1CCN2CCCc1ccc(N)cc1 2121832364 PFVDICUNTDUCSF-BZUAXINKSA-N 260.381 2.311 10 10 CECE COC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1CCSC1(C)C 1912192396 FTMSGQAOGYLWFW-UWVGGRQHSA-N 286.401 2.350 10 10 CECE CC(C)Cn1ncnc1CN1CC[C@@H](CN=[N+]=[N-])C1 1912190872 KQBIGYKVRKLMBQ-NSHDSACASA-N 263.349 2.066 10 10 CECE C[C@@H]1C[C@H]2CN(c3ccc(CN)cc3Cl)CCN2C1 2124850269 GIDQHSMWYWWHDW-YPMHNXCESA-N 279.815 2.329 10 10 CECE O=C1N=C(NO)SC1=Cc1ccc(Cl)cc1 2296658441 ZSHPOCMEVKCXBL-UHFFFAOYSA-N 254.698 2.289 10 10 CECE [N-]=[N+]=NCCNC1(C(=O)O)C[C@H]2CCC[C@@H](C2)C1 1912201649 XHHNTTVTYPZGHG-UWVGGRQHSA-N 252.318 2.310 10 10 CECE COc1ncccc1C(=O)N1CCC(CN=[N+]=[N-])CC1 1912211443 WZYZQAJMTKSJFX-UHFFFAOYSA-N 275.312 2.253 10 10 CECE Cc1ccc(C(=O)N(C)CCN=[N+]=[N-])c(Cl)n1 1912206557 SUMYVPUXGSVPNS-UHFFFAOYSA-N 253.693 2.426 10 10 CECE Cc1cccc(O)c1CN1CC=C(CC(=O)O)CC1 2125208251 QPPNOQKLYQIWKX-UHFFFAOYSA-N 261.321 2.307 10 10 CECE O=C(/C=C\c1cncc(F)c1)N1CCc2cc(F)cnc21 1583711046 OFLWBBDMAZOIIL-UPHRSURJSA-N 287.269 2.357 10 10 CECE COc1ccc(O)c([C@H](C)NC(=O)CCCCCO)c1 1595806810 WCYQSLREBLJJLP-NSHDSACASA-N 281.352 2.131 10 10 CECE Oc1ccc(CNCc2c[nH]nc2C(F)F)c(O)c1 2126650570 WRWCTLVBZQIYDU-UHFFFAOYSA-N 269.251 2.048 10 10 CECE CC(C)(O)C1CC(NCc2cc(F)cc(F)c2O)C1 1965943099 APXQXLFXTOCIQW-UHFFFAOYSA-N 271.307 2.310 10 10 CECE c1cc(N2CCOCC2)ccc1CNC[C@@H]1[C@H]2CC[C@H]21 1966076371 GQQHCMOCMOLCKM-FVQHAEBGSA-N 272.392 2.269 10 10 CECE C[C@@H]1[C@@H](O)CCCN1c1ccc2c(c1)CCC[C@H]2O 2128279612 REJIURDVVHNITR-XFBWCDHKSA-N 261.365 2.406 10 10 CECE OCC[C@@H]1CCN(c2ccc3c(c2)CCC[C@H]3O)C1 2128270331 DLYCILGCBJJZPV-BLLLJJGKSA-N 261.365 2.265 10 10 CECE COCCOCCCN(C)c1ccc([C@H](C)O)cc1 2129760902 VCUWBRDRLUYHQJ-ZDUSSCGKSA-N 267.369 2.229 10 10 CECE CC(C)N(CC(N)=O)c1ccc(/C=C/C(=O)O)cc1Cl 164364456 PWQBVRJUQXXKLB-GQCTYLIASA-N 296.754 2.138 10 10 CECE Cc1ccc([C@H](C)NC[C@H](C)[S@](C)=O)c(O)c1 168855421 MKNOBLFGKJBENX-PSVSLLHZSA-N 255.383 2.118 10 10 CECE CC(=O)CCC(C)(C)C(=O)NCCc1ccc(O)c(O)c1 159826136 MJTQAMKHSUGHQV-UHFFFAOYSA-N 293.363 2.152 10 10 CECE CCO[C@H](CNC(=O)Nc1ccc(N)cc1)C(C)C 2131819225 XOQPWOSVTCMNQD-CYBMUJFWSA-N 265.357 2.451 10 10 CECE O[C@H]1CCc2cc(N3CC[C@@H](C4(O)CC4)C3)ccc21 2130502526 JBDJQGXLKSOBDG-DOMZBBRYSA-N 259.349 2.017 10 10 CECE NC(=O)[C@H](NCc1cccc(Cl)c1O)c1ccccc1 1664533096 AWJGIRHZPDVRQW-CYBMUJFWSA-N 290.750 2.362 10 10 CECE Oc1ccc(Cl)cc1CNCCOC1CCOCC1 922932951 JAJJKIDNHHZOBE-UHFFFAOYSA-N 285.771 2.331 10 10 CECE CCCN(Cc1ccccc1O)C[C@@H]1CCCS1(=O)=O 929752907 HXTRBTKQKHWDRD-AWEZNQCLSA-N 297.420 2.181 10 10 CECE Cc1ccc(O)c(CNCC(=O)Nc2ncc(C)s2)c1 1857876675 MSHSLBIOEQIMPY-UHFFFAOYSA-N 291.376 2.194 10 10 CECE CON1CCN(c2ccc([C@H](C)N)cc2Cl)CC1 1915787891 JOLMFJAOYYKRQV-JTQLQIEISA-N 269.776 2.043 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCN3C(=O)CC[C@@H]3C2)c1 211666707 VXIYCLKXNWDQIQ-QWHCGFSZSA-N 274.364 2.068 10 10 CECE CNCc1ccc(N(C)[C@@H]2CC[C@@H]2COC)c(F)c1 2142415569 FEFVPEXHTIIKFY-TZMCWYRMSA-N 266.360 2.406 10 10 CECE COc1cc(N(C)CCOCC2CC2)ccc1CO 2139682609 KECQMOBUVHQCNZ-UHFFFAOYSA-N 265.353 2.050 10 10 CECE COc1cc(N(C)[C@@H]2CCOC2(C)C)ccc1CO 2139685330 PWSSYPZSFZMKEN-CQSZACIVSA-N 265.353 2.191 10 10 CECE Oc1cccc(F)c1CN[C@H]1C[C@H]2CC[C@H]1[C@H](O)C2 2139753752 NWXAYWGTGIWHCJ-FRWLMAKKSA-N 265.328 2.170 10 10 CECE C[C@H]1C[C@@H](C)CN(Cc2ccccc2O)[C@H]1C(=O)O 2136409849 WOVTZVMZPQRTSI-UHIISALHSA-N 263.337 2.323 10 10 CECE COC[C@H]1CC[C@@H](NCc2cc3c(cc2O)OCO3)C1 1918601154 PMKJLEXFVNIYMM-CMPLNLGQSA-N 279.336 2.026 10 10 CECE CCN[C@@H](C)c1ccc(N2CC[C@@H](CO)C2)c(F)c1 226454900 DPZZQVWEXBEUJX-NWDGAFQWSA-N 266.360 2.315 10 10 CECE CC(C)Cc1noc(CN(C)c2ccc(CN)cc2)n1 1967636711 YTOJAAKVVTUCTH-UHFFFAOYSA-N 274.368 2.363 10 10 CECE CSC[C@@H](C)N(C)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2 226897544 AJGJYZMSMAMVIT-JMCQJSRRSA-N 299.827 2.480 10 10 CECE COc1cccc(CNCC[C@@H]2CC[C@@H](C)O2)c1O 1967777518 XENWCXSCMKQDOE-YPMHNXCESA-N 265.353 2.448 10 10 CECE Cc1cccc(CN[C@H]2C[C@@H]3CCCCN3C2)c1O 1969661916 NHHWPCJTFQZRCB-GJZGRUSLSA-N 260.381 2.417 10 10 CECE CN[C@H]1C(=O)Nc2cc(N3CCC=C(C)C3)ccc21 230814485 HTVXMDHTKFTLNM-CQSZACIVSA-N 257.337 2.056 10 10 CECE N[C@@H]1CCc2cc(N3CCCC[C@@H]3CCO)ccc21 2141716360 LXDIGBRJBZAJEF-CZUORRHYSA-N 260.381 2.374 10 10 CECE CCOCCN(CCOCC)c1ccc(CN)c(F)c1 124778476 RRWHEHHGNFPLIY-UHFFFAOYSA-N 284.375 2.164 10 10 CECE O=C(C[C@]12CCC[C@H]1C2)NCCc1ccc(O)c(O)c1 1968738915 HMZWELMQYAEMEC-BLLLJJGKSA-N 275.348 2.337 10 10 CECE CO[C@@H]1C[C@H](NCc2cccc(O)c2O)C1(C)C 234835200 XUDIRLNJWHMVOY-NWDGAFQWSA-N 251.326 2.001 10 10 CECE CSC[C@H](C)N(C)[C@H](C)C(=O)Nc1ccc(N)cc1 252749827 ASEINYSDEWYCFL-WDEREUQCSA-N 281.425 2.279 10 10 CECE NCc1ccc(N2CCC[C@H](CCO)C2)c(F)c1F 236218990 OXNJTTMUAOKLQJ-SNVBAGLBSA-N 270.323 2.022 10 10 CECE NCc1cc(F)c(N2C[C@@H]3CCC[C@H](O)[C@H]3C2)c(F)c1 2150927175 NPHMSUHYDXUTAF-MJVIPROJSA-N 282.334 2.021 10 10 CECE CN(C)CCOc1ccc(N(C)CC(C)(C)CO)cc1 2143511695 VCWYNFUJWJTCLK-UHFFFAOYSA-N 280.412 2.082 10 10 CECE COc1cc2c(cc1OC)N(C[C@H]1CCOC1)CC2 1970282142 RHLSHGWDOWDAKD-LLVKDONJSA-N 263.337 2.103 10 10 CECE CN1CCCc2cc([C@H](O)[C@@H](N)c3ccsn3)ccc21 2147705613 ISVWSCSEAIOEQK-GJZGRUSLSA-N 289.404 2.259 10 10 CECE CN1C[C@H](N)C[C@H]1c1cc(Cl)cc(Cl)c1O 1952310564 FMMNSCPUXBFIDZ-XCBNKYQSSA-N 261.152 2.403 10 10 CECE COc1ccc(O)c([C@H](C)N2CC[C@@H](N)C[C@@H]2C)c1 131497339 CZPGBEVLFZALRU-SDDRHHMPSA-N 264.369 2.273 10 10 CECE Nc1ccc(OCCN2CC=CC[C@@]23CCOC3)cc1 2150029934 XTAPAQSLKRWQLZ-INIZCTEOSA-N 274.364 2.069 10 10 CECE COc1ccc(O)c(CN[C@@H](CO)[C@@H]2CC=CCC2)c1 1971212831 ULFBXTFECPBNLS-DOMZBBRYSA-N 277.364 2.208 10 10 CECE Nc1cc2c(cc1N1C[C@H]3CSC[C@@H](C3)C1)OCCO2 2144768853 BPFQNRKHLLOQEK-QWRGUYRKSA-N 292.404 2.229 10 10 CECE CC1(O)CC(NCc2c(O)cccc2Br)C1 1976121861 SHFIWDCXBXGKFZ-UHFFFAOYSA-N 286.169 2.158 10 10 CECE C[C@H]1CCC[C@@H](NC(=O)NCc2cc(N)ccc2O)C1 2144838819 RWDJTLWTMHHUHG-GXFFZTMASA-N 277.368 2.352 10 10 CECE CC(C)C[C@@H]1CCN1c1ccc2c(c1)N(C)C(=O)[C@H]2O 2148951643 QVZWZQWQOCTFHO-WFASDCNBSA-N 274.364 2.321 10 10 CECE Cc1cccc(CN[C@H](C)[C@@H]2CCCS(=O)(=O)C2)c1O 2146111747 JZTAIZMPZVMOOC-TZMCWYRMSA-N 297.420 2.004 10 10 CECE C[C@]1(O)CCCN(c2ccc(CNC3CC3)cc2)C1 163376125 BSSZIGLAHQDGOA-INIZCTEOSA-N 260.381 2.290 10 10 CECE C[C@H]1CNCCCN1Cc1ccc(Br)cc1O 1997007083 AGCYCKSMLLAMEK-JTQLQIEISA-N 299.212 2.339 10 10 CECE C[C@H](NCC(=O)OC(C)(C)C)c1cc(O)ccc1O 164059533 SUMCQTXMHLCYQG-VIFPVBQESA-N 267.325 2.090 10 10 CECE CC[C@@H](NC[C@H]1CN(CC)CCO1)c1ccccc1O 164047215 RNFJORJYOINICP-DZGCQCFKSA-N 278.396 2.154 10 10 CECE NCc1ccc(N(C2CC2)C2COC2)cc1Br 1998326919 PMPXXIPQWPXIKR-UHFFFAOYSA-N 297.196 2.275 10 10 CECE CNCc1ccc(N2CC[C@]2(C)CO)cc1C(F)(F)F 2153562254 JFRPHPRMDZAVII-CYBMUJFWSA-N 288.313 2.386 10 10 CECE C[C@@H](NCc1cccc(Cl)c1O)c1cnn[nH]1 2003286961 ZMOPRVJMIKVUOQ-SSDOTTSWSA-N 252.705 2.015 10 10 CECE CC1(C)OC2(CNC(=O)Nc3ccc(N)cc3)CC1C2 2153967610 HOOWNLFITOPIRU-UHFFFAOYSA-N 275.352 2.348 10 10 CECE CC(=O)N1CCCN(c2ccc3c(c2)CCCN3)CC1 168372060 QSDSCWFANVOUTB-UHFFFAOYSA-N 273.380 2.103 10 10 CECE CN(C)CC1CCN(CCc2ccc(N)cc2)CC1 42388673 AYLFSNZQSNGNCN-UHFFFAOYSA-N 261.413 2.085 10 10 CECE OCc1ccc(N2C[C@@H]3CCO[C@H]3C2)c(Cl)c1 2004625074 OZIISQZYWWTPPZ-GWCFXTLKSA-N 253.729 2.057 10 10 CECE Oc1cc(Cl)ccc1CN1C[C@@H]2CCO[C@H]2C1 2004631479 BQFFCEPZVUZXCI-GWCFXTLKSA-N 253.729 2.266 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@H]2N)[C@@H]1CCC12CCC2 2154894911 GZGNHGPVZSISCB-KGLIPLIRSA-N 271.364 2.407 10 10 CECE CP(C)(=O)CCC(=O)NCC1(CN=[N+]=[N-])CC1 2008520971 GJTIMBCLAQAMQC-UHFFFAOYSA-N 258.262 2.206 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H](O)[C@@H]2C)c(Br)c1 2011372969 MIQISNLEJHVMFQ-VYUIOLGVSA-N 299.212 2.299 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)c2nnc(Cl)s2)CC1 2011520585 BVXXXLBKQVVZEJ-UHFFFAOYSA-N 272.721 2.012 10 10 CECE C[C@H](O)c1ccc(N(C)C2C[C@H]3COC[C@@H]3C2)cc1O 2156141854 JLGIWUBVBQTVFJ-SRVKXCTJSA-N 277.364 2.307 10 10 CECE CN[C@@H](C)c1ccc(N(CCOC)CCOC)c(F)c1 48895476 YRPIQPIYEKUUKP-LBPRGKRZSA-N 284.375 2.205 10 10 CECE CC[C@H](CN(C)C)NCc1ccc(OC)c(C)c1 2029865804 DJONYZNBFUDNMI-CQSZACIVSA-N 250.386 2.433 10 10 CECE C[C@@H](NCCc1ccc(O)c(O)c1)[C@H]1CCSC1 2031075417 RMCCTCGAAYEWBN-PWSUYJOCSA-N 267.394 2.372 10 10 CECE CC1(C)COCC[C@@H]1NCc1ccc(O)cc1O 2031923859 GJEYZRMHCCWTHC-ZDUSSCGKSA-N 251.326 2.003 10 10 CECE C[C@H](N(C)C(=O)c1cccc(O)c1O)C(F)(F)F 2034259251 JOZKFNRNEJYBIS-LURJTMIESA-N 263.215 2.121 10 10 CECE COc1ccc(O)c(CNC[C@@H]2[C@@H](C)C2(F)F)c1 2035998150 CEFRARGXXWUWFQ-LDYMZIIASA-N 257.280 2.392 10 10 CECE Cc1cc(N2CCNCC2)ccc1OCCOC(C)C 63063289 MHRIRRHVOOVEDA-UHFFFAOYSA-N 278.396 2.208 10 10 CECE CC(C)CN1CC[C@@H](N[C@@H](C)c2ccc(O)cc2O)C1 2160041176 RDMYEWZQEHKCHU-QWHCGFSZSA-N 278.396 2.479 10 10 CECE COc1ccc(N2CC[C@H](NC3CC3)C2)cc1OC 71197979 CSSKKJVJFVSDJV-LBPRGKRZSA-N 262.353 2.035 10 10 CECE CCN(CCc1cncc(C)n1)c1ccc(N)cc1 402680434 WWGNFECPRRYZHE-UHFFFAOYSA-N 256.353 2.436 10 10 CECE C[C@H](N)c1ccc2c(c1)CCN2CCc1cnccn1 403022627 UUYBMVFOZZZFHU-LBPRGKRZSA-N 268.364 2.102 10 10 CECE [N-]=[N+]=N[C@H]1CCCN([S@](=O)c2ccccc2)C1 403692918 PVIBSAKZWGATDC-DYZYQPBXSA-N 250.327 2.484 10 10 CECE Oc1cccc(F)c1CN1C[C@@H]2C(N3CCCC3)[C@H]2C1 2160775124 XNVRTRRDCIZZOB-RYUDHWBXSA-N 276.355 2.057 10 10 CECE C[C@H](c1c(O)cccc1O)N1CC[S@](=O)C(C)(C)CC1 322176414 YLMLYFWTFLIQBJ-GIPWTMENSA-N 297.420 2.392 10 10 CECE Cc1cccnc1C(=O)[C@H](O)c1ccc(N(C)C)cc1 2161651435 MSHPADQAZBSFLW-OAHLLOKOSA-N 270.332 2.372 10 10 CECE C[C@H](N)c1ccc(N2CC[C@@H]3CN(C)CC[C@H]32)c(F)c1 2170948746 SEQDASCJTRVNIV-NJZAAPMLSA-N 277.387 2.376 10 10 CECE COc1ccc(N2CCC[C@H](n3cccn3)C2)c(N)c1 2171254557 IVZOJYCPRRKDIM-LBPRGKRZSA-N 272.352 2.315 10 10 CECE CCCN(c1ccc([C@H](N)CC)cc1)[C@H]1CCNC1=O 2171238621 PIIXWMQDVDKTQB-CABCVRRESA-N 275.396 2.201 10 10 CECE CCN(C(=O)O[C@@H](C)COC)c1ccc(N)cc1 704266158 OFJOJVYRRMLEML-JTQLQIEISA-N 252.314 2.267 10 10 CECE C[C@@H]1O[C@H](C)C[C@@H]1CN(C)Cc1cc(N)ccc1O 686386326 BPVWFDVGPKLGQT-GRYCIOLGSA-N 264.369 2.220 10 10 CECE CCN1CC[C@H](N(C)Cc2cc(F)cc(F)c2O)C1 708397322 BHEKGKNRJYMLJB-LBPRGKRZSA-N 270.323 2.196 10 10 CECE CC[C@H](N[C@@H]1CCCS(=O)(=O)CC1)c1ccccc1O 709882839 NOSJIGHNBMVIFO-OCCSQVGLSA-N 297.420 2.400 10 10 CECE CC[C@@H]1NCC[C@H]1c1nc(-c2ccc(O)c(O)c2)no1 690695674 POEYDUHWTWLUQV-ZJUUUORDSA-N 275.308 2.003 10 10 CECE CC(=O)N(C1CCC1)[C@@H](C(=O)O)c1cc(F)ccc1O 712291798 CSCXHNDOPLZHFB-CYBMUJFWSA-N 281.283 2.058 10 10 CECE C[C@@H]1OCCN(c2c(F)cc(CN)cc2F)[C@H]1C 380476962 MBXSEHXLKOJNQN-IUCAKERBSA-N 256.296 2.037 10 10 CECE CCOc1cccc(CN2CC(CC)(C(=O)O)C2)c1O 722840655 QZTLBQRNFOFAHS-UHFFFAOYSA-N 279.336 2.088 10 10 CECE C[C@H]1CN(c2c(F)cc(CN)cc2F)CC[C@@H]1N(C)C 693663640 VZTLCBDHAYRQDH-HZMBPMFUSA-N 283.366 2.200 10 10 CECE CCNCc1ccc(N2CC[C@H](CO)[C@H]2C)cc1C 385848912 XGAPPHPVDYXCQK-UKRRQHHQSA-N 262.397 2.312 10 10 CECE CCC[C@H](OC)[C@@H](NCCCN=[N+]=[N-])C(=O)OCC 386450885 NYFBMXJNNGSZQB-WDEREUQCSA-N 272.349 2.023 10 10 CECE CN[C@H](C)c1ccc(N2C[C@@H]3CN(C)CC[C@H]3C2)cc1 394349351 YNMKHXMLDRISGS-KBMXLJTQSA-N 273.424 2.355 10 10 CECE C[C@@H](c1c(O)cccc1O)N1CCCOC[C@H]1C 398931830 PDRNCKNZHMLUII-MNOVXSKESA-N 251.326 2.270 10 10 CECE CC[C@H](COC)N(C)c1cc2c(cc1Cl)[C@H](O)C(=O)N2 2165970647 FASVKKAWJXPPQJ-OQPBUACISA-N 298.770 2.187 10 10 CECE C[C@H](N[C@H]1CCC[C@@H]1C(N)=O)c1ccc(N(C)C)cc1 2174102932 JJZNQAYEAMBTKF-CQDKDKBSSA-N 275.396 2.057 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@@]3(CCCOC3)C2)cc1 2168209824 FKSQKRURVAIGPD-CJNGLKHVSA-N 277.364 2.126 10 10 CECE CC[C@H](C)[C@H](C(=O)O)N(C)Cc1ccc(OC)cc1O 2174977200 GEAYHVVTXMVPGE-IINYFYTJSA-N 281.352 2.332 10 10 CECE O=C(O)c1cnn(-c2ccc(O)c(O)c2)c1C1CCC1 2069783848 WHWBMBYXWHTUIJ-UHFFFAOYSA-N 274.276 2.249 10 10 CECE C[C@@H](c1ccc(F)cc1O)n1nccc1C(=O)N(C)C 2069884407 XWKZNYCTLSYZGS-VIFPVBQESA-N 277.299 2.039 10 10 CECE Cc1nn(C)c2sc([C@H](NN)c3ccccc3O)cc12 2175259716 AAIXMLQRHDMGMY-CYBMUJFWSA-N 288.376 2.202 10 10 CECE CCN(Cc1ccnn1C)c1ccc(CNC)cc1F 2170045551 NNIAYKVLVRXHFI-UHFFFAOYSA-N 276.359 2.305 10 10 CECE CCN(c1ccc2c(c1)NC(=O)[C@@H]2NC)[C@H]1CCSC1 2170142863 AVQZJZVVRGNKMF-SMDDNHRTSA-N 291.420 2.231 10 10 CECE Nc1ccc(CCOCCOC[C@H]2CCCCO2)cc1 2176291692 HIJCWLBNCBRWBW-MRXNPFEDSA-N 279.380 2.414 10 10 CECE C[C@H](N)c1ccc(N2CCS[C@H]3COCC[C@H]32)cc1O 2170488528 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2269676058 ZMGVISGPJHPNQF-LBPRGKRZSA-N 259.353 2.418 10 10 CECE Cc1cc(N(C)Cc2cnn(C)c2)ccc1[C@@H](C)O 2269695572 LYQXWHGJSRNICL-GFCCVEGCSA-N 259.353 2.418 10 10 CECE Cc1cc(N2C[C@H](O)CC3(CC3)C2)ccc1[C@H](C)O 2269670733 BFYVXNPWCDDJFQ-GXTWGEPZSA-N 261.365 2.400 10 10 CECE C[C@H](CN[C@H](C)c1cc(O)ccc1O)Cc1cn[nH]c1 2290440255 QPMAXUDITIERNO-WDEREUQCSA-N 275.352 2.350 10 10 CECE COC1(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)CC(CF)C1 2281066210 VDHHMTPPUVFPMJ-AKJDGMEZSA-N 284.335 2.443 10 10 CECE CCCN(CCS(C)(=O)=O)c1ccc([C@H](C)N)c(C)c1 2285127045 CPNIEPOGZFTPHS-ZDUSSCGKSA-N 298.452 2.276 10 10 CECE CNCc1ccc(OC)c(CN(C)CC[C@@H]2CCO2)c1 2296017029 IAJMZZQBQPSUIG-OAHLLOKOSA-N 278.396 2.025 10 10 CECE CC[C@@H](N)Cc1ccc(N2C[C@H]3COC[C@H]2C3)cc1C 2286852096 PCWNBSRZUSBUIC-YSVLISHTSA-N 274.408 2.500 10 10 CECE Cc1ccc([C@@H](C)N[C@H]2CC[C@H](C(N)=O)CC2)c(O)c1 2287897683 SKYXESCGZSTQGP-JHJVBQTASA-N 276.380 2.395 10 10 CECE CC[C@H]1CNCC[C@@]1(Sc1nccs1)C(=O)O 2306962053 HMIPCVDFQOHAPP-KWQFWETISA-N 272.395 2.078 10 10 CECE CC[C@@H]1CCN(Cc2ccc(N3CCNCC3)cc2)C1 1236911764 HYYJTPYKKNTIES-OAHLLOKOSA-N 273.424 2.328 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@H]1CC[C@@H]2[C@H]1C2(F)F 2308643761 YPYOIVQKAQWADM-YIZRAAEISA-N 258.272 2.484 10 10 CECE CO[C@H]1C[C@@H]2[C@H]1CCN2c1ccc(CN)cc1Cl 2310065755 RXOZYGWYEZUEKQ-HONMWMINSA-N 266.772 2.412 10 10 CECE Cc1ccc(O)c([C@H](C)N2CCOC[C@@H](F)C2)c1 2315079747 XTXWYQWLBSZHHX-RYUDHWBXSA-N 253.317 2.432 10 10 CECE COc1ccc(N2CC(F)(F)[C@@](C)(CN)C2)cc1 2326708970 BFCINMKJSDGTTJ-LBPRGKRZSA-N 256.296 2.116 10 10 CECE COc1ccc(N(C)C[C@H](N)[C@@H]2CC2(F)F)cc1 2327280993 BBFUMCXGGKAIDE-RYUDHWBXSA-N 256.296 2.114 10 10 CECE CCC[C@H](CO)Sc1ncc(CNCCOC)s1 2327477239 GGMZLVAETHJNLR-SNVBAGLBSA-N 290.454 2.132 10 10 CECE COc1ccc(N2C[C@H]3CC[C@@H](OC)[C@H]3C2)c(N)c1 2328656213 YXRXGWGXCQAHMO-IFUGULHKSA-N 262.353 2.139 10 10 CECE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H]1C[C@@H]2C[C@@H]2CO1 2331057245 BSSQTMOWQDCSIU-XRGAULLZSA-N 260.381 2.438 10 10 CECE C[C@@H](NC[C@@H]1[C@@H]2CCOC[C@@H]21)c1cc(F)ccc1O 2331249486 KADYGUNTXMSEJW-MWQHPAIMSA-N 265.328 2.464 10 10 CECE C[C@@H]1Cc2cc(N3C[C@H]4CC[C@H]3C[C@@H]4O)ccc2O1 2337166394 PIXXNYPJCFWWAZ-FIXIBIHLSA-N 259.349 2.360 10 10 CECE CCN(CCN=[N+]=[N-])Cc1cc(OC)nc(OC)c1 2337777714 PEELPQDIUIROCH-UHFFFAOYSA-N 265.317 2.231 10 10 CECE CCCOCCCN1CCc2cc(O)c(O)cc2C1 2341217848 ATTJJHTWAZLUBG-UHFFFAOYSA-N 265.353 2.273 10 10 CECE COc1cc(Cl)c(N2CC[C@]3(O)C[C@H]3C2)c(OC)c1 2342295061 YVZBWOICVNCNPE-XPTSAGLGSA-N 283.755 2.318 10 10 CECE COc1ccc(N(C)[C@@]2(C(=O)O)CC[C@H]2SC)cc1 2353474881 RGBBWQHHYUFHFX-OCCSQVGLSA-N 281.377 2.480 10 10 CECE CO[C@@H]1CN([C@@H](C)c2cc(Cl)ccc2O)[C@H]2COC[C@@H]12 2354349021 FMVMIUUQTKJFAZ-BYDSVVRCSA-N 297.782 2.452 10 10 CECE CO[C@]1(C)CCN(c2ccc([C@H](C)N)cc2F)C1 311132395 JPCCTCMSUKYIPH-IINYFYTJSA-N 252.333 2.461 10 10 CECE O=C(NCCCSc1nccs1)C1=COCCC1 114375532 QBDXODJZMVHMAM-UHFFFAOYSA-N 284.406 2.436 10 10 CECE CN(c1ccc(CO)cc1F)[C@@H]1C[C@H]2[C@H]3CC[C@H](O3)[C@H]21 2356926801 IUWBOMBJIKFALD-AHMITGRASA-N 277.339 2.320 10 10 CECE C[C@H]1Cc2cc(N3C[C@@]4(N)CCC[C@@]4(F)C3)ccc2O1 2357532081 PGMJEKAVAYNOTF-XZJROXQQSA-N 276.355 2.420 10 10 CECE CCN(Cc1ccc(N)cc1)Cc1ccc(C(N)=O)cc1 35361403 JOXHGEAIBVDPNQ-UHFFFAOYSA-N 283.375 2.390 10 10 CECE c1ccc(CCOc2ccc(N3CCNCC3)cc2)nc1 37662396 UMEFZKMRRNDPSD-UHFFFAOYSA-N 283.375 2.113 10 10 CECE NC1(c2c(O)cc(F)c(Br)c2F)CC1 218168053 RDICYLYBGJRAQO-UHFFFAOYSA-N 264.069 2.381 10 10 CECE O=C(c1cccc(O)c1O)N1CCCC[C@H]1c1cn[nH]c1 185652699 BIARTYLJOWHEOX-LBPRGKRZSA-N 287.319 2.188 10 10 CECE Nc1ccc(CCNC(=O)c2n[nH]c3ccccc23)cc1 63129763 MJTBJQAUVINANI-UHFFFAOYSA-N 280.331 2.118 10 10 CECE C[C@@H](c1ccc(F)cc1O)N(C)C[C@@H](C)C(=O)O 86808038 LQYJGNWKVPJGBT-BDAKNGLRSA-N 255.289 2.245 10 10 CECE O=[N+]([O-])c1cnc(Cl)nc1NCc1ccccc1O 229338055 PKHTVCDWSIDXDN-UHFFFAOYSA-N 280.671 2.356 10 10 CECE Oc1ccc(F)cc1CN[C@@H]1CCO[C@@H]1C1CC1 226618156 VCKXSESNABGUED-TZMCWYRMSA-N 251.301 2.188 10 10 CECE Nc1ccc(N2C(=O)CCCCC2=O)c(Br)c1 88827258 UHGIFCOUFLRUOG-UHFFFAOYSA-N 297.152 2.465 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])c1ccc(Cl)cc1 90257073 KYVNLCYRVSPTNX-SNVBAGLBSA-N 268.704 2.454 10 10 CECE N[C@H](c1cc(O)c(O)c(Br)c1)C1CC1 238573196 OPCDSGKBUMNLTG-VIFPVBQESA-N 258.115 2.270 10 10 CECE Oc1cccc(F)c1CN1CC[C@H]2NCCC[C@H]2C1 1237390491 IRXBNOMXSPMCND-SMDDNHRTSA-N 264.344 2.105 10 10 CECE COC(=O)[C@@H](N[C@H](C)c1cc(F)ccc1O)C(C)C 94617089 GABUYZQFQNRQGF-RNCFNFMXSA-N 269.316 2.380 10 10 CECE C[C@H]1Oc2ccc(N(C)C)cc2C(=O)[C@@H]1n1ccnc1 248082358 VUBYBMGNWPWJHR-QMTHXVAHSA-N 271.320 2.154 10 10 CECE Oc1ccc(Br)c(C2CCNCC2)c1O 258572800 SRRHSKHPDYCJDS-UHFFFAOYSA-N 272.142 2.327 10 10 CECE CC(C)N(C)C(=O)/C=C\c1ccc(N2CCOCC2)cc1 255773648 OSKYYOJHYLGSNU-TWGQIWQCSA-N 288.391 2.403 10 10 CECE COC(=O)[C@H](NCCCN=[N+]=[N-])[C@@H]1CC[C@H]2C[C@H]2C1 700102368 AFYJGNJJSTVALJ-WHOHXGKFSA-N 266.345 2.254 10 10 CECE C[C@H]1CN(c2ccc(CNC3CC3)cc2F)C[C@H]1N(C)C 251923558 YDYCLUMMCQQRJD-YVEFUNNKSA-N 291.414 2.464 10 10 CECE C[C@H](c1ccc(F)cc1O)N1CC[C@@H](C(=O)O)[C@H](F)C1 2164557188 YRSOLZOLXXHCHR-GGZOMVNGSA-N 285.290 2.337 10 10 CECE CN(C[C@@H](O)C1CCCC1)c1ccc(CN)c(F)c1F 2167600035 VECFULJCHQUVAY-CYBMUJFWSA-N 284.350 2.411 10 10 CECE CO[C@]1(CN(C)c2ccc([C@@H](C)N)cc2)CCCOC1 2166145249 WMTFVBKAPWLLBW-CJNGLKHVSA-N 278.396 2.338 10 10 CECE NCc1ccc2c(c1)CCCN2CCC1(O)CCC1 700813229 NAILZSPJWARLEO-UHFFFAOYSA-N 260.381 2.203 10 10 CECE CN(C)c1ccc(/C=C/CNc2n[nH]c(N(C)C)n2)cc1 818214793 MECWEXBJYDHRGI-AATRIKPKSA-N 286.383 2.062 10 10 CECE Nc1ccc(OCC(=O)N[C@H]2C[C@@H]3CCCC[C@@H]32)cc1 712462396 CXAKFMPBBDASCK-CQDKDKBSSA-N 274.364 2.343 10 10 CECE Cc1ccc([C@@H](C)N[C@H]2CNCCC2(F)F)c(O)c1 817979439 BBGMKUDDHHZALO-MFKMUULPSA-N 270.323 2.348 10 10 CECE CO[C@@H]1C[C@@H]2C[C@@H](NCc3ccc(O)cc3O)[C@@H]2C1 2133978563 DBSIXHZUWLPSFD-FMKGYKFTSA-N 263.337 2.001 10 10 CECE C[C@@H]1CCN(c2ccc(/C=C/C(=O)O)cc2)CCO1 720497097 LJSHPAOUXNGKBQ-RPTYSRGTSA-N 261.321 2.400 10 10 CECE CCC/C=C\[C@H](O)C(=O)N(C)Cc1ccccc1O 901055009 KCNPDBPOXQNKNI-MFNCVGGLSA-N 263.337 2.068 10 10 CECE C[C@H](NC/C=C/c1ccc(N(C)C)cc1)[C@H](C)C(=O)O 901444191 DRDFDYRKJBPEAC-AAAGKOELSA-N 276.380 2.465 10 10 CECE CC1(C)CN(Cc2cccc(Cl)c2O)C[C@@H]1N 903987215 YRASKWBUYVWJQA-NSHDSACASA-N 254.761 2.215 10 10 CECE Cc1cc(C)c(CNC(=O)c2cc(O)cs2)c(O)n1 731866125 RDHGYXATOBAGAI-UHFFFAOYSA-N 278.333 2.101 10 10 CECE COC(=O)CC1(NC/C=C/c2ccc(N(C)C)cc2)CC1 846027431 OXRYYKYDCFRWEE-SNAWJCMRSA-N 288.391 2.451 10 10 CECE C[C@H]1CNCC[C@H]1NCc1c(O)cccc1Cl 841064006 NVYSOWMIYUMBHZ-JOYOIKCWSA-N 254.761 2.133 10 10 CECE Cc1cc(N(C)C)ccc1CNC[C@@H](CO)c1cccnc1 840945633 RSKDPTNZFMARAH-KRWDZBQOSA-N 299.418 2.322 10 10 CECE CCc1cccc(CN2CC[C@](O)(C(F)(F)F)C2)c1O 848888236 PMBRBWBQUVWEGL-CYBMUJFWSA-N 289.297 2.454 10 10 CECE CCc1cccc(CN2CC[C@@](O)(C(F)F)C2)c1O 848916847 XVXLSALLPHDBKA-AWEZNQCLSA-N 271.307 2.157 10 10 CECE CC[C@@H]1COC[C@H]1N[C@H]1CCN(c2ccc(OC)cc2)C1 926679828 GQUSRCIZXGTNTC-JKIFEVAISA-N 290.407 2.289 10 10 CECE CCNCc1ccc(N2C[C@H](C)C(O)[C@@H](C)C2)cc1 688138255 PSZDGOASFBHENT-STQMWFEESA-N 262.397 2.249 10 10 CECE C[C@H](NCc1cn(C)nn1)c1cc(Cl)ccc1O 757655181 HZQUPEJNUDUGPH-QMMMGPOBSA-N 266.732 2.025 10 10 CECE COc1cc(C)cc(CN2CCC[C@H]2C[C@@H](C)O)c1O 754748431 LYVIFGNLGGFPIY-OCCSQVGLSA-N 279.380 2.445 10 10 CECE COc1ccc(N2CC[C@@H](NC(=O)C(C)C)C2)cc1 855230406 CYVVBWGBPKCBCH-GFCCVEGCSA-N 262.353 2.046 10 10 CECE Cc1cc(C)c([C@H](C)NC2CN(c3ccncn3)C2)c(O)c1 866496669 UUFWZWLBPMJVSO-ZDUSSCGKSA-N 298.390 2.338 10 10 CECE C[C@H]1C[C@@H]2CN(Cc3cccc(F)c3O)CCN2C1 1876168611 NKRUKRWQKNYUDG-WCQYABFASA-N 264.344 2.057 10 10 CECE CCN(C)c1ccc(CN(C)Cc2cc[nH]n2)cc1 773757916 RMZLFSFJQVQODN-UHFFFAOYSA-N 258.369 2.498 10 10 CECE C[C@@H](CNCc1ccc(Cl)cc1O)CN1CCOC1=O 1876049821 PTXXMKFHOPRTAB-JTQLQIEISA-N 298.770 2.224 10 10 CECE Oc1cc2c(cc1CN[C@@H]1C(F)(F)C13CC3)OCO2 1876228195 KBRREWFOZDTGNC-NSHDSACASA-N 269.247 2.008 10 10 CECE Cc1cc(C=CC(=O)O)ccc1N1CCCOCC1 1898043220 NVPIIIDNSYQMMJ-UHFFFAOYSA-N 261.321 2.320 10 10 CECE Cn1cc(CNCc2cc(F)ccc2O)c(C(F)F)n1 1964615342 QWPFHABVTCHQLE-UHFFFAOYSA-N 285.269 2.492 10 10 CECE Oc1ccc2c(c1O)CCN[C@H]2[C@H]1C[C@@H]2C=C[C@H]1C2 75793792 RDEPIIGJIINLLO-MHOHDPQLSA-N 257.333 2.497 10 10 CECE CCCCc1nnc([C@H](N)c2cccc(F)c2O)o1 83481242 ODIMSNHCDBYOLM-LLVKDONJSA-N 265.288 2.305 10 10 CECE Oc1ccc(O)c([C@H]2NCCc3c(O)ccc(F)c32)c1 83626136 RFIHSPPHJNPPKU-OAHLLOKOSA-N 275.279 2.178 10 10 CECE Oc1cc([C@H]2NCCc3cccc(F)c32)cc(O)c1O 83728483 OQTLDUPCSLJONF-CQSZACIVSA-N 275.279 2.178 10 10 CECE COc1ccncc1CN[C@H](C)c1c(O)cccc1O 701575760 CKKIVSRPCKNBNW-SNVBAGLBSA-N 274.320 2.352 10 10 CECE CCOC(CN[C@@H](C)c1ccccc1O)OCC 93447308 SHDDDOBHMPNFQC-NSHDSACASA-N 253.342 2.442 10 10 CECE Oc1ccc(CNC[C@@H]2C[C@]23CCCOC3)c(O)c1 1894129710 WCYNTAMKARFROX-WFASDCNBSA-N 263.337 2.004 10 10 CECE CN1CCCc2cc(CNCCOCCF)ccc21 702633216 PPHRHGJRZANQHW-UHFFFAOYSA-N 266.360 2.145 10 10 CECE CN(C)CC(C)(C)CNCc1ccc(F)c(F)c1O 703229198 IHWSABDOPAJIGS-UHFFFAOYSA-N 272.339 2.348 10 10 CECE CCNCc1ccc(N(C)CC2CN(CC)C2)cc1 692254287 QHZYMKMOXDSTRT-UHFFFAOYSA-N 261.413 2.184 10 10 CECE CN[C@H](C)c1ccc2c(c1)CCN2Cc1nccn1C 689360672 MYAPYBCSBJPMTA-GFCCVEGCSA-N 270.380 2.263 10 10 CECE CCC1(O)CCN(c2ccc([C@H](C)NC)c(O)c2)CC1 707231224 FJKNSJDEJOIWQB-LBPRGKRZSA-N 278.396 2.414 10 10 CECE C[C@@H](N)c1ccc(N2CCC[C@@H]3COC[C@H]32)c(F)c1 690320504 CAIVGLYRAOOPLL-IXPVHAAZSA-N 264.344 2.461 10 10 CECE CN[C@H](C)c1ccc(N2CC[C@H](N(C)C)C2)c(F)c1 62966047 GZDFAYBMRGBCLA-YPMHNXCESA-N 265.376 2.246 10 10 CECE CCN(Cc1cccc(OC)c1O)C1CCC(N)CC1 91849884 YNSBNKQOGVSGBA-UHFFFAOYSA-N 278.396 2.493 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CCS[C@H](C(=O)O)C1 699257633 KEQLBBMADYCOPJ-PELKAZGASA-N 285.340 2.094 10 10 CECE CCN(Cc1cc(OC)ccc1O)CC1CCNCC1 94011526 IFZUQVAYTDNIBW-UHFFFAOYSA-N 278.396 2.222 10 10 CECE OCc1cc(F)c(N2CCO[C@@H](C(F)F)CC2)c(F)c1 687553338 IAPPRODIACTKCO-LLVKDONJSA-N 293.260 2.318 10 10 CECE COC(OC)[C@@H](C)NCc1ccc(N2CCCC2)cc1 79607813 GWMAWMFEVDAETJ-CYBMUJFWSA-N 278.396 2.384 10 10 CECE CC(C)(F)[C@@H](N)[C@@H](O)c1ccc(N2CCCC2)cc1 2117555862 XGYILHQIZCKZQI-KBPBESRZSA-N 266.360 2.396 10 10 CECE OC[C@@H]1C[C@H]1CNCc1ccc(N2CCCC2)cc1 2117655916 FPFJENJIMMCILT-GJZGRUSLSA-N 260.381 2.005 10 10 CECE Cc1cnc2c(c1)N(C(=O)/C=C\c1cccnc1)CC2 1526646110 PJMRXWDDAVHSEF-PLNGDYQASA-N 265.316 2.388 10 10 CECE [N-]=[N+]=NCC1(CNS(=O)(=O)C[C@H]2CC[C@H](F)C2)CC1 2117729929 ZXEXYMVUIZTOOS-UWVGGRQHSA-N 290.364 2.135 10 10 CECE CN(c1ccc(N)cc1)S(=O)(=O)[C@H]1CCCC[C@H]1F 2118942897 YWIYFCPMMGXOBN-OLZOCXBDSA-N 286.372 2.316 10 10 CECE CC[C@@]1(C)CCN1c1cc2c(cc1F)[C@@H](O)C(=O)N2 2119485577 XMRIFEVMMZOGEK-OCCSQVGLSA-N 264.300 2.190 10 10 CECE Nc1ccc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1 1866090938 JMSFMGLZEZPDKO-UHFFFAOYSA-N 273.248 2.135 10 10 CECE CCOc1cc(CNCCCO)ccc1N1CCCC1 211890401 HMBKDIMUFRZWPF-UHFFFAOYSA-N 278.396 2.158 10 10 CECE O=C1NC(=S)SC1=Cc1ccc2c(c1)CCO2 2297353317 DMARRXYRWLAEFB-UHFFFAOYSA-N 263.343 2.110 10 10 CECE C[C@@H](N)c1ccc(N(C)Cc2ncn(C)n2)c(Cl)c1 2121853345 CJHUJLDLNKEKOD-SECBINFHSA-N 279.775 2.125 10 10 CECE Nc1ccc(CCCN2CCC[C@H]2CC(=O)O)cc1 2123046870 TWOXZFDRIHZYHP-AWEZNQCLSA-N 262.353 2.141 10 10 CECE Cc1nnsc1CN1CCC[C@@H](CN=[N+]=[N-])C1 1912196349 UVJVYNKYZVMPBH-VIFPVBQESA-N 252.347 2.369 10 10 CECE [N-]=[N+]=NC[C@@H]1CCN(C(=O)CCOC2CCC2)C1 1912156862 NZRVYGMUOZPLDH-JTQLQIEISA-N 252.318 2.104 10 10 CECE CN(CCCN=[N+]=[N-])C[C@@H](C(=O)O)c1ccccc1 1912181233 LPLQHXSCJYWVHM-GFCCVEGCSA-N 262.313 2.487 10 10 CECE Cc1ccc(O)c(C(=O)NCc2c(O)cccc2O)c1 1639289057 HVBSXNLSFNTUCQ-UHFFFAOYSA-N 273.288 2.042 10 10 CECE CCC1=C(C(=O)NCc2cc(O)ccc2O)CCCO1 1637126342 UESKJFURUCVFCE-UHFFFAOYSA-N 277.320 2.189 10 10 CECE COc1ccc(N2C[C@H](O)CC2(C)C)c(OC)c1 259508538 UGCNSFDZTMRVTC-SNVBAGLBSA-N 251.326 2.053 10 10 CECE CO[C@H](CN1CCCC[C@H](CN=[N+]=[N-])C1)[C@@H]1CCOC1 1912199289 QLSFYMGXKAIKCP-MGPQQGTHSA-N 282.388 2.450 10 10 CECE Cc1nnccc1C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 1912166854 CNMTYDVPTYNTFA-LLVKDONJSA-N 274.328 2.338 10 10 CECE C[C@@H](CNC(=O)CN(C)CCN=[N+]=[N-])c1ccccc1 1912207911 ZERJYECUKHXGHL-LBPRGKRZSA-N 275.356 2.148 10 10 CECE CCOC(=O)[C@](C)(CSC(C)C)NCCN=[N+]=[N-] 1912206025 IATPQDONMXGSDN-NSHDSACASA-N 274.390 2.350 10 10 CECE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 1912200435 HLGGTKRHMGGCTN-SECBINFHSA-N 276.296 2.260 10 10 CECE [N-]=[N+]=N[C@@H]1CCN(C(=O)C2CC3(CSC3)C2)C1 1912207927 ZMUXDWYMPXMFNK-SECBINFHSA-N 252.343 2.041 10 10 CECE O=C(NCc1ccc(O)cc1O)c1ccc(F)cc1 1638352692 UOIHILQJUYVYJV-UHFFFAOYSA-N 261.252 2.167 10 10 CECE C[C@@H](N[C@H]1C[C@@H]2CC[C@H](C1)O2)c1cc(O)ccc1O 2124954662 FYBOSCVIUJAROG-WFFHOREQSA-N 263.337 2.458 10 10 CECE Cc1conc1C(=O)Nc1c(Cl)ccc2nonc12 1586682870 LEXIEVFRAZDFFA-UHFFFAOYSA-N 278.655 2.425 10 10 CECE COc1ccc(O)c([C@@H](C)NCC(C)(C)[C@H](C)O)c1 1913837336 DKTWPNZERXLJAA-MNOVXSKESA-N 267.369 2.458 10 10 CECE CN(Cc1ccccc1O)C[C@@H]1C[C@@H]2COCC[C@@H]2O1 1966158387 LAMCSEWRYZZFFA-YCPHGPKFSA-N 277.364 2.018 10 10 CECE CN[C@H]1CCc2cc(N3CC=C[C@@H](OC)C3)ccc21 2128296121 FNDYXMROYYFOEX-ZBFHGGJFSA-N 258.365 2.285 10 10 CECE C[C@H](O)CN(c1ccc2c(c1)CCC[C@H]2N)C1CC1 2128269694 VFCJFXMVBAPHRW-MEDUHNTESA-N 260.381 2.372 10 10 CECE N[C@@H]1CCCc2cc(N3CCO[C@H](CF)C3)ccc21 2128278273 CWTQFNHSPAQPCY-UKRRQHHQSA-N 264.344 2.197 10 10 CECE Cc1cccc(C(=O)C(=O)c2ccc3c(c2)NC(=O)CO3)c1 19046307 HIHCJRXURRIBPY-UHFFFAOYSA-N 295.294 2.392 10 10 CECE CCN1CCCN(c2ccc3c(c2)CC[C@@H]3O)CC1 2128316463 FWLYRWOHLGDGHB-INIZCTEOSA-N 260.381 2.198 10 10 CECE COC[C@]1(C)CCN(c2ccc3c(c2)CC[C@@H]3N)C1 2128327940 KGBFMADNGLXPHI-JKSUJKDBSA-N 260.381 2.495 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1CCN2CCC[C@H]12 158718938 RLKSBIUUYISZRZ-QWHCGFSZSA-N 266.772 2.372 10 10 CECE CNCc1ccc(N2CC[C@@H](O)[C@@H]2C(C)(C)C)cc1 2128675030 YMIGSLLTRIIFRI-HUUCEWRRSA-N 262.397 2.392 10 10 CECE CN(Cc1cc2c(cc1O)CCC2)C[C@@H]1CCCO1 151732424 BWNWTUIXJMBMHS-HNNXBMFYSA-N 261.365 2.492 10 10 CECE C[C@@H](N[C@H]1CCN2CCC[C@@H]2C1)c1cc(O)ccc1O 157417309 TXOBGOHGRZEJIC-FRRDWIJNSA-N 276.380 2.375 10 10 CECE CNc1nnc(CN(C)c2ccc(OC)cc2)s1 159364418 ATCKXTJYPDSCEK-UHFFFAOYSA-N 264.354 2.225 10 10 CECE NC(=O)c1ccc(NN=NCc2ccccn2)cc1 1860489039 VLBMYUQUIRTOBM-UHFFFAOYSA-N 255.281 2.160 10 10 CECE COc1cc(C)c(N(C)CC(C)(C)CN)cc1OC 258855881 YARNWWYFTLUDBU-UHFFFAOYSA-N 266.385 2.433 10 10 CECE CC1(C)CN(c2ccc3c(c2)OCCO3)CCC1=O 259405788 YDMZAFXCAWYGNN-UHFFFAOYSA-N 261.321 2.263 10 10 CECE CCN1CCc2cc([C@@H](O)CC3(C)CNC3)ccc21 1892632151 ILZXBKDWTPGKHC-HNNXBMFYSA-N 260.381 2.102 10 10 CECE CCN[C@H](CC(COC)COC)c1ccccc1O 2130883972 UUONUWAJNXZZQS-CQSZACIVSA-N 267.369 2.342 10 10 CECE CC1(C)CC[C@H]1C(=O)NCCOc1ccc(N)cc1 2132037726 NNFKBSDJKXVHNV-ZDUSSCGKSA-N 262.353 2.200 10 10 CECE Nc1ccc(CCNC(=O)[C@@H]2C[C@@H]3CC[C@@H]3C2)cc1 2132557201 VRIRFMJFBFHJKN-WDNDVIMCSA-N 258.365 2.364 10 10 CECE COc1cccc(O)c1CNC[C@H]1CCC[C@@H](C)O1 850379383 NGDWCYLAYXDALV-VXGBXAGGSA-N 265.353 2.448 10 10 CECE C[C@H](CC(=O)NCCc1ccc(O)c(O)c1)C(F)(F)F 860235457 SOPFNHQKFKAKJF-MRVPVSSYSA-N 291.269 2.345 10 10 CECE COC[C@@H]1C[C@@H]1CN[C@H](C)c1ccc(OC)cc1O 2133504717 OFLJMNLICIYBQS-UTUOFQBUSA-N 265.353 2.334 10 10 CECE COC[C@@H]1C[C@H]1CN[C@H](C)c1ccc(OC)cc1O 2133504718 OFLJMNLICIYBQS-WOPDTQHZSA-N 265.353 2.334 10 10 CECE CC(C)NCc1ccc(N(CCO)C2COC2)c(Cl)c1 1915503219 ZFKIFHFSJOBVGF-UHFFFAOYSA-N 298.814 2.036 10 10 CECE CO[C@H]1CCC[C@]1(Sc1nccs1)C(=O)O 1904754466 QJCXTDMAQWMGIX-OIBJUYFYSA-N 259.352 2.258 10 10 CECE COc1cc(N2CCO[C@H](C(C)C)C2)ccc1CO 2139685777 HCQOLBVDDKYXNP-HNNXBMFYSA-N 265.353 2.049 10 10 CECE COc1cc(N(C)C[C@H](OC)C2CC2)ccc1CO 2139700579 LNCWVOHAWAAJNG-HNNXBMFYSA-N 265.353 2.049 10 10 CECE Cc1cccc(CN[C@@H]2C[C@@H]3CNC[C@@]3(C)C2)c1O 2139760154 OUUBDYUDSWYAOU-IIAWOOMASA-N 260.381 2.178 10 10 CECE COc1ccc(O)c(CNCC[C@H]2CC[C@H](C)O2)c1 1967776230 RDAKZNYORLPDFO-WCQYABFASA-N 265.353 2.448 10 10 CECE C[C@@H]1CCN(c2ccc(CNC3CC3)cc2)[C@@H]1CO 227065235 KULFIRKBUNIMFP-MLGOLLRUSA-N 260.381 2.146 10 10 CECE COc1ccc(N2C[C@H]3CCNC[C@@H]3C2)c(F)c1F 2136989015 RTIQGUAJHBLMQX-NXEZZACHSA-N 268.307 2.019 10 10 CECE Cc1cccn2nc(NCc3ccccc3O)nc12 228427262 IOTULVFWTUEZFZ-UHFFFAOYSA-N 254.293 2.355 10 10 CECE CC(F)(F)C1(CNC(=O)c2ccc(O)c(O)c2)CC1 1926827121 KFJQTAYIQUSAIT-UHFFFAOYSA-N 271.263 2.263 10 10 CECE CC[C@H](NC(=O)[C@H]1CNc2ccccc2N1)C(C)C 229878927 TWBJPSVBERGPCE-SMDDNHRTSA-N 261.369 2.443 10 10 CECE CCc1cnc(CN[C@H](C)c2c(O)cccc2O)o1 231635993 OAZVFBXFKACXDG-SECBINFHSA-N 262.309 2.499 10 10 CECE CN1CCc2cc([C@H](O)[C@]34CO[C@](C)(C3)C4)ccc21 2137914689 LTSXLAXCIGHXLP-JYJNAYRXSA-N 259.349 2.281 10 10 CECE O=C(O)c1cc(O)ccc1NC(=O)c1cccnc1Cl 236459738 DOAWFNYDCIVMHL-UHFFFAOYSA-N 292.678 2.391 10 10 CECE CCOC(=O)[C@H]1CCN[C@H](c2cccc(C)c2O)C1 1952456413 ADKSSTOBNQVXJO-AAEUAGOBSA-N 263.337 2.304 10 10 CECE CNCc1ccc(N(C)CCCC(=O)N(C)C)c(Cl)c1 2143708280 VSPLZOKEBPSPLE-UHFFFAOYSA-N 297.830 2.364 10 10 CECE CC[C@H](N)c1ccc(N2CC[C@@H](C(=O)N(C)C)C2)cc1 2143703830 UHEYNUFRDQUDBB-HIFRSBDPSA-N 275.396 2.011 10 10 CECE C[C@H]1C[C@H]2CN(Cc3cc(Cl)ccc3O)CCN2C1=O 1971497598 GVKDNJDKLOTFQK-GWCFXTLKSA-N 294.782 2.098 10 10 CECE Oc1c(F)cccc1CN[C@H]1COCCC1(F)F 1972757086 FIGFBQIODFUSKJ-JTQLQIEISA-N 261.243 2.045 10 10 CECE CC(C)NCc1ccc(N(CC(N)=O)C(C)C)c(F)c1 42438437 JJGVNTXHTQMOIE-UHFFFAOYSA-N 281.375 2.024 10 10 CECE Cc1ccnc(C(=O)NCCc2ccc(N)cc2)c1C 2145140976 NUYQABXBELHPNZ-UHFFFAOYSA-N 269.348 2.253 10 10 CECE CC[C@@H](N)Cc1c(Sc2nccs2)ncn1C 2006583384 WOVDAEWRGINSMY-MRVPVSSYSA-N 268.411 2.308 10 10 CECE CC(C)NCc1ccc(N2CCCN(C)CC2)c(F)c1 34824317 WAILUEINPWHXLY-UHFFFAOYSA-N 279.403 2.466 10 10 CECE NCc1ccc(N2CC[C@]3(O)CCCC[C@@H]3C2)cc1F 160488755 JZERXSSRSWZICS-CZUORRHYSA-N 278.371 2.416 10 10 CECE C[C@@H](N)c1ccc(N(C)CC2(O)CCOCC2)c(Cl)c1 161746394 JOEGXNYAKWTDBQ-LLVKDONJSA-N 298.814 2.337 10 10 CECE COC(=O)c1cccc(N)c1N[C@H]1CCOCC1(C)C 2149248033 OWXVFRLRZDZSQN-LBPRGKRZSA-N 278.352 2.282 10 10 CECE C[C@@]1(CNS(=O)(=O)Cc2ccc(N)cc2)C=CCCC1 2146889412 BRNSPLPANHCRNR-OAHLLOKOSA-N 294.420 2.435 10 10 CECE Cc1cc(CNC2CC2)ccc1N1C[C@H]2CO[C@@H](C2)C1 2152309431 WFPAWBNNMCRXBY-HOCLYGCPSA-N 272.392 2.472 10 10 CECE COc1ccc(CN2CC[C@H](CC(=O)O)[C@@H]2C)c(O)c1 2153496907 XQIUCRKJOSKPGC-WDEREUQCSA-N 279.336 2.086 10 10 CECE CN(Cc1cc2c(cc1O)OCO2)[C@H]1CCOC1(C)C 2153819226 ZNDNXWSIVWAWRY-AWEZNQCLSA-N 279.336 2.120 10 10 CECE CN(C(=O)c1ccc(O)c(O)c1)[C@H]1CCCOC1(C)C 2153802065 XZVPJEFASVNFNK-ZDUSSCGKSA-N 279.336 2.127 10 10 CECE CO[C@H]1CCO[C@H](CNCc2ccc(N(C)C)cc2)C1 2154192354 CMHBVKMBUWBQHB-HOTGVXAUSA-N 278.396 2.036 10 10 CECE CC1(C)CCO[C@H]1CCNCc1ccc(O)c(O)c1O 2154289698 WFCPEIWLCZFQSV-LBPRGKRZSA-N 281.352 2.098 10 10 CECE CC[C@@H]1[C@@H](Sc2nccs2)CC[C@]1(CO)NC 2009258564 HSRGDOAFYWJKTC-JFGNBEQYSA-N 272.439 2.374 10 10 CECE CN(C)c1ccc([C@H](NN)c2nccc(Cl)c2F)cc1 2154344325 XFNUYPNPERQPAV-ZDUSSCGKSA-N 294.761 2.493 10 10 CECE CNCc1ccc(N(C)Cc2cc(C)nn2C)cc1C 2155337455 KSTSZOPEYZZHPM-UHFFFAOYSA-N 272.396 2.393 10 10 CECE C[C@H](CN1CCOCC1)CN1CCC[C@@H](N=[N+]=[N-])CC1 2155553269 DYPYWLHRIHMZHY-UONOGXRCSA-N 281.404 2.120 10 10 CECE C[C@H](c1cncs1)N(C)c1ccc2c(c1)NC(=O)[C@@H]2N 2155708462 XCLQZYAUCIDKEW-AMIZOPFISA-N 288.376 2.292 10 10 CECE Cc1cccc(C(=O)Nc2ccc(O)cc2C(=O)O)n1 48846968 IMGDTOHWILVEBP-UHFFFAOYSA-N 272.260 2.046 10 10 CECE CN(c1ccc2c(c1)NC(=O)[C@@H]2O)[C@H]1CCC(F)(F)C1 2156049916 JRPBZVMDYXFQII-JOYOIKCWSA-N 282.290 2.296 10 10 CECE CCCn1cc(S(=O)(=O)Nc2ccc(O)cc2)nc1C 50265862 ROYGSCXSIKQUGE-UHFFFAOYSA-N 295.364 2.108 10 10 CECE C[C@]12CCCN(c3ccc(CN)c(F)c3F)[C@H]1COC2 2159846695 WIAAWBZJJWCCFN-SWLSCSKDSA-N 282.334 2.429 10 10 CECE Oc1c(F)cccc1CNC[C@@H]1CCc2nccn2C1 2159894148 BILUGHPDTGLLBP-NSHDSACASA-N 275.327 2.080 10 10 CECE CN(C)C1(CNCc2ccc(F)cc2O)CCC1 294483950 ARNTUCKGBFUZCI-UHFFFAOYSA-N 252.333 2.105 10 10 CECE CC(C)SC[C@@H](C)NC(=O)c1cccc(O)c1O 2028116564 AFBPLAUADJEOPQ-SECBINFHSA-N 269.366 2.358 10 10 CECE CN(C)c1ccc([C@H](O)C(=O)c2cnsc2)cc1 2030381527 LCJNCTIQFIZHRM-LBPRGKRZSA-N 262.334 2.125 10 10 CECE COCCN1CC[C@H](N(C)Cc2cc(Cl)ccc2O)C1 2160033902 XKEZHOSDDLTNMC-AWEZNQCLSA-N 298.814 2.198 10 10 CECE CNCc1ccc(N2CCOC(F)(F)C2)cc1Cl 2034853089 YCAMYETWANVKIY-UHFFFAOYSA-N 276.714 2.489 10 10 CECE C[C@@H](N[C@H]1C[C@H]2CC[C@H]1N(C)C2)c1cc(O)ccc1O 401670919 VEZODRPMRCVQSC-HKCMKHECSA-N 276.380 2.231 10 10 CECE C[C@@H](NCCN1CCCCC1=O)c1ccc(F)cc1O 405439635 IHUOSJHWDBOZNW-LLVKDONJSA-N 280.343 2.194 10 10 CECE C[C@H](c1ccccc1O)N1C[C@@H]2CC(C(=O)O)C[C@H]2C1 2158880408 ZVKLWDYZGYXYQZ-WXHSDQCUSA-N 275.348 2.496 10 10 CECE COc1ccc(O)c([C@@H](C)NCC2(CN(C)C)CC2)c1 2161185043 HNWNYSDPTHBXQY-GFCCVEGCSA-N 278.396 2.393 10 10 CECE CCN(CC)C1CN(c2ccc(CN)c(Cl)c2)C1 700562697 CUYWMJONVLWSFH-UHFFFAOYSA-N 267.804 2.329 10 10 CECE CC[C@@H]1C[C@@H](C(=O)O)N([C@H](C)c2c(O)cccc2O)C1 2159271064 OVKKHUOXFTVKJO-MXWKQRLJSA-N 279.336 2.344 10 10 CECE CCCN(CC(=O)O)Cc1ccc2c(c1)CCCN2C 86775838 GXQHBAJMJSPEDB-UHFFFAOYSA-N 276.380 2.366 10 10 CECE CCCc1nnsc1C(=O)NCCc1ccc(N)cc1 87443933 VYHMFCJHFHSAEO-UHFFFAOYSA-N 290.392 2.045 10 10 CECE CC1(C)CN(C(=O)C2=CC[C@H](N)C2)c2ccccc21 638027699 ZWEFTOIWXVJGEB-LBPRGKRZSA-N 256.349 2.358 10 10 CECE C[C@@H]1C[C@]1(C)CN(C)c1ccc2c(c1)NC(=O)[C@H]2N 704127243 LBFLHZJXCDMEJU-ZDBHGNHJSA-N 259.353 2.121 10 10 CECE CN1CCCC[C@H]1CNCc1ccc(F)c(F)c1O 703329555 RIFKWQQIQXEDCD-NSHDSACASA-N 270.323 2.244 10 10 CECE C[C@@H]1[C@H]2CNC[C@@H]2CN1c1ccc2c(c1)C(C)(C)CO2 2162638808 XSYUEWPKDICELS-YRGRVCCFSA-N 272.392 2.401 10 10 CECE CCOC[C@H]1CN([C@H](C)c2ccc(C)cc2O)CCO1 705855476 YMCYVXPDLFEJRG-ZIAGYGMSSA-N 279.380 2.499 10 10 CECE NC1([C@@H](O)c2ccc(N3CCCC3)cc2)CC(F)(F)C1 2163095165 QXAVFTYSYTYNPS-ZDUSSCGKSA-N 282.334 2.447 10 10 CECE CN1CCc2cc(N3CCC[C@H](C4CNC4)C3)ccc21 2163073065 FSDMXQWLAHZRSV-AWEZNQCLSA-N 271.408 2.115 10 10 CECE CN[C@H](c1ccc2c(c1)CCN2C)[C@@]1(C)CCCN1C 2163126121 GTBRLVIOCVWTDT-IAGOWNOFSA-N 273.424 2.424 10 10 CECE CCN1CCc2cc([C@H](NN)[C@@]3(C)CCCO3)ccc21 2163133089 JFXZQZJHILWDON-JKSUJKDBSA-N 275.396 2.143 10 10 CECE CN(C)c1ccc([C@@H](CCc2ccccn2)NN)cc1 2163141038 QAHGQYMJYPOSLF-MRXNPFEDSA-N 270.380 2.285 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@@H](O)[C@@H]1CCC=CO1 2163126346 IIHZNAIKMMTERM-XHSDSOJGSA-N 276.380 2.067 10 10 CECE Cc1ncc([C@H](O)c2ccc(N3CCCC3)cc2)cn1 2163109459 ZHODBWBRRGPNJG-MRXNPFEDSA-N 269.348 2.467 10 10 CECE C[C@@H](c1ccc(O)cc1O)N(C)[C@@H]1C[C@H]2CN[C@@H](C2)C1 709062479 YALHKTVHWKVAHN-ZDEQEGDKSA-N 276.380 2.231 10 10 CECE CCCN(C)CCNCc1cccc(OCC)c1O 688628578 XAZHTMGSLGCGMX-UHFFFAOYSA-N 266.385 2.222 10 10 CECE CN(C)c1ccc(CN2C[C@H](C(=O)O)C(C)(C)C2)cc1 709914280 ADPOBEALJIWBEP-CQSZACIVSA-N 276.380 2.295 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H]3COC[C@H]32)cc1O 690329676 PWWWZVMZMBNSOG-TYNCELHUSA-N 276.380 2.288 10 10 CECE CN(C)c1ccc([C@@H](CN)N2C[C@H]3CSC[C@H]3C2)cc1 711577311 PKLFEYJIPTTZNB-IJEWVQPXSA-N 291.464 2.047 10 10 CECE CCN(C[C@H](C)OC)C(=O)CCc1ccc(N)cc1 383233099 CJVPOCGLBUGPGU-LBPRGKRZSA-N 264.369 2.085 10 10 CECE C[C@@H](NCCCN1CCC1)c1ccc(N(C)C)cc1 697399624 CFFLLKZXWSODDX-CQSZACIVSA-N 261.413 2.499 10 10 CECE CCCNCc1ccc(N2CCS[C@@H](CO)C2)c(F)c1 720003196 OMVYYPCMSVUUMY-CYBMUJFWSA-N 298.427 2.239 10 10 CECE CC(C)N1CC[C@@H](N[C@@H](C)c2c(O)cccc2O)C1 389197232 XNMPSNHQJVESTI-NWDGAFQWSA-N 264.369 2.231 10 10 CECE OCc1ccc(N2C3CCC2(CO)CC3)cc1Cl 723051214 WRSKNOSTLRCTOJ-UHFFFAOYSA-N 267.756 2.326 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])C[C@H]2C=C[C@@H]1C2 698796033 ADNHBKHFZDLQPN-DMDPSCGWSA-N 264.329 2.174 10 10 CECE COc1cc(Cl)cc(CN[C@H](C)C(C)(C)O)c1O 393962386 VKHRYVSKOJEFBZ-MRVPVSSYSA-N 273.760 2.303 10 10 CECE N[C@@H]1C(=O)Nc2cc(N3CCC4(CC4)C3)c(Cl)cc21 400004559 QEXGXASOPXJCRB-LBPRGKRZSA-N 277.755 2.282 10 10 CECE CN[C@H](C)c1ccc(N2CCO[C@@H]([C@@H](C)O)C2)cc1Cl 2174153989 XDTJZAUGIWKQPE-UEKVPHQBSA-N 298.814 2.206 10 10 CECE OC[C@H](NCc1cccc(F)c1O)c1ccsc1 770666695 CAESGLAYCNRJSV-LBPRGKRZSA-N 267.325 2.416 10 10 CECE CCc1cc(CN)n([C@@H](C)c2c(O)cccc2OC)n1 2070035252 DVGNWFBSBCDIKS-JTQLQIEISA-N 275.352 2.228 10 10 CECE CCc1ncncc1CN[C@@H](C)c1c(O)cccc1O 2178833291 WFEJNSHMJSJLRB-JTQLQIEISA-N 273.336 2.301 10 10 CECE CN[C@@H](c1ccccc1O)[C@H](O)c1ncoc1C1CC1 2169517887 LZBHULILEKGMIN-JSGCOSHPSA-N 274.320 2.252 10 10 CECE COc1nc(C)cc(COCCc2ccc(N)cc2)n1 2176291248 ZBEHPSRWXFPIFA-UHFFFAOYSA-N 273.336 2.135 10 10 CECE OCc1ccc(N2Cc3ccccc3[C@H](CO)C2)cc1 2176253010 VEOKOBFCCJUJCC-HNNXBMFYSA-N 269.344 2.275 10 10 CECE Cc1cc(N2Cc3ccccc3[C@@H](CN)C2)nnc1C 2176226499 NJQFASRTBBABPL-AWEZNQCLSA-N 268.364 2.156 10 10 CECE CCO[C@@H](C)c1noc(CN2CCC(N=[N+]=[N-])CC2)n1 2169823874 SKSYVQBWVABDTG-VIFPVBQESA-N 280.332 2.442 10 10 CECE Nc1ccc(CCNC(=O)[C@H]2[C@@H]3[C@@H]2CCC3(F)F)cc1 2170827124 PWLFARZDOGOUTO-UPJWGTAASA-N 280.318 2.219 10 10 CECE O=C(c1ccc(O)cc1)c1cc(O)cc2c1NCC2 2080581335 DOJDAISUMQPFCR-UHFFFAOYSA-N 255.273 2.297 10 10 CECE Cn1ccc2c1CN(c1ccc(CN)c(F)c1F)CC2 2170993606 KOZQMONWTJZCOO-UHFFFAOYSA-N 277.318 2.325 10 10 CECE Nc1ccc(CC(=O)OCC23CCC(CC2)OC3)cc1 2192946574 MEATYMVWOKNREF-UHFFFAOYSA-N 275.348 2.314 10 10 CECE CC(=O)c1ccc(O)c(CN2CC[C@@](C)(CCO)C2)c1 2188435301 QTZFWZAPKPVRBD-INIZCTEOSA-N 277.364 2.189 10 10 CECE O=[N+]([O-])c1cc(N2CC[C@H](C(F)(F)F)C2)ccc1CO 2188575221 GJAHZMKFKSGPMA-VIFPVBQESA-N 290.241 2.476 10 10 CECE NN[C@H](c1ccccc1O)C12CC(C1)[C@@H](C(F)(F)F)O2 2193077353 DQDICRSCNZISMV-BXVAXIAFSA-N 288.269 2.007 10 10 CECE COc1cc(Cl)cc(CN[C@@H]2CC[C@@H]3C[C@]32CO)c1O 2188660933 WPABVEISOWWJIA-YVLXSGLVSA-N 297.782 2.305 10 10 CECE C[C@H]1CC[C@@H](CNCc2cc3c(cc2O)OCO3)S1 2095320732 ZYJOLGVLNUZYIQ-ONGXEEELSA-N 281.377 2.495 10 10 CECE CC1(O)CC2(CN(c3ccc4c(c3)CCC[C@@H]4N)C2)C1 2184684274 KHQQWKFWSPJBIM-HNNXBMFYSA-N 272.392 2.374 10 10 CECE OC[C@@H]1CN(c2ccc3c(c2)CCC[C@@H]3O)CC12CC2 2184684251 KARDDVVPLHQHFS-BBRMVZONSA-N 273.376 2.265 10 10 CECE CN[C@@H]1CCc2cc(N3C[C@@H](C)CC[C@H]3CO)ccc21 2184727105 NRJSPFIWRVIYRM-YLQAJVPDSA-N 274.408 2.491 10 10 CECE CN[C@H]1CCc2cc(N3CCC(CCO)CC3)ccc21 2184727376 UWILHRBGLWWAIQ-KRWDZBQOSA-N 274.408 2.492 10 10 CECE CN1CC[C@@H]2[C@@H]1CCCN2c1ccc2c(c1)CC[C@@H]2O 2184731100 DDYIVTGZFREHEQ-BBWFWOEESA-N 272.392 2.339 10 10 CECE Oc1cccc(F)c1CNC[C@H]1C[C@H](n2cccn2)C1 2184863204 FWVWQIKHPHFXMA-HAQNSBGRSA-N 275.327 2.469 10 10 CECE C[C@H](N)c1ccc(N(C)Cc2ncno2)cc1Cl 2042282407 CZPZAGXGHNEBQM-QMMMGPOBSA-N 266.732 2.379 10 10 CECE Cc1ccc(C)n1-c1ccc(NS(C)(=O)=O)cc1 2042301017 DZANITNBTVIRQR-UHFFFAOYSA-N 264.350 2.466 10 10 CECE CNCc1ccc(N(CCO)[C@H]2C[C@H]2C)cc1Cl 2048216717 QPOLTKJQWZATGL-YGRLFVJLSA-N 268.788 2.267 10 10 CECE CN[C@@H](C)c1cc(F)c(N2C[C@@H](O)C(F)(F)C2)c(F)c1 2194702219 MCKHQMQWYZBRGH-WRWORJQWSA-N 292.276 2.061 10 10 CECE CC1(C)CC(S(=O)(=O)NCC2(CN=[N+]=[N-])CC2)C1 2054028449 DPEVZRIZLIUQSU-UHFFFAOYSA-N 272.374 2.185 10 10 CECE CC(C)NCc1cc(F)c(N2C[C@@H]3COC[C@@H]32)c(F)c1 2186369383 DNBVIIAGHNDGCY-RISCZKNCSA-N 282.334 2.298 10 10 CECE C[C@H](O)c1ccc(N(C)[C@@H](CCO)C(F)F)cc1 2058237922 VEKSGAGCBLQXNR-CABZTGNLSA-N 259.296 2.192 10 10 CECE CO[C@H](C)CCN(C)CCOc1ccc(N)cc1 2059349802 HUKMXSQHYMYFBW-GFCCVEGCSA-N 252.358 2.004 10 10 CECE C[C@@H](O)c1cc(F)c(N2C[C@@H]3CC[C@@]3(CO)C2)c(F)c1 2198882316 SCMGCFYNVLAQNK-VPJDZLOFSA-N 283.318 2.227 10 10 CECE COc1ccc(N2CCN[C@H](CC(F)(F)F)C2)c(N)c1 2191900402 KRJUAAKXXXZAEF-SECBINFHSA-N 289.301 2.008 10 10 CECE N[C@H]1CCCc2cc(N3CC[C@@H](O)[C@@H]3C3CC3)ccc21 2187175089 WVDNGFIESMBDJM-BBWFWOEESA-N 272.392 2.372 10 10 CECE C[C@H](COC(=O)COc1ccc(N)cc1)OC(C)(C)C 2192215158 WPPYGQOLLONPCL-LLVKDONJSA-N 281.352 2.394 10 10 CECE COCC(COC)C[C@H](O)c1ccc2c(c1)CCN2C 2187452613 USESZLGPOLXDKY-INIZCTEOSA-N 279.380 2.011 10 10 CECE CCCNCc1ccc(N2C[C@@H]3C[C@H]2CN3CC)cc1 2187596082 YJUFYYSWGVDMSX-IRXDYDNUSA-N 273.424 2.469 10 10 CECE CCNCc1ccc(N2C[C@H]3C[C@H]2CN3C(C)C)cc1 2187595980 WZHSNNDIFWTFAB-SJORKVTESA-N 273.424 2.467 10 10 CECE CCCN(Cc1ccccc1O)C[C@H]1CCN(C)C1=O 2195998414 WULCOFVCTQFFIH-CQSZACIVSA-N 276.380 2.083 10 10 CECE NCc1ccc(N2C[C@@H]3C(C(F)F)[C@H]3C2)cc1F 2072205135 RJVDGEYTKMFMQA-UWVGGRQHSA-N 256.271 2.232 10 10 CECE CC1(C)CC[C@@H](N)CN1Cc1c(O)cccc1F 2073208484 JELGZSBZMQFVHM-SNVBAGLBSA-N 252.333 2.233 10 10 CECE C[C@@H](N=c1nnc2ccccc2[nH]1)c1ccccc1O 2192631965 NMCKLMXQKSBYPR-SNVBAGLBSA-N 266.304 2.325 10 10 CECE C[C@H](NC[C@@H](C)OC(F)F)c1c(O)cccc1O 2076282243 ZVWIUKDXLLKXSE-SFYZADRCSA-N 261.268 2.376 10 10 CECE CCNCc1ccc(N2[C@@H]3COC[C@H]2C3)c(Cl)c1 2077880355 IUUDZPGEVZDVSH-TXEJJXNPSA-N 266.772 2.427 10 10 CECE CC[C@H](N[C@@H](C)c1ccc(C)cc1O)C(=O)N(C)C 2100228862 LIWODQNQSRRFGB-AAEUAGOBSA-N 264.369 2.218 10 10 CECE Oc1ccc(CNC[C@@H]2CC[C@H]3[C@H]2C3(F)F)cc1O 2102154206 WKYFDLOFCNMRDV-KWBADKCTSA-N 269.291 2.479 10 10 CECE CNCc1ccc(N(C)[C@H]2CN3CC[C@H]2C3)c(Cl)c1 2102506736 HWIRVYXZEGITHO-WFASDCNBSA-N 279.815 2.200 10 10 CECE C[C@H](N[C@H]1C[C@H]2C[C@H]1C[C@H]2O)c1cc(F)ccc1O 2104400003 FYWMNBQPSPIVFV-RMEBFJKESA-N 265.328 2.341 10 10 CECE Cc1cccc(O)c1CN1[C@H]2CC[C@H]1CC(CN)C2 2104510896 OENMYPHYCCBFIS-KBPBESRZSA-N 260.381 2.402 10 10 CECE CN(C)c1ccc([C@H](N)[C@@H](O)[C@H]2CC=CCC2)cc1 2106857906 QAVTUOGODSRZDS-BPUTZDHNSA-N 260.381 2.470 10 10 CECE OCc1ccc(N2CCC([C@H](F)CO)CC2)c(Cl)c1 2106947332 CFUDGJBXGXCGLP-CYBMUJFWSA-N 287.762 2.379 10 10 CECE Cc1oncc1CNCc1ccc2c(c1)CCN2C 2087286813 KWXVUNMHNLJFNK-UHFFFAOYSA-N 257.337 2.265 10 10 CECE CN[C@@H](c1ccccc1O)c1cnc2ccccn12 2107776104 KZAFVSXGZSACHZ-HNNXBMFYSA-N 253.305 2.349 10 10 CECE CC[C@@](C)(C(=O)OC)[C@H](O)c1ccc(N(C)C)cc1 2108444898 WCIGYPYPASFZRU-UKRRQHHQSA-N 265.353 2.375 10 10 CECE NC[C@@H]1C[C@H]2CCC[C@@H]2N1Cc1c(O)cccc1F 2108551257 RVQBHEQAFKWLPP-SUNKGSAMSA-N 264.344 2.233 10 10 CECE CCOC(C)(C)CS(=O)(=O)Nc1ccc(O)c(F)c1 2088706616 LYXAQBQZGJTDCJ-UHFFFAOYSA-N 291.344 2.088 10 10 CECE CCN[C@H](CC)c1ccc(N(C)C2CN(C)C2)cc1 2089241708 RCKXQTSPFPSMKK-MRXNPFEDSA-N 261.413 2.497 10 10 CECE C[C@@H](N)c1ccc(N(C)[C@@H]2CCCOCC2)cc1O 2089232784 AVEREPZUGFFPRK-VXGBXAGGSA-N 264.369 2.417 10 10 CECE COc1ccc(CN(C)C[C@@H]2C[C@H](C)CO2)c(O)c1 2109941834 HHTLKSMDXLOENK-FZMZJTMJSA-N 265.353 2.258 10 10 CECE C[C@]1(OCCNCc2ccc(Cl)cc2O)CCOC1 2090125549 WCDIKEBRCTVKCN-AWEZNQCLSA-N 285.771 2.331 10 10 CECE Nc1ccc(CNC[C@]2(O)CC3CCC2CC3)cc1 2092533633 HBQFQMWCWNFWOI-LDZOIKDWSA-N 260.381 2.300 10 10 CECE COc1cc(Cl)cc(CN2CCOC(F)(F)C2)c1O 2096016587 ZVGSSCPBSZWBPN-UHFFFAOYSA-N 293.697 2.479 10 10 CECE CNCc1ccc(N2CC[C@@H](O)CC2(C)C)c(F)c1 2113562541 WCRSZJITZHWARQ-GFCCVEGCSA-N 266.360 2.285 10 10 CECE CCOC(=O)[C@@H](NCCN=[N+]=[N-])c1cnc(CC)s1 2114306710 IVEODLBANJRIFD-JTQLQIEISA-N 283.357 2.210 10 10 CECE CCCN([C@H]1CCNC1=O)[C@H](C)c1ccccc1O 2114763934 IZJKUOQECOGAND-YPMHNXCESA-N 262.353 2.054 10 10 CECE CN(CC(=O)Nc1ccc(N)cc1)[C@@H]1CCC[C@H]1F 2118947932 FHTYSEKSZZBPQJ-CHWSQXEVSA-N 265.332 2.030 10 10 CECE Cc1c(C)n(C[C@@H]2C=CCN2)c2ccc(C(=O)O)cc12 2203024849 UHANMZWOSXIDRE-ZDUSSCGKSA-N 270.332 2.484 10 10 CECE CCNCc1ccc(N(C)[C@H]2CCCOC2)cc1OC 2204555376 XTPBFDLGICWDCZ-HNNXBMFYSA-N 278.396 2.420 10 10 CECE COc1cc(N2C[C@@H]3COC[C@H]32)ccc1CNC(C)C 2204546006 WSZVYGFIACCRBK-UKRRQHHQSA-N 276.380 2.028 10 10 CECE C[C@@H]1C[C@@H]2CN(c3cc4c(cc3Cl)[C@H](N)C(=O)N4)C[C@H]21 2206413767 CFRZRXTYEGQOKF-LMDOXVSESA-N 291.782 2.384 10 10 CECE CO[C@@H]1C2(CCC2)C[C@@]1(N)c1ccc2c(c1)CCN2C 2206691082 UKYXHWHHLVNACE-NVXWUHKLSA-N 272.392 2.422 10 10 CECE Cc1cc([C@@H](C)O)ccc1N1C[C@@H]2C[C@H](C1)[C@@]2(C)O 2270696571 SGTPEUUMVNNNHH-OEYIWLLWSA-N 261.365 2.255 10 10 CECE COc1ccc(N(C)C[C@@H]2CC[C@H]2OC)c(N)c1 2220532956 UHJPZSRFDWLEAT-IINYFYTJSA-N 250.342 2.139 10 10 CECE Cc1ccc(O)c(CN[C@@H](C(F)F)[C@H]2CCOC2)c1 2231044659 MAOMNNIQYMUQLS-GXFFZTMASA-N 271.307 2.460 10 10 CECE COCCCCCCNCc1ccc(O)c(O)c1 2221362050 BZRZONDPZXSGEK-UHFFFAOYSA-N 253.342 2.394 10 10 CECE Cc1cc([C@H](C)N)ccc1N(C)C[C@H]1[C@@H]2COC[C@@H]21 2232028689 TVEAYEBXNVCERQ-CYUUQNCZSA-N 260.381 2.343 10 10 CECE CCN(CCCOc1ccc(N)cc1)[C@H]1CCC[C@@H]1O 2232612245 YGBREGPCBQYNFG-HOTGVXAUSA-N 278.396 2.273 10 10 CECE COc1ncc(Cl)cc1C(=O)NCc1ccccc1O 2232989480 LCKVYWAYKFSKIG-UHFFFAOYSA-N 292.722 2.379 10 10 CECE COC[C@]1(O)CCCN(c2ccc(OC(C)C)cc2)C1 2235113817 URNIBPHONGSZAU-INIZCTEOSA-N 279.380 2.452 10 10 CECE CC(C)Oc1ccc(N2CC[C@@H]([C@](C)(O)CO)C2)cc1 2235109071 PMIBHOOOTXJOCZ-CZUORRHYSA-N 279.380 2.043 10 10 CECE CON(C)CCCN[C@@H](C)c1ccc(N(C)C)cc1 2225725065 RGKZYTJIRGOSKR-ZDUSSCGKSA-N 265.401 2.287 10 10 CECE CNCc1cc(OC)ccc1N(C)C[C@@H]1CCC[C@@H]1O 2235963373 QIDMPGLGCPORTQ-LRDDRELGSA-N 278.396 2.012 10 10 CECE COc1ccc(N2CC(OCC(C)C)C2)c(CCN)c1 2235972592 NDFVKZMYFGNNMO-UHFFFAOYSA-N 278.396 2.058 10 10 CECE OC[C@@H]1CCCCN(c2ccc3c(c2)COCC3)C1 2226709574 YNSRXTZVCIDMJJ-CYBMUJFWSA-N 261.365 2.358 10 10 CECE COc1ccc(N2CC[C@H](O)[C@@H]2C2CC2)cc1OC 2226805853 QERUOBDBGADZDQ-WFASDCNBSA-N 263.337 2.053 10 10 CECE COc1ccc(N2CCCC[C@@H]2[C@@H](C)O)c(C=O)c1 2227696219 MTLCNAPSCGAFID-BXUZGUMPSA-N 263.337 2.247 10 10 CECE Cc1cc(N(C)C[C@]23COC[C@H](C2)C3)ccc1CO 2228100574 MEJSCTJWZZAHGN-AKAXFMLLSA-N 261.365 2.350 10 10 CECE CN[C@@H]1CCc2cc(N3[C@H]4CC[C@@H](O)[C@H]3CC4)ccc21 2238208410 XNDJXXJMMJKDPK-BASLNEPJSA-N 272.392 2.385 10 10 CECE Oc1cc(F)ccc1CNC[C@H](F)C1CCOCC1 2229967699 YQQJFHPCKXUQNE-ZDUSSCGKSA-N 271.307 2.386 10 10 CECE CSc1ncc(CN[C@H]2CC[C@H](CN)C2)s1 2243833043 PQIMGWFAUHEFOH-IUCAKERBSA-N 257.428 2.082 10 10 CECE CNCc1ccc(N2CC[C@@]3(O)C[C@H]3C2)c(Cl)c1 2254098857 RBIUOMFCIXJUMK-SMDDNHRTSA-N 266.772 2.021 10 10 CECE COC[C@]1(C)C[C@@H]1N[C@@H](C)c1ccc(O)cc1O 2257026486 MKDIWRQMDHZBMD-HERUPUMHSA-N 251.326 2.173 10 10 CECE CN1CCN(c2ccc(CO)cc2)[C@@H](C(C)(C)C)C1 2273569761 AZTIDKGKLKUQIP-OAHLLOKOSA-N 262.397 2.345 10 10 CECE CSc1ncc(CNC(=O)[C@@H](N)c2ccccc2)s1 2269200069 LPAVJQKKJLLGTD-NSHDSACASA-N 293.417 2.181 10 10 CECE Cc1cc(N2CCN(C)[C@H]3CC[C@H]32)ccc1[C@H](C)O 2269680012 WJDOUFMJENPNNG-VBNZEHGJSA-N 260.381 2.331 10 10 CECE COc1ccc(N2CC[C@@H]3CCN[C@H]3C2)c2c1CCC2 2284589805 GEHAJBWQCDIZML-WFASDCNBSA-N 272.392 2.372 10 10 CECE COc1ccc(N2C[C@H](CCO)O[C@H](C)C2)c(C)c1C 2284593139 FYJVKIZNARKDJO-RISCZKNCSA-N 279.380 2.288 10 10 CECE COc1ccc(N2CC[C@@H](O)[C@@H]2C2CC2)c(OC)c1C 2295379293 YVNVPNVYRSRDBJ-HIFRSBDPSA-N 277.364 2.362 10 10 CECE CN[C@H](C)c1ccc(N2CCC[C@H]2CC(N)=O)c(C)c1 2285713967 DYYKWFNZOXWXKW-OCCSQVGLSA-N 275.396 2.120 10 10 CECE C[C@H]1[C@H](C)C[C@H]1NCc1ccc(N2CCNCC2)cc1 2286065769 MXNBEWXFHCUNRE-JKIFEVAISA-N 273.424 2.230 10 10 CECE CC[C@]1(C)CCN1Cc1ccc(N2CCNCC2)cc1 2286073305 LWSYEMOTGIXBKW-QGZVFWFLSA-N 273.424 2.471 10 10 CECE Nc1ccc(CCC(=O)N2CCc3ncsc3C2)cc1 2287205647 RHGUXHRABLPAIY-UHFFFAOYSA-N 287.388 2.243 10 10 CECE O=C(Nc1ccc(F)cc1)c1cc(O)c(O)c(O)c1 586731332 UBSSJPGRSOKUBV-UHFFFAOYSA-N 263.224 2.195 10 10 CECE C[C@@H](CN(C)C)N(C)Cc1ccc(Cl)cc1O 2306893103 DCZJHZRQOQDQIQ-JTQLQIEISA-N 256.777 2.428 10 10 CECE CC1(C)COC[C@@H]1CNCc1c(O)cccc1F 2314577132 VFFNZKQQGKRTCC-JTQLQIEISA-N 253.317 2.294 10 10 CECE COc1cc(Cl)c(N2CC=C[C@@H](O)C2)c(OC)c1 2319641719 FWSKFCQHBRSSQO-SECBINFHSA-N 269.728 2.094 10 10 CECE CO[C@H]1CC[C@@H]2CN(c3ccc(CN)cc3F)C[C@@H]21 2328657157 KUQXYONEUPLDDL-XUJVJEKNSA-N 264.344 2.146 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]3CC[C@H]2O3)CC1 2328983342 QBLPUTFADMBNKC-WRWGMCAJSA-N 264.329 2.245 10 10 CECE 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COc1ccc(N2CC[C@@H]3[C@@H](O)C(C)(C)[C@@H]32)c(F)c1 2226775198 MGSJKEBJRRJTPI-ZLKJLUDKSA-N 265.328 2.430 10 10 CECE CC[C@H]1CO[C@@H](C)CN1c1ccc(OC)cc1CO 2227708393 HWGSVRHWNGOOJF-AAEUAGOBSA-N 265.353 2.191 10 10 CECE COc1ccc(N(C[C@H](C)OC)C(C)C)c(CO)c1 2227709213 RAPSPIRSUPZWAA-LBPRGKRZSA-N 267.369 2.437 10 10 CECE COc1ccc(O)c([C@H](C)NC[C@H](F)[C@H]2CCOC2)c1 2238312701 VVEXKERWALFWRY-MJVIPROJSA-N 283.343 2.426 10 10 CECE CN(C[C@H](F)[C@@H]1CCOC1)c1ccc2c(c1)CC[C@@H]2N 2238333146 KVXYOBWJKOMBLZ-KCXAZCMYSA-N 278.371 2.443 10 10 CECE O=C1Nc2cc(N3CC[C@@H]4C[C@@]4(F)C3)c(Cl)cc2[C@@H]1O 2238602373 ZEBMICNJDJYSFT-FDHQVAJDSA-N 296.729 2.264 10 10 CECE CN(C)C[C@H]1C=CCN1c1ccc2c(c1)CCC[C@@H]2O 2239104011 MWNOGBRBQSCANF-WBVHZDCISA-N 272.392 2.363 10 10 CECE CN(C)c1ccc(OC[C@@H](O)c2ccccn2)cc1 2229380743 HRFVEMBCZTWMAF-OAHLLOKOSA-N 258.321 2.260 10 10 CECE Cc1cc(O)cc(C)c1NS(=O)(=O)Cc1ccncc1 2239722088 NCKWAZVDZJKZAY-UHFFFAOYSA-N 292.360 2.346 10 10 CECE COc1ccc(N(C)C[C@H](F)[C@H]2CCOC2)c(N)c1 2229991783 DIVVRSCQNGONBJ-JQWIXIFHSA-N 268.332 2.088 10 10 CECE Cc1cc([C@H](C)N)ccc1N1CCCN(C)C(=O)CC1 2240757432 HLMGXDWFBISXMD-ZDUSSCGKSA-N 275.396 2.073 10 10 CECE Cc1cc(N2CCC[C@@H](S(C)(=O)=O)C2)ccc1[C@@H](C)N 2285147205 ZBVDLENDXMQFIY-TZMCWYRMSA-N 296.436 2.028 10 10 CECE CSc1ncc(CNC[C@@]2(C)CC(F)(F)CN2)s1 2257129932 BRVIGQAFBVBFQM-SNVBAGLBSA-N 293.408 2.342 10 10 CECE COc1cc(C)c(N2CC(O)(C(F)F)C2)c(C)c1 2257404802 JELFSJAALUURCV-UHFFFAOYSA-N 257.280 2.128 10 10 CECE CCOC(CNCc1cnc(SC)s1)OCC 2248608219 HYDRQAOLAFYKAB-UHFFFAOYSA-N 276.427 2.354 10 10 CECE CSc1ncc(CNCCCCC2CNC2)s1 2248731165 BSCKMJLNWHZTME-UHFFFAOYSA-N 271.455 2.344 10 10 CECE NC[C@]12C[C@H]1CN(Cc1cc(Cl)cc(Cl)c1O)C2 2259934999 JDYMPGIBJOTNBM-ZANVPECISA-N 287.190 2.480 10 10 CECE COc1cccc(O)c1CNC[C@@]1(C)CCC[C@@H]1O 2271292151 AUDNWUWVJQZSSU-LSDHHAIUSA-N 265.353 2.042 10 10 CECE Oc1ccc(CNc2ccc3ccnn3c2)c(O)c1 2271508702 DFXJOZPVOXAHCT-UHFFFAOYSA-N 255.277 2.358 10 10 CECE CCN[C@@H](CCNC)c1ccc2c(c1)CCN2CC 2271958154 FBPBEWCXUFOTCK-HNNXBMFYSA-N 261.413 2.329 10 10 CECE C[C@@H](N[C@H]1CC[C@H](C(N)=O)CC1)c1ccccc1O 2272266722 QJKKOPVRHWEGAY-IJLUTSLNSA-N 262.353 2.087 10 10 CECE CC(C)CN(C[C@@H](C)O)c1c(F)cc(CN)cc1F 2272393218 UYPGLQYLPHTQRM-SNVBAGLBSA-N 272.339 2.267 10 10 CECE CC1(C)COc2ccc(N3C[C@@H]4C[C@]4(CN)C3)cc21 2272655622 QOGLIWSQVAAXCG-ZBEGNZNMSA-N 258.365 2.142 10 10 CECE C[C@]1(O)C[C@H]2[C@@H]1CCN2c1ccc(OCF)cc1 2263850486 NRKHREDXOIUXJC-IHRRRGAJSA-N 251.301 2.342 10 10 CECE O[C@H]1CCN(c2ccc(OC(F)F)cc2)C[C@H]1F 2263938199 UWOBLMYLURHZBD-MNOVXSKESA-N 261.243 2.197 10 10 CECE [N-]=[N+]=NCCCCN1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 2264978019 KPKSSFLFXDXHCI-UKKRHICBSA-N 262.313 2.108 10 10 CECE CO[C@@H](C[S@@](=O)CCOc1ccc(N)cc1)C(C)C 2268688911 VZGBYHVQVQJVBD-LIRRHRJNSA-N 285.409 2.067 10 10 CECE O=C(O)[C@H]1CC[C@H](CNCc2ccc(Cl)cc2O)OC1 2279416311 WOBJSFDGOBBLNF-CMPLNLGQSA-N 299.754 2.015 10 10 CECE C[C@H](O)c1ccc(N2CC3(CCC(=O)NC3)C2)c(Cl)c1 2280253424 HVCZLGUZPBROMV-JTQLQIEISA-N 294.782 2.110 10 10 CECE C[C@H](CNCc1ccc(F)c(F)c1O)Cc1cn[nH]c1 2290436314 NRFYTGRJMNBOMI-VIFPVBQESA-N 281.306 2.362 10 10 CECE Cc1cc(N(CCS(C)(=O)=O)C2CC2)ccc1[C@H](C)O 2285157406 IBOPFAFQODFHEW-LBPRGKRZSA-N 297.420 2.062 10 10 CECE Cc1cc(N(C)[C@H]2CS(=O)(=O)C2(C)C)ccc1[C@H](C)O 2285174302 PTTAYJCWQMLLHM-FZMZJTMJSA-N 297.420 2.060 10 10 CECE Cc1cc(N(C)C[C@@]2(C)COCCO2)ccc1[C@H](C)N 2285120537 HDPQOLYWBIJFNS-BBRMVZONSA-N 278.396 2.256 10 10 CECE CN1CCc2cc([C@]3(O)[C@H]4CC[C@@H]3C[C@H](N)C4)ccc21 2285810725 FCJUHXHBCASHLM-IUGPZWINSA-N 272.392 2.014 10 10 CECE Nc1cc2c(cc1N1CCc3ncsc3C1)OCCO2 2287199909 FXBIKKWFGNYPOL-UHFFFAOYSA-N 289.360 2.059 10 10 CECE C[C@@H](NC(=O)CNC1CCCCC1)c1ccccc1O 2288184292 MSCQHMZCDZIPRS-GFCCVEGCSA-N 276.380 2.492 10 10 CECE CSc1ncc(CNC[C@H]2C[C@@H]3C[C@@H]3CO2)s1 2298463983 LMNMOVNDVKFOTD-IVZWLZJFSA-N 270.423 2.380 10 10 CECE Cc1cccc(N(C)C(=O)/C=C/c2cnccn2)c1 491465551 ROUYVPRWEVIUPO-VOTSOKGWSA-N 253.305 2.461 10 10 CECE COc1ccc(N2[C@H]3CC[C@@H]2C[C@H]3CN)cc1F 2309703168 AMYICOJOGUQNIR-CWSCBRNRSA-N 250.317 2.150 10 10 CECE Oc1c(Cl)cccc1CN[C@H]1C[C@@H]2C[C@H]1C[C@@H]2O 2310039907 KDTBQAIIWKBHNH-UKJIMTQDSA-N 267.756 2.295 10 10 CECE COC(=O)[C@]1(NCCN=[N+]=[N-])CCCC[C@@H]2C[C@@H]21 2319450834 KRRLLIRSDFYXGD-SCVCMEIPSA-N 252.318 2.008 10 10 CECE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])[C@@H]1C[C@H]1C1CC1 2332647318 GBEOFWASMHAYIN-TUAOUCFPSA-N 266.345 2.254 10 10 CECE CN[C@H](c1ccccc1O)[C@@]1(O)CC[C@@H]2[C@H]1C2(F)F 2333871872 MBFUXCDFZQXARY-OJAKKHQRSA-N 269.291 2.059 10 10 CECE C[C@]12C[C@H](C1)[C@@H](C(=O)N1CCC(N=[N+]=[N-])CC1)CO2 2337678104 XFODJUVCPVSLJX-XHVZSJERSA-N 264.329 2.103 10 10 CECE COc1cccc(O)c1CNC(C)(C)[C@H](O)C(C)C 2340516939 XHIOGKZXSXFKRL-CQSZACIVSA-N 267.369 2.286 10 10 CECE CO[C@H]1C[C@@H]2C[C@H]1CN2c1c(F)cc(CN)cc1F 2340782863 JKXUBFMWKBRZHD-KWBADKCTSA-N 268.307 2.037 10 10 CECE Cc1ncc(CN2CCc3cc(O)c(O)cc3C2)s1 2341214249 KBJUVGIXGCTBSZ-UHFFFAOYSA-N 276.361 2.421 10 10 CECE Cc1cccc(CNC[C@]2(O)C[C@@H]2C(F)(F)F)c1O 2344272225 TTZJOACHLGEZAV-CMPLNLGQSA-N 275.270 2.104 10 10 CECE CCC[C@H](CO)SCCC(=O)Nc1ccc(N)cc1 2352513381 ZDSNNOSZKLSBIC-CYBMUJFWSA-N 282.409 2.492 10 10 CECE CSc1cc(N2CCC[C@H]2CN(C)C)ccc1CN 2353849558 QFWSSXSFABZFIK-AWEZNQCLSA-N 279.453 2.398 10 10 CECE CSc1cc(N2CC[C@@H](O)C(C)(C)C2)ccc1CN 2353860174 QHTQGOXNJJYKIU-CQSZACIVSA-N 280.437 2.464 10 10 CECE CO[C@@H]1C[C@H]2C[C@@H]1C[C@@]2(N)c1ccc2c(c1)CCN2C 2354608677 HLOCCLWEZRIOIY-ODVANORSSA-N 272.392 2.278 10 10 CECE COC(=O)[C@@H](NCc1cccc(O)c1O)c1ccccc1 50507532 PPYZAIBXHLTHNZ-AWEZNQCLSA-N 287.315 2.102 10 10 CECE [N-]=[N+]=NCCCNC(=O)c1ncccc1Br 231804368 TWPYHQQPKKYSEQ-UHFFFAOYSA-N 284.117 2.274 10 10 CECE C[C@H](N)c1ccc(N(CCO)C2CC2)c(Cl)c1 61697487 CLNDQAHAQLBKAU-VIFPVBQESA-N 254.761 2.321 10 10 CECE CCN(CC)[C@@H]1CCN(c2ccc(OC)cc2N)C1 213428723 OICPBUZHCLUPKW-GFCCVEGCSA-N 263.385 2.198 10 10 CECE CN(CC(=O)N(C)c1ccc(N)cc1)Cc1ccccc1 37272793 RBSORTNYVYYANP-UHFFFAOYSA-N 283.375 2.364 10 10 CECE COC(OC)[C@@H](C)N[C@H](C)c1cc(C)ccc1O 79604491 QLMNGIXOBCQULL-GHMZBOCLSA-N 253.342 2.359 10 10 CECE Cc1ccc([C@H](C)NCC2CCN(CCO)CC2)c(O)c1 185380665 GMBDPNHVZVNVAU-AWEZNQCLSA-N 292.423 2.056 10 10 CECE CCOc1ccc(O)c(CN(C)CCn2cccn2)c1 125315979 ASVFVGXNBPGRAM-UHFFFAOYSA-N 275.352 2.119 10 10 CECE C[C@H]1CN(Cc2c(O)cccc2Cl)CCN1C 133895023 YAKOYMWTAGGEML-JTQLQIEISA-N 254.761 2.182 10 10 CECE CO[C@H]1C[C@@H](CF)N(Cc2ccc(F)c(F)c2O)C1 2133722976 MICPNIPFLGUKQI-UWVGGRQHSA-N 275.270 2.229 10 10 CECE C[C@@H]1COc2ccccc2[C@]1(NCCCN=[N+]=[N-])C(=O)O 228184767 IEXQXYSOHTWWJZ-YGRLFVJLSA-N 290.323 2.285 10 10 CECE COC(=O)[C@H](NCCN=[N+]=[N-])[C@H]1CCC[C@@H](C)C1 227260663 GKDUETCQRHOLJJ-OUAUKWLOSA-N 254.334 2.254 10 10 CECE C[C@@H]1CC(N(CC(N)=O)Cc2ccc(N)cc2)C[C@H](C)C1 84949629 PXAMNUQIPXFTRW-OCZCAGDBSA-N 289.423 2.381 10 10 CECE Cc1cc(Cl)ccc1[C@H](NCCN=[N+]=[N-])C(N)=O 235760727 QBTLQDFDIINDNZ-JTQLQIEISA-N 267.720 2.075 10 10 CECE COC(=O)CC1(CSc2ncc(N)s2)CC1 234631884 MUIVCVITDWDQAS-UHFFFAOYSA-N 258.368 2.161 10 10 CECE CN(C[C@@H]1CCCN1C)c1ccc(CN)c(Cl)c1 92620581 BXABVAILXWQBLD-ZDUSSCGKSA-N 267.804 2.329 10 10 CECE CCCCC(=O)N1CCN(c2ccc3c(c2)OCO3)CC1 242609462 CLUKMWQGYAYKOF-UHFFFAOYSA-N 290.363 2.254 10 10 CECE Cn1c(-c2oncc2CCN)cc2cccc(O)c21 606594087 KGKFWUUXQIQGEF-UHFFFAOYSA-N 257.293 2.040 10 10 CECE COC(=O)[C@H](C)c1cc(Br)c(F)c(O)c1O 260688640 UVXURRBRNORYML-SCSAIBSYSA-N 293.088 2.276 10 10 CECE Cc1cc(CO)ccc1N(C)[C@H]1CCN2CCC[C@H]1C2 2164426462 UCRGAJRVLBODJU-RDJZCZTQSA-N 274.408 2.408 10 10 CECE CN(CCOc1ccc(N)cc1)C1(CO)CC(C)(C)C1 2164588012 UYMYNSPKCQUYJR-UHFFFAOYSA-N 278.396 2.131 10 10 CECE COc1cccc(CN(C)C[C@@H]2C[C@H]3CC[C@H]2O3)c1O 2168092993 PAIORKIPPHWZRU-BFHYXJOUSA-N 277.364 2.400 10 10 CECE CN1CCc2cc([C@H](O)[C@@H]3C[C@@H]4CCC[C@@H]4N3)ccc21 2164670845 PKXXYOWUFPPVOB-SIUGBPQLSA-N 272.392 2.243 10 10 CECE O=C1Nc2cc(N3C[C@H]4CC[C@@](F)(C4)C3)ccc2[C@H]1O 2168272390 VPIYQHBQXAANMU-JBCWJZNQSA-N 276.311 2.001 10 10 CECE FC(F)(F)[C@]1(NCc2ccc3c(c2)CCO3)CCOC1 2168284265 QIFMJANCUGZUQX-ZDUSSCGKSA-N 287.281 2.433 10 10 CECE C[C@@H]1CN[C@H](C)C[C@@H]1[C@H](O)c1ccc2c(c1)CCN2C 2163071181 MHKGXCNNEUUCOX-BKBUGSPTSA-N 274.408 2.346 10 10 CECE CCN1CCc2cc([C@@]3(O)CNCC(C)(C)C3)ccc21 2163074057 OSWWAEXNLHMATL-KRWDZBQOSA-N 274.408 2.276 10 10 CECE Cc1ncc([C@@H](N)c2ccc(N3CCCC3)cc2)cn1 2163127979 RNPQFENJPNZZMC-INIZCTEOSA-N 268.364 2.433 10 10 CECE CN(C)c1ccc([C@@H](CCOCC(F)(F)F)NN)cc1 2163141642 WPAHJACMYSQUOR-GFCCVEGCSA-N 291.317 2.226 10 10 CECE NN[C@H](c1ccc(N2CCCCC2)cc1)c1cnsn1 2163141963 ABYGMWQIBOOFPO-CQSZACIVSA-N 289.408 2.081 10 10 CECE CN1CCc2cc([C@H](N)[C@@](C)(O)c3cscn3)ccc21 2163142708 CWCAPUYSERNFDI-GJZGRUSLSA-N 289.404 2.043 10 10 CECE CCC[C@@](N)(C(=O)O)c1cccc(Br)c1O 713771259 KKHOWBXZNIGMEY-NSHDSACASA-N 288.141 2.193 10 10 CECE CNCc1cc(F)c(N2CC[C@@H]3OCC[C@H]3C2)c(F)c1 724838137 GWAOSKPXERJRTO-FZMZJTMJSA-N 282.334 2.299 10 10 CECE CC[C@@H](NC)c1ccc(N(C)CC(=O)NC2CC2)cc1 723181779 HCXPRMIOQJDLHL-OAHLLOKOSA-N 275.396 2.072 10 10 CECE C[C@@H](N)c1ccc(N2CC[C@](C)(C(N)=O)C2)cc1Cl 723150540 KJOKXCJUUIIDHD-OTYXRUKQSA-N 281.787 2.061 10 10 CECE CO[C@@H]1CC[C@H]1NCc1ccc(Br)cc1O 724200713 QFWXVPSMBHGOAU-ZYHUDNBSSA-N 286.169 2.422 10 10 CECE C[C@H](CN1CCOCC1)Cn1ccc2cc(N)ccc21 720006680 KYOAJZHHODZTRL-CYBMUJFWSA-N 273.380 2.192 10 10 CECE Cc1cccc(CN2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c1O 824653946 JSDVBNNLCRPBMJ-XHSDSOJGSA-N 291.391 2.062 10 10 CECE Oc1ccccc1CN1CCCC[C@]2(CCNC2)C1 903960166 YCWKMMZEKKGISN-MRXNPFEDSA-N 260.381 2.358 10 10 CECE COc1ccc(O)c(CNC(=O)C[C@@H](C)[C@H]2CCCO2)c1 830543629 AMOLGTGCOGRLOY-IAQYHMDHSA-N 293.363 2.222 10 10 CECE O=C(c1c(F)ccc(O)c1O)N1CC[C@@]2(C1)CC2(F)F 846662666 WSMMIPCHMVWDIU-LBPRGKRZSA-N 287.237 2.108 10 10 CECE Cc1cc(O)c(CNCC(C)(C)[C@]2(O)CCOC2)cc1C 842758219 HBHKCLVBZPVFRX-KRWDZBQOSA-N 293.407 2.276 10 10 CECE Cc1cc(Cl)cc(CNC[C@@H]2CCCNC2)c1O 841032628 IHDCHRQJNVDTSE-LLVKDONJSA-N 268.788 2.443 10 10 CECE C[C@@H](NC(=O)NCC1CSC1)c1ccccc1O 923834334 QCWHFVBTEIZNTL-SECBINFHSA-N 266.366 2.115 10 10 CECE Cc1ccc(O)c(CNC(=O)c2nc([C@@H]3C[C@@H]3C)no2)c1 866025192 GCHZLIOMNLLQNH-GXSJLCMTSA-N 287.319 2.137 10 10 CECE Nc1ccc(NC(=O)NC[C@H](O)c2ccsc2)cc1 1876148171 DECALOVSPMLZQO-LBPRGKRZSA-N 277.349 2.185 10 10 CECE CC(C)(C)[C@@](C)(O)CNC(=O)Nc1ccc(N)cc1 1876137350 QFADLXOSKFPGAG-AWEZNQCLSA-N 265.357 2.187 10 10 CECE COc1ccc(O)c([C@@H](C)Nc2nccc(O)n2)c1 1877598921 GVOGLUJKGSPETR-MRVPVSSYSA-N 261.281 2.070 10 10 CECE C[C@@H](c1ccccc1O)n1cncc1CC(C)(C)N 1877586492 LDOMFAKNPLDJMV-NSHDSACASA-N 259.353 2.478 10 10 CECE C[C@H]1CCN(c2ccc([C@@H](C)N)cc2F)C[C@@]1(C)O 1876950339 QSUFTWVCSHDXOJ-FIXISWKDSA-N 266.360 2.443 10 10 CECE C[C@@H](O)[C@@H]1CCCN1c1ccc2c(c1)CCC[C@H]2N 1879182127 KTVWMVDKPNDXAQ-LYRGGWFBSA-N 260.381 2.372 10 10 CECE COc1cc(C)cc(CN2CCC23CCOCC3)c1O 894571657 VGQJVBTVIDDXSS-UHFFFAOYSA-N 277.364 2.464 10 10 CECE COC[C@H](NCc1cccc(C)c1O)[C@@H]1CCCOC1 895855894 UPLOGNKWTFJNGO-CABCVRRESA-N 279.380 2.232 10 10 CECE Cc1cc(N2CC(O)(c3ccsc3)C2)ccc1CO 1878937684 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Cc1coc(SC[C@H](O)COc2ccc(N)cc2)n1 235935984 ZKUKASDYNDDAIX-LLVKDONJSA-N 280.349 2.097 10 10 CECE CCN[C@H]1C(=O)Nc2cc(N3CCC=CCC3)ccc21 2151341462 ZKPOODOLHZFFMI-OAHLLOKOSA-N 271.364 2.446 10 10 CECE CC(=O)C(=O)c1cccc(C)c1I 1951322427 GTDAXNLKVPLYAK-UHFFFAOYSA-N 288.084 2.371 10 10 CECE C[C@H]1CCS[C@H]1CN(C)CC(=O)Nc1ccc(N)cc1 2150866563 HDILNUIWPAPJAW-FZMZJTMJSA-N 293.436 2.281 10 10 CECE CC[C@@H](O)c1ccc(N(C)C[C@H]2OCCO[C@H]2C)cc1 2143685622 XSZOPBDLUYHABD-APHBMKBZSA-N 279.380 2.370 10 10 CECE CN1CCCc2cc([C@@H](O)[C@@H](N)c3ccsn3)ccc21 2147705615 ISVWSCSEAIOEQK-LSDHHAIUSA-N 289.404 2.259 10 10 CECE Oc1cc2c(cc1CN[C@H]1C[C@@H]3CSC[C@@H]3C1)OCO2 1973975165 GLCBCPMUSHPQMM-GDNZZTSVSA-N 293.388 2.352 10 10 CECE Nc1ccc(OCCNC(=O)C2(C(F)(F)F)CC2)cc1 2144256991 BHBIVLGCPZWOSP-UHFFFAOYSA-N 288.269 2.106 10 10 CECE Cc1cc([C@H](N)[C@@H](O)c2ccc3c(c2)CCN3C)co1 2147959751 CANYTJVFIRLSFM-HOTGVXAUSA-N 272.348 2.314 10 10 CECE CN1CC[C@@H](NCc2cc(F)cc(F)c2O)CC12CC2 1974263562 YIBRBEVLPVWMHR-GFCCVEGCSA-N 282.334 2.387 10 10 CECE Oc1cc(F)cc(CNCCc2ccc(O)c(O)c2)c1 2148008598 AVLMOZYFZMTWMR-UHFFFAOYSA-N 277.295 2.275 10 10 CECE Oc1ccc(CCN=c2[nH]oc3ccccc23)cc1O 2148017620 XQZMUMWLMRPJPY-UHFFFAOYSA-N 270.288 2.316 10 10 CECE CCOC(=O)CC[C@@H](N)c1cc(CF)ccc1O 260249731 HZHGRYBJWIPPEP-LLVKDONJSA-N 255.289 2.205 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1CC(CCCC(=O)O)C1 2145303838 NZGSPTDZRHZSRU-JTQLQIEISA-N 279.336 2.346 10 10 CECE [N-]=[N+]=N[C@H]1CCN(C(=O)c2cnc(Cl)s2)C1 1985864352 UPWGTORVJGCCFR-YFKPBYRVSA-N 257.706 2.321 10 10 CECE CC(C)N1CCN(c2ccc(CNC3CC3)cc2)CC1 36190565 OKMSRLXYZNWUJS-UHFFFAOYSA-N 273.424 2.469 10 10 CECE CCOc1cccc(CN[C@@H]2CCN3CCC[C@H]23)c1O 37168803 VCUAADRKXQLOFN-ZIAGYGMSSA-N 276.380 2.117 10 10 CECE NC(=O)Nc1ccc(NCc2ccc(O)cc2O)cc1 37136461 CMJPGCRFHOBXME-UHFFFAOYSA-N 273.292 2.201 10 10 CECE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCc1cnn[nH]1 2145969003 PGZMPQYGNWDNLA-JQWIXIFHSA-N 272.352 2.199 10 10 CECE CC(=O)c1ccc(O)c(CN2CCN(C(C)C)CC2)c1 37312775 PFKRNTMUUFCZFV-UHFFFAOYSA-N 276.380 2.121 10 10 CECE Cc1cccc(CN[C@@H](C)[C@@H]2CCCS(=O)(=O)C2)c1O 2146111744 JZTAIZMPZVMOOC-GXTWGEPZSA-N 297.420 2.004 10 10 CECE CCCN[C@@H](c1ccccc1O)[C@@H]1CCCS(=O)(=O)C1 2146239043 BKLINYDISXFUHH-IUODEOHRSA-N 297.420 2.258 10 10 CECE CO[C@H]1CN(c2ccc(C=CC(=O)O)cc2C)C[C@H]1F 2146472906 DXECCIRRVXDUGT-OCCSQVGLSA-N 279.311 2.266 10 10 CECE COC[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1COC 2149237626 BAZIQWJHERDXJL-STQMWFEESA-N 299.798 2.386 10 10 CECE N=C(N)Cc1cccc(CSc2nccs2)n1 1997672305 XCQOUMUQIFCAJM-UHFFFAOYSA-N 264.379 2.309 10 10 CECE Nc1ccc(NC(=O)CCN2CCC[C@H]3CC[C@@H]32)cc1 2151777404 ZCRREMDPAIUVGV-WFASDCNBSA-N 273.380 2.472 10 10 CECE COc1cc(N)c(N(C)C[C@H]2OCC[C@H]2C)cc1OC 2152420126 GNVLKHSYIHLJOJ-MEBBXXQBSA-N 280.368 2.147 10 10 CECE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H]1CC2(CC2)CN1 2152451818 AEFHVMWAUGXVJH-YPMHNXCESA-N 274.364 2.054 10 10 CECE FC(F)(F)COc1ccc(N2CCCNCC2)cc1 43461582 HEXGFXDKVYMJME-UHFFFAOYSA-N 274.286 2.427 10 10 CECE OCc1cc(F)c(N2CC3(CC[C@H]2CO)CC3)c(F)c1 2154156915 SVVDPOOZZWWOIO-NSHDSACASA-N 283.318 2.198 10 10 CECE CNCc1ccc(OC)c(CN2C[C@H](C)O[C@@H](C)C2)c1 50124226 SQPDKBXEDNRHPR-STQMWFEESA-N 278.396 2.024 10 10 CECE CCCNCc1ccc(N2CCC[C@@H](O)C2)c(C)c1 50561424 RXNJYGAAWJHUSS-OAHLLOKOSA-N 262.397 2.456 10 10 CECE C[C@H](N)c1ccc(N2CCO[C@@H](CO)C2(C)C)cc1Cl 2159629522 VEEHGQMKZRQGPO-HZMBPMFUSA-N 298.814 2.336 10 10 CECE C[C@H]1C[C@H](NCc2ccc(O)c(O)c2O)CCS1 2027214485 YNBQCELHACMFMW-WCBMZHEXSA-N 269.366 2.177 10 10 CECE CCc1nc(CNC(=O)Nc2ccc(N)cc2)c(C)o1 2160610933 GNDZBLLRTKHJKJ-UHFFFAOYSA-N 274.324 2.449 10 10 CECE CN(C)CCC(C)(C)NCc1cccc(F)c1O 2034957409 HLVBZLZOUDAXPS-UHFFFAOYSA-N 254.349 2.351 10 10 CECE CN[C@H](C)c1ccc(N2C[C@H](C)[C@@H](F)C2)cc1O 2035311209 NTSYLQZGMNRICF-CWSCBRNRSA-N 252.333 2.467 10 10 CECE CC(C)CNCc1ccc(N2CCC[C@H](O)C2)cc1 62737136 FMNZBUKEHZCVJF-INIZCTEOSA-N 262.397 2.393 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2C(F)(F)F)C1 2039125644 NGCVHLZFZSSSDP-GJMOJQLCSA-N 262.235 2.486 10 10 CECE COc1ccc(N(C)CC[C@@H]2CCCO2)c(N)c1 2039532794 ZYSYJIIWNQMUAM-NSHDSACASA-N 250.342 2.283 10 10 CECE CC(C)CN1CC[C@@H](N(C)c2ccc(CN)cc2F)C1 2160075672 GBQLCDSQXSZEEH-CQSZACIVSA-N 279.403 2.451 10 10 CECE CCCN1CC[C@@H](N(C)c2c(F)cc(CN)cc2F)C1 2160064163 FPCDCZGWEOGQQE-GFCCVEGCSA-N 283.366 2.344 10 10 CECE C[C@@H](O)C[C@@H](C)CNCc1ccc2c(c1)CCN2C 305220697 VNEJDXSHDORBIK-CHWSQXEVSA-N 262.397 2.176 10 10 CECE CCN(CC)CC(C)(C)NC(=O)Cc1ccc(N)cc1 308618637 KSYKQBXLCIUATL-UHFFFAOYSA-N 277.412 2.048 10 10 CECE O=C([C@H]1CNc2ccccc2N1)N1CCC(F)(F)CC1 405075509 DKXDAMHCERUGIK-GFCCVEGCSA-N 281.306 2.150 10 10 CECE COc1ccc(CN2CC[C@H](OC)C[C@@H]2C)c(O)c1 311318928 WVDFZVITCCWCLZ-FZMZJTMJSA-N 265.353 2.400 10 10 CECE CN(C)[C@H]1CCN(c2ccc(CO)cc2F)C2(CC2)C1 2160272107 IQXKJAKNHSAWHG-ZDUSSCGKSA-N 278.371 2.381 10 10 CECE CCN(Cc1nc(C)no1)c1c(F)cc(CO)cc1F 2160400634 HAVDFUFNHKUPAF-UHFFFAOYSA-N 283.278 2.175 10 10 CECE COc1cc(Cl)cc(CN2C[C@H](C)C[C@H]2C(=O)O)c1O 2159257713 CGFBTXPREFSMNZ-KCJUWKMLSA-N 299.754 2.349 10 10 CECE C[C@@H](NC[C@H](O)C(C)(C)C)c1cc(O)ccc1O 324455540 WUDGVAXPXQHSEO-RNCFNFMXSA-N 253.342 2.155 10 10 CECE COc1cccc(CNCc2cc(C)ccn2)c1O 328081245 GTCPIEXVWOTKBU-UHFFFAOYSA-N 258.321 2.394 10 10 CECE CC(C)NCc1cc(F)c(N2CCO[C@@H]3C[C@@H]32)c(F)c1 2171806023 STSROINNFOHLMK-UONOGXRCSA-N 282.334 2.440 10 10 CECE CN[C@@H]1C(=O)Nc2cc(N3CCC[C@@H]3CF)c(Cl)cc21 2171802176 IYRCDNRTGFLPEU-OQPBUACISA-N 297.761 2.491 10 10 CECE NCc1ccc(N2C[C@H]3C[C@H]2C[C@@H]3O)c(C(F)(F)F)c1 2172099010 ZBBAHWQZJUVFIR-NRUUGDAUSA-N 286.297 2.124 10 10 CECE C[C@@H]1Cc2cc(N3CC[C@@H]4CNC[C@H]4CC3)ccc2O1 2162635577 HGRYXQJWOLIOQX-MGPQQGTHSA-N 272.392 2.446 10 10 CECE CN1CCc2cc(C3(N)C[C@@H]4CC[C@H](C3)N4C)ccc21 2163062777 NONHHXJCKAEPAZ-FKEKPDDDSA-N 271.408 2.090 10 10 CECE CCN1CCc2cc([C@H](NC)c3cnn(C)c3)ccc21 2163065442 ABVMPSHWIXXXMX-INIZCTEOSA-N 270.380 2.111 10 10 CECE CNCc1cc(F)c(N2CC[C@@]3(CCOC3)C2)c(F)c1 707669383 SPKXEXZKKIGBNW-OAHLLOKOSA-N 282.334 2.301 10 10 CECE C[C@@H]1CC[C@@H]([C@@H](O)c2ccc3c(c2)CCCN3C)CN1 2163110544 JRFIGQHODYEHOO-VMGRFDJRSA-N 274.408 2.491 10 10 CECE NN[C@@H](c1cccc(C(F)(F)F)n1)c1ccccc1O 2172848121 CSQPWOWJPYPMOF-GFCCVEGCSA-N 283.253 2.359 10 10 CECE CC[C@@H]1COC[C@H]1N(C)c1ccc(OC)cc1N 688254188 XILGBIKOWCYWLY-QMTHXVAHSA-N 250.342 2.139 10 10 CECE CCN(c1ccc(CN)c(Cl)c1)C(C)(C)CO 688356493 YGWQVDGOARIOJG-UHFFFAOYSA-N 256.777 2.396 10 10 CECE C[C@@H]1CC[C@H](CO)CN1c1ccc(CO)cc1Cl 688719119 AWJQKSXIUVCQQR-PWSUYJOCSA-N 269.772 2.430 10 10 CECE COc1cc(Cl)cc(CNC[C@]23COC[C@H]2C3)c1O 689222672 JRADNFSVWGYUCJ-QMTHXVAHSA-N 283.755 2.180 10 10 CECE CCN[C@H](CSc1nccs1)c1cn(C)cn1 710541347 HTSMGRXEBUBJCG-SNVBAGLBSA-N 268.411 2.320 10 10 CECE Nc1cccc(F)c1N[C@@H]1CCN([C@@H]2CCCOC2)C1 2173070398 WWQLTBDRNBTIGA-VXGBXAGGSA-N 279.359 2.073 10 10 CECE CNCc1ccc(N(C)Cc2ccnn2C)cc1Cl 689527557 WYWICOQHQGXWSP-UHFFFAOYSA-N 278.787 2.429 10 10 CECE C[C@@H]1CN([C@@H](C)c2ccc(O)cc2O)CC[C@@H]1C(=O)O 380089207 KSNUDTSIISUGHJ-SCVCMEIPSA-N 279.336 2.201 10 10 CECE COc1cc(Cl)cc(CNCc2[nH]cnc2C)c1O 380024569 TWNIRBAOYSUEIM-UHFFFAOYSA-N 281.743 2.376 10 10 CECE C[C@@]1(O)C[C@H]2C[C@H]1C[C@H]2NCc1cc(F)cc(F)c1O 2178197236 LWTNIZFVOIDUAH-FMBSFYNOSA-N 283.318 2.310 10 10 CECE Oc1ccccc1CN[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 713573531 YCZKZSRIQGFJSF-NWANDNLSSA-N 259.349 2.439 10 10 CECE CCNCc1ccc(N2CCC[C@H](O)[C@@H]2C)c(F)c1 384897141 VNZYESSXVZMFNK-NHYWBVRUSA-N 266.360 2.285 10 10 CECE CC[C@@H]1[C@H](CO)CCN1c1ccc(CN)c(F)c1F 385627946 AVCRWUCNKSRMPB-WDEREUQCSA-N 270.323 2.021 10 10 CECE CC[C@H](NCc1ccc2c(c1)CCCN2C)[C@@H](C)O 386851722 ZKVWQSPLBOGJOC-DOMZBBRYSA-N 262.397 2.318 10 10 CECE CN(Cc1cc(F)ccc1O)[C@H]1C[C@H]2CCCN(C1)C2 718895609 USBRCOLEMFTRME-DOMZBBRYSA-N 278.371 2.447 10 10 CECE Cc1cc(N2CCC[C@H](C)[C@@H]2CCO)ccc1CN 697206709 HCKKSIDJDXDHNW-LRDDRELGSA-N 262.397 2.441 10 10 CECE COc1ccc(O)c(CN2C[C@H](C(=O)O)CC[C@H]2C)c1 397079662 PXGWNFPSSHNFBF-GHMZBOCLSA-N 279.336 2.086 10 10 CECE C[C@@H](c1ccc(O)cc1O)N1C[C@@H](C(=O)O)CC[C@H]1C 397045052 UOMSIIBDZDNOTM-VWYCJHECSA-N 279.336 2.344 10 10 CECE Cc1cc(CNC2CC2)ccc1N(C)CC[S@](C)=O 398879832 GYFSEKOGSPXWMR-IBGZPJMESA-N 280.437 2.062 10 10 CECE C[C@H]1CC[C@H](O)CN1c1ccc([C@@H](C)N)cc1F 399164934 CZRJUWQTVMGDEU-UMNHJUIQSA-N 252.333 2.195 10 10 CECE C[C@]1(C(=O)NCc2c(O)cccc2O)C[C@@]1(F)Cl 2062576669 PSMGGXPIHOCUBS-NEPJUHHUSA-N 273.691 2.029 10 10 CECE CC1(C)CCC[C@@H]1C(=O)NCc1c(O)cc(O)cc1O 2063084429 LRBWPMWNWBXYFR-LLVKDONJSA-N 279.336 2.246 10 10 CECE [N-]=[N+]=NCCCN[C@H](C(=O)O)c1ncoc1C(F)(F)F 2167837564 FWUSSFXAQQSVGG-LURJTMIESA-N 293.205 2.109 10 10 CECE Cc1ccc(O)c([C@@H](C)n2cc(C(=O)N(C)C)cn2)c1 2069901388 NBTGNINTTKYWMU-LLVKDONJSA-N 273.336 2.208 10 10 CECE CNCc1cc(C2CC2)nn1Cc1cccc(OC)c1O 2070200544 VRWUJTJYPQTHAE-UHFFFAOYSA-N 287.363 2.242 10 10 CECE COC(=O)c1cn([C@@H](C)c2cc(C)c(C)cc2O)nc1O 2070595937 NHJWOEDQXKRJIS-JTQLQIEISA-N 290.319 2.307 10 10 CECE CCN[C@H](C)c1ccc(N2CCCC[C@H](O)C2)cc1O 2169205197 NRGRBUKJYMLNIO-OCCSQVGLSA-N 278.396 2.414 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])c1cnc(C(C)C)[nH]1 2169530781 CPOKQDOKIWCYDV-SNVBAGLBSA-N 280.332 2.037 10 10 CECE CC[C@@H](O)c1ccc(N2CCn3c(C)nnc3C2)cc1 2170352069 FRRZCFVSOHYHIK-CQSZACIVSA-N 272.352 2.050 10 10 CECE CN(CCc1ccsc1)c1ccc2c(c1)NC(=O)[C@@H]2N 2170307057 FNPBMDWPIRNWDY-CQSZACIVSA-N 287.388 2.379 10 10 CECE C[C@@H](O)c1ccc(N2CCO[C@H](CN(C)C)C2)c(Cl)c1 2170340441 YSUWZZDARZSARJ-DGCLKSJQSA-N 298.814 2.160 10 10 CECE CN(CCc1ccsc1)c1ccc2c(c1)NC(=O)[C@@H]2O 2170302499 NNJADRZKSCWKDU-CQSZACIVSA-N 288.372 2.413 10 10 CECE Cc1cc(N(C)[C@@H]2CCN(C)[C@H](C)C2)ccc1CCN 2170394343 FSPXGKFZMJHVMS-RHSMWYFYSA-N 275.440 2.415 10 10 CECE C[C@H](O)c1ccc(N2C[C@H]3[C@@H](C2)OC(=O)N3C)c(Cl)c1 2176929554 AOUAIPODSZWGSL-AQUOVQTQSA-N 296.754 2.033 10 10 CECE Nc1ccc(CC(=O)OC[C@H]2C[C@@H]3CC[C@H](C2)O3)cc1 2181474634 YPSKPFLFPWXODP-XMQYKBBCSA-N 275.348 2.312 10 10 CECE COc1cccc(O)c1CNC[C@]1(O)C[C@H]2CCC[C@@H]21 2197542501 FFLWOBAWXCUXKU-PVXIVEMSSA-N 277.364 2.042 10 10 CECE O=C(N[C@@H]1C[C@@H]2CCCC[C@@H]21)c1cc(O)c(O)c(O)c1 2188867735 FXJNOPNHAIFMKV-INTQDDNPSA-N 277.320 2.112 10 10 CECE CN[C@@H](C)c1ccc(N2CCC=C[C@H]2COC)cc1O 2182370076 KNJPORPCLLLEHX-JSGCOSHPSA-N 276.380 2.454 10 10 CECE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@]12CCCOC2 2198140934 GYTADMHDXHHQGD-BBRMVZONSA-N 275.348 2.167 10 10 CECE CCN[C@@H]1CCc2cc(N3CCS[C@@H](CO)C3)ccc21 2184723213 KDGRGQYRUUKNNF-GDBMZVCRSA-N 292.448 2.198 10 10 CECE Cc1cn(C)nc1CN(C)c1ccc2c(c1)CC[C@H]2O 2184732142 QOKBLTAHZCVRAV-MRXNPFEDSA-N 271.364 2.345 10 10 CECE CN[C@H]1CCc2cc(N3CC[C@@](F)(COC)C3)ccc21 2184723682 PSSZCHOCBIRTHW-HOTGVXAUSA-N 278.371 2.458 10 10 CECE CCN[C@H]1CCc2cc(N3CC4(CN(C)C4)C3)ccc21 2184727959 SUULLDGOECAVFW-INIZCTEOSA-N 271.408 2.035 10 10 CECE CN[C@H](C)c1cc(F)c(N2CC[C@H](C)[C@@H](O)C2)c(F)c1 2194713025 DNEIGQZFHBYFDU-RBZYPMLTSA-N 284.350 2.452 10 10 CECE COc1cc(NCCOc2ccc(N)cc2)sn1 2044159923 DCKAQXCILHOOBG-UHFFFAOYSA-N 265.338 2.225 10 10 CECE CC(C)[C@H](CN)C[C@H](O)c1ccc(N(C)C)cc1 2044703707 WTBGWZDUJSQYPL-ZFWWWQNUSA-N 250.386 2.407 10 10 CECE CC(C)[C@]1(C)CCN1c1cc2c(cc1N)OCC(=O)N2 2191204880 FXRDYAPVBYLORZ-HNNXBMFYSA-N 275.352 2.225 10 10 CECE CCOC(=O)/C=C/CN(C)Cc1ccc(N(C)C)cc1 2199053772 RAENQTQNQTUILN-VOTSOKGWSA-N 276.380 2.304 10 10 CECE CC(C)[C@H](C(=O)O)[C@@H](O)c1ccc(N(C)C)cc1 2048076177 BZJALILSDOYSPB-STQMWFEESA-N 251.326 2.143 10 10 CECE C[C@@H](O)[C@@H](NCc1ccc2c(c1)CCCO2)C(F)(F)F 2195310953 RMXROBNVXHUSLO-NOZJJQNGSA-N 289.297 2.413 10 10 CECE Oc1ccc([C@H]2NC[C@H](CC(F)(F)F)O2)cc1O 2055506354 XCCQLLBXBWTRBO-XVKPBYJWSA-N 263.215 2.037 10 10 CECE [N-]=[N+]=NCCCCN1CCN[C@@H](CC(F)(F)F)C1 2055952383 RVSJJEWVFOSZHD-VIFPVBQESA-N 265.283 2.303 10 10 CECE Nc1ccc(Oc2cc(C(=O)O)nc(Cl)n2)cc1 2065467424 ATWSISBKBVFIQI-UHFFFAOYSA-N 265.656 2.203 10 10 CECE Cc1cc(N(C)[C@H]2CCOC[C@@H]2F)ccc1CN 2066651521 GEXQHPOEKRAWSJ-KBPBESRZSA-N 252.333 2.017 10 10 CECE C[C@H](N[C@@H]1CC[C@](C)(O)C1)c1cc(F)ccc1O 2066754544 RQCDXQYNELVPRU-PXWWUCIGSA-N 253.317 2.485 10 10 CECE CN1CCCc2cc([C@H](O)[C@@]3(CN)CC3(F)F)ccc21 2196695404 GUOHZVGYTCLPDT-KBPBESRZSA-N 282.334 2.087 10 10 CECE CCOc1cc(CNCc2cccc(O)c2O)ccn1 2187720933 FLFFAROOWLFVLU-UHFFFAOYSA-N 274.320 2.181 10 10 CECE COc1cc2c(cc1OC)N(C[C@H]1C[C@@H]1F)CC2 2068096022 LFHHIFJHRSJMHB-MNOVXSKESA-N 251.301 2.424 10 10 CECE CNCc1ccc(N(C)[C@@H]2CCN3CC[C@H]2C3)cc1C 2192732622 FSLIFCQSPWSEJE-DOTOQJQBSA-N 273.424 2.245 10 10 CECE CCN(c1ccc(OCC(F)F)cc1)C1CNC1 2073886252 PKGNCMKVEHCAIN-UHFFFAOYSA-N 256.296 2.129 10 10 CECE Cc1cc(N2CCN(C)C3(CC3)C2)ccc1C[C@H](C)N 2188423846 BCXKUNHJKLGGTK-AWEZNQCLSA-N 273.424 2.169 10 10 CECE N[C@@H]1CC[C@@]2(CCO2)C[C@@H]1Sc1nccs1 2211181105 VUZYESQYRHIPIS-WCABBAIRSA-N 256.396 2.274 10 10 CECE CCOC(=O)[C@H](NCCN=[N+]=[N-])[C@@H]1CC12CCCC2 2100558617 AJTSLTVBQBKYPP-WDEREUQCSA-N 266.345 2.398 10 10 CECE COc1ccc(N2C[C@@H](N)CC[C@@H]2C)c(F)c1F 2081854333 QQJFNORQFYUSKY-IUCAKERBSA-N 256.296 2.289 10 10 CECE CN[C@@H]1CCCN(c2ccc(OC)c(F)c2F)C1 2081865460 ZYPNQIFHVPPRDA-SECBINFHSA-N 256.296 2.162 10 10 CECE Cc1cc(CN)ccc1N1CCC[C@@]2(C)COC[C@@H]12 2103593754 DHTBZIAAXXMMOW-CVEARBPZSA-N 260.381 2.459 10 10 CECE Oc1cc(F)ccc1CNC[C@]12C[C@H](CCO1)C2 2084173167 RESKGMTUJUBSIL-WJONMLJTSA-N 251.301 2.190 10 10 CECE COc1cccc(O)c1CNCc1ccc(O)cc1 2104433176 BMLIQQCYKNVATH-UHFFFAOYSA-N 259.305 2.396 10 10 CECE CCC12COC(C(=O)N(C)CCCN=[N+]=[N-])(C1)C2 2084439398 JIKIIVNYMBMRIE-UHFFFAOYSA-N 252.318 2.104 10 10 CECE c1cc2c(cc1N(C[C@@H]1CCCN1)C1CC1)CCO2 2106345756 OSFLLZGSTMFVTJ-ZDUSSCGKSA-N 258.365 2.342 10 10 CECE C[C@@H]1CCN(c2ccc3c(c2)COCC3)[C@H](C)[C@H]1N 2106377167 NITCUUHUNVWPEJ-HSMVNMDESA-N 260.381 2.321 10 10 CECE CN[C@H](c1ccc(N(C)C)cc1)[C@H](O)[C@@]1(C)C[C@H]1C 2106859584 KZAMOMZBULGZKY-FWYOQMDTSA-N 262.397 2.420 10 10 CECE CCC1([C@H](O)c2ccc3c(c2)CCCN3C)CNC1 2106826276 RQWPXZFRTMKBGG-OAHLLOKOSA-N 260.381 2.102 10 10 CECE CCOCC[C@H](NN)c1ccc(N2CCCC2)cc1 2106827092 ZPQZJYBDKJAIGA-HNNXBMFYSA-N 263.385 2.218 10 10 CECE COc1ccc(CNC[C@@H](C)c2ncon2)cc1C 2087612603 IQTZXPPJCFINKL-LLVKDONJSA-N 261.325 2.280 10 10 CECE CCN(Cc1ccc(N)cc1)C(=O)N1C[C@H]2C[C@H]2C1 2088824705 BCGGWLUIZNWMPA-BETUJISGSA-N 259.353 2.162 10 10 CECE CNCc1ccc(N2C[C@@]3(C)C[C@]3(CO)C2)c(Cl)c1 2109154623 OESNFVAEMGOSLL-HUUCEWRRSA-N 280.799 2.268 10 10 CECE CC(C)OCC1CN(c2c(F)cc(CO)cc2F)C1 2109580146 CFQDWISNMZBBRF-UHFFFAOYSA-N 271.307 2.318 10 10 CECE C[C@H](N[C@H]1CCC[C@H](C(N)=O)C1)c1ccccc1O 2090010707 PAGBXYMUGOIPQP-SRVKXCTJSA-N 262.353 2.087 10 10 CECE CCNCc1ccc(N2C[C@@H](F)[C@H](OC)C2)c(F)c1 2090288358 PTKBQHNGDBSMRT-TZMCWYRMSA-N 270.323 2.108 10 10 CECE CN(CCc1ccc(N)cc1)Cc1c(Cl)cnn1C 2111851581 AXWWHTFJJJIMLE-UHFFFAOYSA-N 278.787 2.330 10 10 CECE C[C@H]1CCC[C@H]1CS(=O)(=O)NCc1ccc(N)cc1 2093565979 CWEAWAYIOGZGTQ-AAEUAGOBSA-N 282.409 2.124 10 10 CECE CC(C)(C)O[C@H]1CCN(Cc2cc(N)ccc2O)C1 2097666155 QZGXWBFZWDTSMZ-ZDUSSCGKSA-N 264.369 2.364 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cnc(Cl)nc2)CC1 2099328986 IGRIMIBBHNTQQO-SECBINFHSA-N 280.719 2.435 10 10 CECE C[C@H](c1ccc(O)cc1O)N1CCC(C)(CN)CC1 2099835061 BNECFTLXUMDWCN-LLVKDONJSA-N 264.369 2.220 10 10 CECE Cc1cc(CN)ccc1N1CCC12CCN(C)CC2 2114134705 SCGISZWISJZSCQ-UHFFFAOYSA-N 259.397 2.128 10 10 CECE CC[C@@]12CC[C@@](C(=O)NCc3ccc(N)cc3)(CO1)C2 2201818277 FLYNAZZGONQKLY-HOTGVXAUSA-N 274.364 2.234 10 10 CECE Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])o1 2218742182 BZGBJAHGEHIQAL-IUCAKERBSA-N 270.314 2.098 10 10 CECE Cc1cccc(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])c1N 2271363870 ZAMSYJINCSBBAP-SNVBAGLBSA-N 259.313 2.492 10 10 CECE OC[C@@H]1CCCN1c1ccc(CNC2CCC2)cc1 2231461106 NREYUXQHEZAIRZ-INIZCTEOSA-N 260.381 2.290 10 10 CECE Cc1cc([C@@H](C)N)ccc1N1CCC2(CC(O)C2)C1 2232012958 SKDOUZIPDIDXAH-XEBKBJJBSA-N 260.381 2.366 10 10 CECE CCNC(=O)CN(CC)c1ccc([C@H](C)O)cc1C 2232106843 SELNZALCBSHNRD-LBPRGKRZSA-N 264.369 2.011 10 10 CECE C[C@@H](CO)CC1CN(c2ccc(CO)c(Cl)c2)C1 2222853496 UBVPTCUDFPGHRR-SNVBAGLBSA-N 269.772 2.287 10 10 CECE [N-]=[N+]=NCC1(CNC(=O)Cc2sccc2C(=O)O)CC1 2234166993 SGXLWRONMNYAHP-UHFFFAOYSA-N 294.336 2.196 10 10 CECE [N-]=[N+]=NC[C@H]1CCN(C(=O)C[C@H](CC(=O)O)C2CC2)C1 2234171259 KNSGYLLRPAPILI-MWLCHTKSSA-N 280.328 2.036 10 10 CECE Nc1ccc(OCCC(=O)NCCSC(F)F)cc1 2224296432 AMMQZTYQLKCFSB-UHFFFAOYSA-N 290.335 2.110 10 10 CECE C[C@H](c1c(O)cccc1O)N1[C@H]2CCC[C@@H]1CN(C)C2 2234737626 HZEDNLCOIYPJME-UPJWGTAASA-N 276.380 2.327 10 10 CECE CN1C[C@@H]2CCC[C@H](C1)N2c1c(F)cc(CO)cc1F 2234732381 OMOILUPXYOGSDF-TXEJJXNPSA-N 282.334 2.130 10 10 CECE CN(C[C@@H]1OC[C@H]2CCC[C@@H]21)c1ccc(CN)cc1 2225012934 GXFFJBJSBGQKEJ-KBMXLJTQSA-N 260.381 2.397 10 10 CECE COc1ccc(N(C)C2(CO)CCSCC2)cc1OC 2235123516 AJFUAALCKQHTSZ-UHFFFAOYSA-N 297.420 2.398 10 10 CECE Cc1nccc2c1NC[C@@H](Cc1ccc(O)c(O)c1)N2 2235295353 FFGTZSWXOFPNKA-LLVKDONJSA-N 271.320 2.250 10 10 CECE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NS(=O)(=O)C[C@@H]1CC[C@H](F)C1 2225798641 HKAXHDJENBTPMK-YTWAJWBKSA-N 290.364 2.275 10 10 CECE [N-]=[N+]=NCCCCNC(=O)[C@@H]1CCC[C@@H](C(=O)O)C1 2225796609 YRCLMJIVTPXPIT-NXEZZACHSA-N 268.317 2.084 10 10 CECE COc1ccc(N2CC([C@@H]3CC3(F)F)C2)c(C(=O)O)c1 2235948697 UZISOLWCSSCNCO-NSHDSACASA-N 283.274 2.485 10 10 CECE CCNCc1cc(OC)ccc1N1CCO[C@@H](C)[C@H]1C 2235958475 LFLGKBMJGXDXID-OLZOCXBDSA-N 278.396 2.418 10 10 CECE COc1ccc(N2C[C@@H](C)OC(C)(C)C2)c(CCN)c1 2235970450 PYDIHNVQSLIQBM-GFCCVEGCSA-N 278.396 2.200 10 10 CECE COc1ccc(N2CC(C)(C)CC[C@H]2CO)c(CO)c1 2235999316 IACDLKHVMOYGHB-ZDUSSCGKSA-N 279.380 2.175 10 10 CECE COc1ccc(N2CC[C@@H](n3cccc3)C2)c(CO)c1 2236002356 MQWYLJVAPZZHLC-CQSZACIVSA-N 272.348 2.440 10 10 CECE C[C@@H]1CC[C@@H]1C[C@@H](N)[C@H](O)c1ccc2c(c1)CCN2C 2236222919 AMVTUXGBKONYBL-GADXADSLSA-N 274.408 2.476 10 10 CECE CN(CCCOc1ccc(N)cc1)[C@@H]1C[C@H]2CC[C@H]1O2 2236286737 ROSNOJSOPXZXOY-BZUAXINKSA-N 276.380 2.289 10 10 CECE CCNCc1ccc(N2C[C@@H](F)C[C@@H](O)C2)cc1C 2226295697 XASYKUWAXFHTCP-DZGCQCFKSA-N 266.360 2.014 10 10 CECE CC(C)NCc1ccc(N2C[C@@H](O)C[C@H](F)C2)cc1 2226295284 ORCTXQQUJUUGNQ-ZFWWWQNUSA-N 266.360 2.094 10 10 CECE Nc1ccc(CC(=O)N[C@@H]2C[C@H]3CSC[C@H](C3)C2)cc1 2236729750 KHKRIVYUQDOQIU-NHAGDIPZSA-N 290.432 2.459 10 10 CECE C[C@H](O)[C@@H]1CCCN(c2ccc3c(c2)CCN3C)C1 2226806670 CMHGNJIBRLHCTJ-GXTWGEPZSA-N 260.381 2.276 10 10 CECE COc1ccc(N(C)[C@@H]2CO[C@H]3C[C@@H]2C3)c(C=O)c1 2227698172 XXQSYMFDLNZPDC-RIEGTJTDSA-N 261.321 2.121 10 10 CECE CN(C)c1ccc(OCC2(C(=N)NO)CCC2)cc1 2229380448 FQIBEMYWYDBSGO-UHFFFAOYSA-N 263.341 2.258 10 10 CECE COC(=O)[C@](C)(NCCCN=[N+]=[N-])c1scnc1C 2229628505 ZUCYBFIYIMJZGU-LLVKDONJSA-N 283.357 2.130 10 10 CECE CC(C)Oc1ccc(N2C[C@@H]3CCO[C@@]3(CO)C2)cc1 2239845339 WSIIIDBJGBGVDM-XJKSGUPXSA-N 277.364 2.061 10 10 CECE OC[C@@H]1CN(c2ccc(CNC3CCC3)cc2)C[C@H]1F 2240008735 AMQBCARFIKSWJM-XJKSGUPXSA-N 278.371 2.095 10 10 CECE Cc1cc([C@H](C)O)ccc1N1CCO[C@@]2(CCOC2)C1 2240841698 KKPZXOXDGUZEKC-BBRMVZONSA-N 277.364 2.044 10 10 CECE CCNC(=O)[C@@H]1CCCN1c1ccc([C@H](C)N)cc1C 2240846460 MLINGPNHQGBIGS-WFASDCNBSA-N 275.396 2.120 10 10 CECE Oc1cccc(Br)c1CN[C@]12COC[C@H](C1)C2 2250899970 NXTGYRXLBFBXDE-GMZHKTEUSA-N 298.180 2.423 10 10 CECE CC(C)(C)OC(=O)N(CC(=O)NCCN=[N+]=[N-])C1CCC1 2242082404 PZIVKLDIHPWLRL-UHFFFAOYSA-N 297.359 2.203 10 10 CECE CSc1ncc(CN[C@@H]2CC[C@@]23CCCNC3)s1 2257095525 BEHDCYAHZNIIHB-DGCLKSJQSA-N 283.466 2.487 10 10 CECE CNCc1ccc(N(C[C@@H](C)O)C(C)(C)C)cc1 2259764650 WYWBSNPXALJLSS-GFCCVEGCSA-N 250.386 2.392 10 10 CECE COC(=O)NC[C@@H](C)N[C@@H](C)c1cc(C)ccc1O 2270616039 HKFJNFXQBLYONX-MNOVXSKESA-N 266.341 2.096 10 10 CECE CNCC(C)(C)N(C)Cc1ccc2c(c1)CCN2C 2273281724 VENYVGUKWKCJKG-UHFFFAOYSA-N 261.413 2.109 10 10 CECE Oc1cc(F)ccc1CN1CCC[C@H]2CCNC[C@H]21 2274501000 SYUFYHPPCXLDFB-SMDDNHRTSA-N 264.344 2.105 10 10 CECE C[C@@H](c1ccccc1O)N1CC[C@@](CF)(C(=O)O)C1 2266502438 DHSGRNZJIKMXJA-HZMBPMFUSA-N 267.300 2.199 10 10 CECE Cc1cccc(CN2C[C@H](S(C)(=O)=O)CC[C@H]2C)c1O 2279354515 PVAQNSHNYUNZNE-TZMCWYRMSA-N 297.420 2.098 10 10 CECE Cc1ccc(N(C)Cc2ccccc2O)c(C(=O)O)n1 2279602376 OSWUBHKJPLLWBU-UHFFFAOYSA-N 272.304 2.430 10 10 CECE CCN1C[C@H]2C[C@H]1CN2c1ccc([C@H](C)N)c(C)c1 2269670311 WNWDAKSZJYVEOG-AEGPPILISA-N 259.397 2.298 10 10 CECE Cc1nnc(CN(C)c2ccc([C@@H](C)N)c(C)c2)o1 2269659281 VAPBJRFCZWYOPW-SNVBAGLBSA-N 260.341 2.343 10 10 CECE COc1ccc(N2CC[C@H](C3CNC3)C2)c2c1CCC2 2284595096 ZPYQNWDDGCWTSB-LBPRGKRZSA-N 272.392 2.230 10 10 CECE COC[C@]1(C)COCCN1c1ccc([C@@H](C)O)c(C)c1 2285161016 ABYJPQSATCZIOX-CZUORRHYSA-N 279.380 2.290 10 10 CECE Cc1cc(N(C)[C@@H](C)CCS(C)(=O)=O)ccc1[C@H](C)N 2285143314 GPMSWZWTNPKOEA-STQMWFEESA-N 298.452 2.274 10 10 CECE CN[C@@H](C)c1ccc(N2CCO[C@@H](COC)C2)cc1C 2285140187 PUHFDFYYNZDZQX-DZGCQCFKSA-N 278.396 2.127 10 10 CECE CCCN(c1ccc([C@H](C)N)c(C)c1)[C@@H]1CCNC1=O 2285120570 HQDVNQBTPDYCQO-SWLSCSKDSA-N 275.396 2.120 10 10 CECE FCOc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CNC[C@@H]32)cc1 2295961340 OTEZDVCZJAZUMU-MEYUZBJRSA-N 276.355 2.427 10 10 CECE OC[C@]12CCO[C@H]1CN(c1ccc3c(c1)CCCC3)C2 2296356465 RYXCCNUMZAELCV-DLBZAZTESA-N 273.376 2.153 10 10 CECE COc1cc(OC)c(N(C)[C@H]2CCC[C@H]2O)cc1OC 2289448902 VSOMGNMENKZLAL-CMPLNLGQSA-N 281.352 2.062 10 10 CECE CO[C@H](CNC(=O)C=Cc1ccc(O)c(O)c1)C(C)(C)C 2307990019 UQEXMKMOXKPIBM-CQSZACIVSA-N 293.363 2.288 10 10 CECE CC(C)[C@@H](O)C(C)(C)NCc1cccc(F)c1O 2318071288 CPSAEOLORYWYIP-CYBMUJFWSA-N 255.333 2.416 10 10 CECE Cc1ccc(CN2CCC[C@H](N)C2)c(O)c1Br 2307428557 GSKGEIRYBFSUMU-NSHDSACASA-N 299.212 2.386 10 10 CECE CN[C@H](C)c1ccc(N(C)C[C@H](C)O)c(C)c1C 2318386481 AIOJWIJQSNWUDC-GXFFZTMASA-N 250.386 2.401 10 10 CECE C[C@H](NC(=O)[C@H]1CC[C@H](C2CC2)N1)c1ccccc1O 870988495 QRXBUGPRYXNQGP-ZLKJLUDKSA-N 274.364 2.100 10 10 CECE CCN1N=C(C)C(=Cc2ccc(C(=O)OC)cc2)C1=O 2332134928 ZWNVZQULNGKTIP-UHFFFAOYSA-N 272.304 2.095 10 10 CECE C[C@@H](N[C@@H]1C[C@@H]2OCCC[C@@H]21)c1cc(O)ccc1O 2328821470 DEIQCEZVTDMTAC-YYWQGFNFSA-N 263.337 2.316 10 10 CECE CN(C[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(CN)c(F)c1 2329967119 FBBRTQQSBDAFOJ-LNSITVRQSA-N 264.344 2.288 10 10 CECE C[C@@H](NC[C@H]1[C@@H]2CCOC[C@@H]21)c1ccc(O)cc1O 2331250039 RUELQADYJHUWFX-HYNSBDGHSA-N 263.337 2.031 10 10 CECE 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C[C@H](O)[C@H](Nc1c(N)cccc1F)C(F)(F)F 2019070121 HQMZAAKADAOIDU-CDUCUWFYSA-N 252.211 2.132 10 10 CECE Nc1ccc(OCCSc2ncnc3nc[nH]c23)cc1 51035902 DCDLRXFRHJLMFR-UHFFFAOYSA-N 287.348 2.106 10 10 CECE Oc1cccc(Cl)c1CN1CC[C@H]2COC[C@H]21 2021429219 JHUYTUDHGKDEEG-JOYOIKCWSA-N 253.729 2.266 10 10 CECE CCN[C@H](C)c1ccc(N2C[C@H]3C[C@@H](C2)N(C)C3)cc1 2160689476 FMEGSAROLJEFLA-KEYYUXOJSA-N 273.424 2.497 10 10 CECE OC[C@H](Cc1ccccc1)NCc1ccc(F)cc1O 294480765 AMWDOSRFPYRITJ-HNNXBMFYSA-N 275.323 2.225 10 10 CECE C[C@H]1C[C@@H]([C@@H](NN)c2ccccc2O)C[C@@H](C)O1 2029550048 PEZGTOCFMHSQCA-YAMSLAJTSA-N 250.342 2.100 10 10 CECE Nc1ccc(CC(=O)OC[C@H]2CC[C@@H](F)C2)cc1 2032948887 QMORQSXRAIIXEC-NWDGAFQWSA-N 251.301 2.493 10 10 CECE C[C@H]1CC[C@@H](CNCc2cccc(F)c2O)N1C 2034198634 MQJUDIVRKQBQOS-JQWIXIFHSA-N 252.333 2.104 10 10 CECE Oc1ccc(Cl)cc1CN1CC2(CCNCC2)C1 2035092097 QBQCJHRIRMKKPA-UHFFFAOYSA-N 266.772 2.231 10 10 CECE CC[C@@H]1CCOC[C@H]1NCc1cc(F)ccc1O 2035123292 PXXZQTPMKMDCNP-ZWNOBZJWSA-N 253.317 2.436 10 10 CECE CNCc1ccc(N2CCC23CC(CN(C)C)C3)cc1 2160892164 RJYNZEZJNASTAN-UHFFFAOYSA-N 273.424 2.327 10 10 CECE C[C@@]1(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)CCCO1 2038001490 CFMDWXDFJXENIK-PWSUYJOCSA-N 252.318 2.247 10 10 CECE CN[C@H](C)c1ccc(N2CCCN(C)C[C@H]2C)cc1 300553084 WOVMFRCEQGBRAL-ZIAGYGMSSA-N 261.413 2.497 10 10 CECE Cc1ccc(O)c([C@H](C)NC[C@@H]2CO[C@@H]3COC[C@@H]32)c1 2158029336 FPPGULYVEMIXGL-KLZCAUPSSA-N 277.364 2.013 10 10 CECE CN1[C@H]2CC[C@@H]1C[C@@H](CNCc1c(O)cccc1F)C2 2160781909 KQTJQQMTCIJVJZ-XYYAHUGASA-N 278.371 2.494 10 10 CECE CC(C)NCc1ccc(N(C)[C@@H]2CN3CC[C@H]2C3)cc1 2158734843 OJIMBHRZSFTTJH-DOTOQJQBSA-N 273.424 2.325 10 10 CECE CNCc1ccc(N2CC[C@H]2c2noc(C)n2)c(F)c1 2160457855 CSZNKFYHTOOFHT-ZDUSSCGKSA-N 276.315 2.188 10 10 CECE C[C@H](NC[C@@]12COC[C@H]1C2(F)F)c1ccc(F)cc1O 2161877745 UOYLOSZFABKXTC-ZEGGKSINSA-N 287.281 2.464 10 10 CECE Cc1cc(C)n(CCC(=O)N2CCC[C@@H]2CN=[N+]=[N-])n1 701291648 PTFPEQRMMMMNDV-GFCCVEGCSA-N 276.344 2.191 10 10 CECE 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277.364 2.138 10 10 CECE Nc1ccc(N2CCN(C[C@H]3CC34CC4)CC2)cc1 722624678 TXSCDBFIKGYIFO-CYBMUJFWSA-N 257.381 2.191 10 10 CECE COc1ccc2c(c1)CCN2C[C@@H](N)CC(F)F 903872510 FXUHBODTYBRNNO-JTQLQIEISA-N 256.296 2.040 10 10 CECE CN(C)c1ccc(/C=C/CNCCCc2cnn(C)n2)cc1 835052695 IWDVIOBTRDEBAB-GQCTYLIASA-N 299.422 2.117 10 10 CECE COc1cccc([C@H](C)N[C@@H]2CCCOC2)c1O 846144423 JECYXKNDOWDSTN-WDEREUQCSA-N 251.326 2.230 10 10 CECE CCN(CC)c1ccc(CN[C@H](C)[C@@H](C)N)cc1F 841077040 XBRVJCXYOSSZTQ-VXGBXAGGSA-N 267.392 2.497 10 10 CECE C[C@H](NC(=O)[C@H]1C[C@@H]1C(F)F)c1ccccc1O 827964248 JFOAZNLJRNRVOS-HGNGGELXSA-N 255.264 2.471 10 10 CECE Cc1ccc(O)c(CNCCc2cncc(C)n2)c1 850390581 KDQSMXCMSFQICC-UHFFFAOYSA-N 257.337 2.131 10 10 CECE c1cc2c(cc1CN[C@@H]1CCOC13CCOCC3)CCO2 924900484 NTYMBEDCZVBKPG-MRXNPFEDSA-N 289.375 2.049 10 10 CECE C[C@@H]1[C@H](NCc2c(O)ccc(Cl)c2F)CCN1C 922556533 DMWAQTVLYYERDE-LDYMZIIASA-N 272.751 2.367 10 10 CECE COc1cc(O)c(CN[C@@H]2CO[C@H](C3CC3)C2)cc1OC 862529180 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CNCc1ccc(N(C)CCOCC2CC2)c(F)c1 94990886 LFBMPJHPRAPVES-UHFFFAOYSA-N 266.360 2.408 10 10 CECE Oc1cccc(F)c1CNC(=S)NCC1CCC1 1332040124 UZOQABVCVZVLLK-UHFFFAOYSA-N 268.357 2.296 10 10 CECE C[C@H](N)c1nc(C(=O)N[C@H](C)c2ccccc2O)cs1 1342306088 FGOMQJNYMMQMPH-DTWKUNHWSA-N 291.376 2.359 10 10 CECE CC[C@H]1CC(=O)N(CCOc2ccc(N)cc2)[C@H]1C 2115287025 HFDVAEHNHQWVKW-RYUDHWBXSA-N 262.353 2.295 10 10 CECE C[C@H](N)[C@@H]1C[C@@H]1[C@H](O)c1ccc(N2CCCC2)cc1 2118314112 IRXVJSFMHCYUGS-VCOSZWKGSA-N 260.381 2.304 10 10 CECE Cc1cnc(NCCOc2ccc(N)cc2)c(N)c1 2117200516 TUDILSJHWSEADW-UHFFFAOYSA-N 258.325 2.045 10 10 CECE C[C@]1(C(F)F)CCN(C(=O)c2cccc(O)c2O)C1 2117961399 QVWOUFJFAVXPTC-ZDUSSCGKSA-N 271.263 2.215 10 10 CECE CC1=C[C@@](O)([C@H](N)c2ccc3c(c2)CCN3C)CC1 2119411376 LLCOTSYTWSEKCO-HZPDHXFCSA-N 258.365 2.150 10 10 CECE CCOc1cc(CNC)ccc1N1CCC[C@H](C(=O)O)C1 212706395 SCGDRSZVQVZVKW-ZDUSSCGKSA-N 292.379 2.106 10 10 CECE Oc1cccc(Cl)c1CN1CCC(C2CNC2)CC1 2120413221 XRRBHIDUJVOGKW-UHFFFAOYSA-N 280.799 2.477 10 10 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10 10 CECE C[C@@H]1C[C@@H](CO)CN1c1ccc(CO)cc1C(F)(F)F 2156548564 CQNXXXINFQUVQZ-MWLCHTKSSA-N 289.297 2.405 10 10 CECE CN1CCN(Cc2ccc(F)cc2O)C(C)(C)C1 295289789 JDKXQGDQUPHBGL-UHFFFAOYSA-N 252.333 2.057 10 10 CECE C[C@@H](c1ccc(F)cc1O)N1CCC[C@H](N)CC1 2027960070 RURNQQYDTMVVGR-JQWIXIFHSA-N 252.333 2.406 10 10 CECE C[C@H](N[C@@H]1CC[C@@H](CO)C1)c1cc(F)ccc1O 2029536070 PAULLJUNIYTUPK-HOSYDEDBSA-N 253.317 2.343 10 10 CECE Cn1ccnc1CCNCc1ccc(Cl)cc1O 2029656528 IWHNMVUIKOUHGE-UHFFFAOYSA-N 265.744 2.111 10 10 CECE CCOC(=O)[C@@]1(NCCCN=[N+]=[N-])C[C@H]2C[C@H]1C[C@@H]2F 2157637180 XBUQAZUEWAIXRR-MPPDQPJWSA-N 284.335 2.346 10 10 CECE [N-]=[N+]=N[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2C(F)(F)F)C1 2039125643 NGCVHLZFZSSSDP-CSMHCCOUSA-N 262.235 2.486 10 10 CECE C[C@H](N)c1ccc(N2C[C@H](C)C[C@@H](O)C2)c(F)c1 401452749 AZCWDMPHDJBGKE-JFGNBEQYSA-N 252.333 2.053 10 10 CECE COC1(CO)CCN(c2ccc([C@H](C)N)cc2Cl)CC1 403012903 IIRBNRXBPNWRJJ-NSHDSACASA-N 298.814 2.337 10 10 CECE C[C@H](c1cc(F)ccc1O)N1CC[C@@](C)(CN)C1 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C[C@H](c1ccccc1O)N(C)S(=O)(=O)CC(F)(F)F 695102720 WVYXIAIBVRTUNC-MRVPVSSYSA-N 297.298 2.277 10 10 CECE CC[C@H]1CN(c2ccc(CNC(C)C)cc2)C[C@@H]1O 399981294 XVRFPCGGLXLTLR-HOCLYGCPSA-N 262.397 2.392 10 10 CECE CN1CCC[C@H]1CNCc1ccc2c(c1)CCCO2 921594970 YACXRVDLMIYANG-HNNXBMFYSA-N 260.381 2.195 10 10 CECE Cc1ccc(O)c([C@H](C)n2nccc2C(=O)NC2CC2)c1 2069940329 RZSFYWISNXBNEF-NSHDSACASA-N 285.347 2.399 10 10 CECE NCc1cc(F)c(N2C[C@H](O)C3(CCCC3)C2)c(F)c1 2174377186 RFEOAIMFGFHPMF-ZDUSSCGKSA-N 282.334 2.165 10 10 CECE CN(c1ccc(CN)cc1Cl)[C@@H]1CO[C@@]2(CCOC2)C1 2179025027 AWHVCJDNFWYRPI-WFASDCNBSA-N 296.798 2.183 10 10 CECE CCNCc1cc(F)c(N2CC[C@@H]3[C@H](O)C[C@H]32)c(F)c1 2178173419 PWAVCIDSLKWASM-ZLKJLUDKSA-N 282.334 2.034 10 10 CECE CC(C)N1C[C@H]2C[C@H]1CN2c1ccc(CN)c(F)c1F 2187589204 WIUMWDZAKYJMJZ-NWDGAFQWSA-N 281.350 2.095 10 10 CECE C[C@@H](O)c1ccc(N(C)[C@H](C)c2ccccc2O)nn1 2192591261 FSBJSXGOGHMOIZ-GHMZBOCLSA-N 273.336 2.433 10 10 CECE CC(C)[C@]1(C(=O)N[C@@H](C)c2ccccc2O)CCNC1 2192623729 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C[C@H](NC[C@H]1OCC[C@@H]1F)c1cc(F)ccc1O 2058669544 UMXCCOJDQCPJID-LJUAHTATSA-N 257.280 2.309 10 10 CECE CCN(CC)C(=O)CCN1CCC[C@@H]1CN=[N+]=[N-] 2059058754 JEPAWQYDEBIQDA-LLVKDONJSA-N 253.350 2.020 10 10 CECE C[C@H]1CCC[C@@](CO)(NC(=O)Nc2ccc(N)cc2)C1 2191502677 FTNVWPRLPZPRTD-XHDPSFHLSA-N 277.368 2.332 10 10 CECE C[C@H](C1CC1)N(C)c1ccc(CO)c([N+](=O)[O-])c1 2068310918 NRYNIIYDYIIUFO-SECBINFHSA-N 250.298 2.322 10 10 CECE C[C@]1(CNCc2cccc(O)c2O)CCCOC1 2069673259 OXYFPHLLPNNJRR-CQSZACIVSA-N 251.326 2.004 10 10 CECE COc1ccc(N2C[C@H](CN)[C@@H](C)C2)c(F)c1F 2081859225 GELKBGHZGOJRLD-IUCAKERBSA-N 256.296 2.004 10 10 CECE COc1ccc(N2CCC(CN)CC2)c(F)c1F 2081861322 HPMXXCJLHMPBTM-UHFFFAOYSA-N 256.296 2.149 10 10 CECE C[C@H]1CNC[C@@H](C)CN1[C@H](C)c1ccc(O)cc1O 2102878623 SRILEFRNABSWQH-GRYCIOLGSA-N 264.369 2.089 10 10 CECE CN(C)c1ccc(CNC(=O)c2cc(N)cs2)cc1 2104184604 GLILNTDPDLZDEU-UHFFFAOYSA-N 275.377 2.326 10 10 CECE CC[C@@H](CN(C)c1ccc(CN)c(OC)c1)OC 2084017874 UJCXBAFGTQPQRN-ZDUSSCGKSA-N 252.358 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