0 B24R2.75420 CC(C)CCOc1ccc(cc1C=O)c2ccc(cc2)C(=O)O da69171f39585c44ff4ad8011f6c6650 [0,0,0,0,0,0|3,0,1]=4 1 B24R2.75420 COc1cc(ccc1OCCC(C)C)c2ccc(cc2)C(=O)O 7ffe4308946d4795edef101bda3628a7 [0,0,0,0,0,0|4,0,0]=4 2 B23R2.8156 CC(C)CCOc1ccc(cc1C=O)c2ccc(cn2)C=O af47cce1c4374c21b351d7056a2a80b2 [1,0,0,0,0,0|2,0,1]=4 3 B23R2.152398 CC(=O)c1cnc(nc1)c2ccc(c(c2)F)OCCN(C)C 3d52f993242f0ae17787ea4816e9e5ec [1,0,0,0,0,0|3,0,0]=4 4 B23R2.152398 CC(C)CCOc1ccc(cc1F)c2ccc(cc2)C(=O)O 7de74e684d5be4e78a049d55ec6d990c [1,0,0,0,0,0|3,0,0]=4 5 B23R2.152398 CN(C)CCOc1ccc(cc1F)c2ccc(cn2)C(=O)O a669158eedd7d8497f0d7acbadf33264 [1,0,0,0,0,0|3,0,0]=4 6 B23R2.152398 CN(C)CCOc1ccc(cc1F)c2ncc(cn2)C(=O)N eaf4b9edb628270603eab4f9447591ed [1,0,0,0,0,0|3,0,0]=4 7 B23R2.152398 CN(C)CCOc1ccc(cc1F)c2ncc(cn2)C(=O)O a647852b303a075b6f784588fdb30427 [1,0,0,0,0,0|2,0,0]=3 8 B23R2.152398 Cc1cc(ccc1OCCC(C)C)c2ccc(cc2)C(=O)O cd1e755773f92e50fa7410dc239c8dc5 [1,0,0,0,0,0|2,0,1]=4 9 B23R2.502976 CCCCOc1ccc(cc1C#N)c2ccc(cc2)C(=O)C 28fcf4a8a60f0a197a11797cb4df05cf [1,0,0,0,0,0|3,0,0]=4 10 B23R2.502976 CCCCOc1ccc(cc1C#N)c2ccc(cc2)C(=O)N 223e58bb78eda9874598774a0df16cfd [1,0,0,0,0,0|3,0,0]=4 11 B23R2.502976 CCCCOc1ccc(cc1C#N)c2ccc(cc2)C(=O)O 4184357a520ffbf3b0fdbe6a263f321e [1,0,0,0,0,0|2,0,0]=3 12 B23R2.502976 CCCCOc1ccc(cc1C#N)c2ccc(nc2)C(=O)O 11397960b5473d1bedce06277fe1937c [1,0,0,0,0,0|3,0,0]=4 13 B23R2.502976 CCCCOc1ccc(cc1C=O)c2ccc(cn2)C(=O)O 7f2e0c034266000cc0b6cb6bb9a832ab [1,0,0,0,0,0|2,0,1]=4 14 B23R2.502976 CCCCOc1ccc(cc1C=O)c2ncc(cn2)C(=O)C 25ce8868408879a81d1a4928d17ec74f [1,0,0,0,0,0|2,0,1]=4 15 B23R2.502976 CCCCOc1ccc(cc1C=O)c2ncc(cn2)C(=O)N b02b6c4108475d4f0e3853c1cf2bb273 [1,0,0,0,0,0|2,0,1]=4 16 B23R2.502976 CCCCOc1ccc(cc1C=O)c2ncc(cn2)C(=O)O 670226c1860224464400fe0b7d32607c [1,0,0,0,0,0|1,0,1]=3 17 B23R2.502976 COCCOc1ccc(cc1C#N)c2ccc(cc2)C(=O)O cc252e9b526a4b857969b5981f5de5ef [1,0,0,0,0,0|3,0,0]=4 18 B23R2.502976 COCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)C bdb72eb304c37ece6800b9666880311a [1,0,0,0,0,0|3,0,0]=4 19 B23R2.502976 COCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)N 2f4046da8302988a3b6f5c869019374d [1,0,0,0,0,0|3,0,0]=4 20 B23R2.502976 COCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)O d1f20e12d4600d3888ae00cf299d7a6e [1,0,0,0,0,0|2,0,0]=3 21 B23R2.502976 COCCOc1ccc(cc1C#N)c2ccc(nn2)C(=O)O 0eb3ca0bc22d2ca0b90f47e40455820a [1,0,0,0,0,0|3,0,0]=4 22 B23R2.502976 COCCOc1ccc(cc1C#N)c2cnc(cn2)C(=O)O dee7b628ba9f164128486a22c20320a2 [1,0,0,0,0,0|3,0,0]=4 23 B23R2.502976 COCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)C 01d268a49397df6e7d90bf35beb48bfb [1,0,0,0,0,0|2,0,0]=3 24 B23R2.502976 COCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)N 85a01719bbc9d941e826fa16afa13377 [1,0,0,0,0,0|2,0,0]=3 25 B23R2.502976 COCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)O 85c53b7194bf4417f8d6ea341e150ec5 [1,0,0,0,0,0|1,0,0]=2 26 B23R2.502976 COCCOc1ccc(cc1C#N)c2ncc(cn2)C(C)O b255fa5d27e6badd3fae76a00d2372aa [1,0,0,0,0,0|2,0,1]=4 27 B23R2.502976 COCCOc1ccc(cc1C#N)c2ncc(cn2)[N+](=O)[O-] 5d928a525af2e72565b45de7cc7b52a7 [1,0,0,0,0,0|2,0,1]=4 28 B23R2.502976 COCCOc1ccc(cc1OC)c2ncc(cn2)C(=O)O 25a4a12057afb29f9192b2daf15c43cd [1,0,0,0,0,0|3,0,0]=4 29 B23R2.66651 C=C(C)c1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C f59bd52581a79f832010b444add9c53e [0,0,0,0,1,0|3,0,0]=4 30 B23R2.66651 CC(=O)c1ccc(cc1)c2ccc(c(c2)C#N)OCC(C)C c2fab7d76f7b12682aaf2900830cc98d [0,0,0,0,1,0|3,0,0]=4 31 B23R2.66651 CC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C e38b2c828fdc1b9381b314647490caeb [0,0,0,0,1,0|2,0,0]=3 32 B23R2.66651 CC(=O)c1ccc(nn1)c2ccc(c(c2)C#N)OCC(C)C 849d9d93c609017b711b899aee997ab2 [0,0,0,0,1,0|3,0,0]=4 33 B23R2.66651 CC(=O)c1cnc(cn1)c2ccc(c(c2)C#N)OCC(C)C 54a0254cba284a8d9203e6fb7168a99d [0,0,0,0,1,0|3,0,0]=4 34 B23R2.66651 CC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C 3a36d68c81fcc80bf4ad854858ebf9c7 [0,0,0,0,1,0|1,0,0]=2 35 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)F 5d603772e5f806b0170f4efc05caccff [0,0,0,0,1,0|3,0,0]=4 36 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)N 85d2ade71080c08e6c9ca66542d2e493 [0,0,0,0,1,0|3,0,0]=4 37 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)O ea94fc1fdbc388b4bc99f5018663c2d3 [0,0,0,0,1,0|2,0,0]=3 38 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)S(=O)O 2ceebfcc11d857d61735ccea45a290ea [0,0,0,0,1,0|3,0,0]=4 39 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)N 3e966f96b3bcaf74bff957275c0d0ab2 [0,0,0,0,1,0|2,0,0]=3 40 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)O 818f3f45607d63a00f4cd4dec3c85573 [0,0,0,0,1,0|1,0,0]=2 41 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=S)N 836d8b171080499e94d065738a9d071f [0,0,0,0,1,0|2,1,0]=4 42 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(C)O 107f293146d21f00a83078288079b883 [0,0,0,0,1,0|2,0,1]=4 43 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)S(=O)C bfeee026387a300b82ea074f4ca1dd3f [0,0,0,0,1,0|3,0,0]=4 44 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)[C@@H](C)O 3b37b8e08d9f769f75ab42ff4b712aa2 [0,0,0,0,1,0|2,0,1]=4 45 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)[C@H](C)O 9022071ceae98e642b988198bd38af00 [0,0,0,0,1,0|2,0,1]=4 46 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)[N+](=O)[O-] a627f8f6e19028f1c8f212d2e95d1412 [0,0,0,0,1,0|2,0,1]=4 47 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(nc2)C(=O)O 1a18acf97ba35d651d1499e195af34f4 [0,0,0,0,1,0|3,0,0]=4 48 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(nn2)C(=O)N 01a5e8cfd759ba56f09927b0e12221f7 [0,0,0,0,1,0|3,0,0]=4 49 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(nn2)C(=O)O 4ca4623fe6066de41cc115f89d83b18f [0,0,0,0,1,0|2,0,0]=3 50 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2cnc(cn2)C(=O)N f3018aa586a4cb7c07cc0d988b82e2b7 [0,0,0,0,1,0|3,0,0]=4 51 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2cnc(cn2)C(=O)O 2e23f7879214b904a5ffb844b570b164 [0,0,0,0,1,0|2,0,0]=3 52 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(=O)N d919ca4f398968f5b4adeffb48c412d2 [0,0,0,0,1,0|1,0,0]=2 53 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(=O)O 6ebfabf29091c007ffcb012dc33360ca [0,0,0,0,1,0|0,0,0]=1 54 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(C)C 02f72ef38aa8fa2638244613af9e9e5b [0,0,0,0,1,0|2,0,1]=4 55 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(C)O 3cca78e6fb65da4b6526fdd75e33ecf6 [0,0,0,0,1,0|1,0,1]=3 56 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(F)F 6b44b1508e1076913a94ec14e27d894d [0,0,0,0,1,0|2,0,1]=4 57 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)N(C)C adf8e1be04a073d0096c66bc9e89b8aa [0,0,0,0,1,0|3,0,0]=4 58 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)[C@@H](C)N b48caa68b7ad288129839ce9c8e3186c [0,0,0,0,1,0|2,0,1]=4 59 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)[N+](=O)[O-] ee2f16d26421b8ad535043b1d0800302 [0,0,0,0,1,0|1,0,1]=3 60 B23R2.13966726 CC(C)CCOc1ccc(cc1C=O)c2cc(co2)C(=O)O 74adc5f20946219b1f99b5ff5358cd43 [0,0,0,0,1,0|2,0,1]=4 61 B23R2.13966726 CC(C)CCOc1ccc(cc1C=O)c2cc(cs2)C(=O)O f5c2c1d97fd274cf67d55100cbf91311 [0,0,0,0,1,0|2,0,1]=4 62 B25R2.4721963 CC(=O)c1cnc(nc1)Nc2ccc(c(c2)C=O)OCCC(C)C 3f015f3bd86d5231f12b1b965914e376 [0,0,0,0,0,1|2,0,1]=4 63 B25R2.4721963 CC(C)CCOc1ccc(cc1C=O)Nc2ccc(cn2)C(=O)O 454f29973cb07a04b6b59f310946822a [0,0,0,0,0,1|2,0,1]=4 64 B25R2.4721963 CC(C)CCOc1ccc(cc1C=O)Nc2ncc(cn2)C(=O)O bcd4db22666aacdfd59ab62c6ebde43e [0,0,0,0,0,1|1,0,1]=3 65 B22R2.7462 CN(C)CCOc1ccc(cc1F)c2ncc(cn2)C=O 4f8ceb904a98476d1b62e636d944e9d0 [2,0,0,0,0,0|2,0,0]=4 66 B22R2.7462 Cc1cc(ccc1OCCC(C)C)c2ccc(cn2)C=O d82200e145c600890521b9d7adf9933b [2,0,0,0,0,0|1,0,1]=4 67 B22R2.376000 C=Cc1cnc(nc1)c2ccc(c(c2)C#N)OCCOC 8c16882429b9f26c952a32d6b824ab81 [2,0,0,0,0,0|2,0,0]=4 68 B22R2.376000 CCCCOc1ccc(cc1C#N)c2ccc(cc2)C=O f3ba1ecea43280b1a2b1609af7ea6fd9 [2,0,0,0,0,0|2,0,0]=4 69 B22R2.376000 CCCCOc1ccc(cc1C#N)c2ccc(cn2)C=O e2e0deaf3a774071ce3f2ac96f896b22 [2,0,0,0,0,0|1,0,0]=3 70 B22R2.376000 CCCCOc1ccc(cc1C=O)c2ncc(cn2)C=O 0fe6a3090f0ec5c4b44203187224fb71 [2,0,0,0,0,0|1,0,1]=4 71 B22R2.376000 COCCOc1ccc(cc1C#N)c2ccc(cn2)C=O 41b01f7c0236bffb3fac1fb2964a9e0f [2,0,0,0,0,0|2,0,0]=4 72 B22R2.376000 COCCOc1ccc(cc1C#N)c2ncc(cn2)C=O d7f030f744866b0bd585872b80b0634d [2,0,0,0,0,0|1,0,0]=3 73 B22R2.376000 COCCOc1ccc(cc1C#N)c2ncc(cn2)CO bd4c6b0dc212d3ca0693cb3b817bef24 [2,0,0,0,0,0|1,0,1]=4 74 B22R2.15089 CC(=O)c1ccc(nc1)c2ccc(cc2)OCCC(C)C 53132ca4e28078f498eedfaa244fe59c [2,0,0,0,0,0|2,0,0]=4 75 B22R2.15089 CC(=O)c1cnc(nc1)c2ccc(cc2)OCCC(C)C 19011a852152d5b4559e47e61dbaf1df [2,0,0,0,0,0|1,0,0]=3 76 B22R2.15089 CC(=O)c1cnc(nc1)c2ccc(cc2)OCCN(C)C 05a1e74e166566c950f57cd04eb4f0d2 [2,0,0,0,0,0|2,0,0]=4 77 B22R2.15089 CC(=O)c1cnc(nc1)c2ccc(cc2)SCCC(C)C 03ccecc9eaf2a99faf5718b04bc42dd8 [2,0,0,0,0,0|1,1,0]=4 78 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ccc(cc2)C(=O)O 245b01686bdc35583a70e8012c9c76bc [2,0,0,0,0,0|2,0,0]=4 79 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ccc(cn2)C(=O)N 928d6a787f9aab1de8083ae3b8aed154 [2,0,0,0,0,0|2,0,0]=4 80 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ccc(cn2)C(=O)O c8adbcf3bd86fb78acd92cd1a6526649 [2,0,0,0,0,0|1,0,0]=3 81 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ccc(nn2)C(=O)O 68da80da8f328e757896b5e64a327129 [2,0,0,0,0,0|2,0,0]=4 82 B22R2.15089 CC(C)CCOc1ccc(cc1)c2cnc(cn2)C(=O)O 2f131d6f203f1a8491faef9861fbf072 [2,0,0,0,0,0|2,0,0]=4 83 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ncc(cn2)C(=O)N 1f055e90a46b73e423951d849405a919 [2,0,0,0,0,0|1,0,0]=3 84 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ncc(cn2)C(=O)O b8761948a65e10582d4c36bde55a0239 [2,0,0,0,0,0|0,0,0]=2 85 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ncc(cn2)C(C)O 11ec1ca354370adfa136aaa6b1bdac67 [2,0,0,0,0,0|1,0,1]=4 86 B22R2.15089 CC(C)CCOc1ccc(cc1)c2ncc(cn2)[N+](=O)[O-] c64b4c009b82a8073d593baa0043acc7 [2,0,0,0,0,0|1,0,1]=4 87 B22R2.15089 CC(C)CCSc1ccc(cc1)c2ccc(cn2)C(=O)O 7007d373dca2c9b77f0bd83ffe834c9d [2,0,0,0,0,0|1,1,0]=4 88 B22R2.15089 CC(C)CCSc1ccc(cc1)c2ncc(cn2)C(=O)O 4d9191d6435af81dba1d3336f4ea1d0d [2,0,0,0,0,0|0,1,0]=3 89 B22R2.15089 CN(C)CCOc1ccc(cc1)c2ccc(cn2)C(=O)O fa84264e891acd43815f1347e0e57065 [2,0,0,0,0,0|2,0,0]=4 90 B22R2.15089 CN(C)CCOc1ccc(cc1)c2ncc(cn2)C(=O)N a7fd43089f1b024dbbf9676d90de7a10 [2,0,0,0,0,0|2,0,0]=4 91 B22R2.15089 CN(C)CCOc1ccc(cc1)c2ncc(cn2)C(=O)O a0f30b8c1c1f20da44d67de2b7198463 [2,0,0,0,0,0|1,0,0]=3 92 B22R2.15089 CN(C)CCOc1ccc(cn1)c2ncc(cn2)C(=O)O 48a264f0d08cdfcb8e84f15d55d6e81a [2,0,0,0,0,0|2,0,0]=4 93 B22R2.376179 CCCCOc1ccc(cc1Cl)c2ccc(cn2)C(=O)O d19a9bbc734f71db07026aba4a256de9 [2,0,0,0,0,0|2,0,0]=4 94 B22R2.376179 CCCCOc1ccc(cc1Cl)c2ncc(cn2)C(=O)C 48ec8cf993c703d4fa45a5a6c31443f4 [2,0,0,0,0,0|2,0,0]=4 95 B22R2.376179 CCCCOc1ccc(cc1Cl)c2ncc(cn2)C(=O)N 72f5200469184d59048965e513f13f2e [2,0,0,0,0,0|2,0,0]=4 96 B22R2.376179 CCCCOc1ccc(cc1Cl)c2ncc(cn2)C(=O)O cff4cd44f75269e9d82d4cb52b9323ec [2,0,0,0,0,0|1,0,0]=3 97 B22R2.376179 CCCCOc1ccc(cc1F)c2ccc(cn2)C(=O)O 59ea0294c93bcf8969060aab0ef0c8ae [2,0,0,0,0,0|2,0,0]=4 98 B22R2.376179 CCCCOc1ccc(cc1F)c2ncc(cn2)C(=O)C 3e258dad7b5a2ebc882d46ab3013e2cc [2,0,0,0,0,0|2,0,0]=4 99 B22R2.376179 CCCCOc1ccc(cc1F)c2ncc(cn2)C(=O)N fbef70adde2047b44818e8bee857b592 [2,0,0,0,0,0|2,0,0]=4 100 B22R2.376179 CCCCOc1ccc(cc1F)c2ncc(cn2)C(=O)O 302022193f03e595d41bbfb4a3f04e15 [2,0,0,0,0,0|1,0,0]=3 101 B22R2.376179 CCCCOc1ncc(cc1C)c2ncc(cn2)C(=O)O b10e1f19bed6d38a2561d3faf7042348 [2,0,0,0,0,0|1,0,1]=4 102 B22R2.376179 CCCCOc1ncc(cc1Cl)c2ncc(cn2)C(=O)O 998e8037024bc16614b1b8d872c0a931 [2,0,0,0,0,0|2,0,0]=4 103 B22R2.376179 COCCOc1ccc(cc1C)c2ncc(cn2)C(=O)O d99b29d462d73c8ee109b9e30d483d98 [2,0,0,0,0,0|1,0,1]=4 104 B22R2.376179 COCCOc1ccc(cc1Cl)c2ncc(cn2)C(=O)O 8c6aa355b63d4bedfe8788888553eee3 [2,0,0,0,0,0|2,0,0]=4 105 B22R2.376179 COCCOc1ccc(cc1F)c2ncc(cn2)C(=O)O 45070b4992c9fcdc4b3d91f7a5b89125 [2,0,0,0,0,0|2,0,0]=4 106 B22R2.67828 CCCOc1ccc(cc1C#N)c2ccc(cc2)C(=O)O 667dbe8be790cf8b454262dc02e5dafc [2,0,0,0,0,0|2,0,0]=4 107 B22R2.67828 CCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)C f3acf83a1404b4f4243698d56116c900 [2,0,0,0,0,0|2,0,0]=4 108 B22R2.67828 CCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)N cd2e5f7d11df52be34ab65c03eda509e [2,0,0,0,0,0|2,0,0]=4 109 B22R2.67828 CCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)O 9d6b2f250d7274e6993ac309b8b90526 [2,0,0,0,0,0|1,0,0]=3 110 B22R2.67828 CCCOc1ccc(cc1C#N)c2ccc(nn2)C(=O)O 36ec12e16733d5ea3c00c07717ae0a4a [2,0,0,0,0,0|2,0,0]=4 111 B22R2.67828 CCCOc1ccc(cc1C#N)c2cnc(cn2)C(=O)O 9dec5cf7d0790389e3a97c7e29635db1 [2,0,0,0,0,0|2,0,0]=4 112 B22R2.67828 CCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)C 1db2b2907334d85e9691fd2ff864e01b [2,0,0,0,0,0|1,0,0]=3 113 B22R2.67828 CCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)N bb54afe4c4ddb657c245ce8902bb71ab [2,0,0,0,0,0|1,0,0]=3 114 B22R2.67828 CCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)O 5153a83339a8ded816b0c4a6f4cfd041 [2,0,0,0,0,0|0,0,0]=2 115 B22R2.67828 CCCOc1ccc(cc1C#N)c2ncc(cn2)C(C)O 5efbf89bc32b6a4abe12eaff4e3551ca [2,0,0,0,0,0|1,0,1]=4 116 B22R2.67828 CCCOc1ccc(cc1C#N)c2ncc(cn2)[N+](=O)[O-] 557e9f2e16f2b053ea6ddd17f00e6ed3 [2,0,0,0,0,0|1,0,1]=4 117 B22R2.67828 COCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)O c1470fe2a0d83bdf11887b3a336a506e [2,0,0,0,0,0|2,0,0]=4 118 B22R2.67828 COCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)C ccbb03c9fdbbbdec23a9cd3acf5221d6 [2,0,0,0,0,0|2,0,0]=4 119 B22R2.67828 COCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)N c0bd1842c1826dd1883ba3ed7c8c8df7 [2,0,0,0,0,0|2,0,0]=4 120 B22R2.67828 COCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)O fc5eee855c4b3843de83e565f5731440 [2,0,0,0,0,0|1,0,0]=3 121 B24R2.988569 COC(=O)c1cnc(nc1)c2ccc(c(c2)F)OCCN(C)C 8622488cc8c5277f3d3f15d86ae5db4e [1,1,0,0,0,0|2,0,0]=4 122 B24R2.642980 CCCCOc1ccc(cc1C#N)c2ccc(cc2)C(=O)OC 08a5e3ac98e98f798e39eb466ef532a4 [1,1,0,0,0,0|2,0,0]=4 123 B24R2.642980 CCCCOc1ccc(cc1C=O)c2ncc(cn2)C(=O)OC ddbacd39e7b2414f01d8f48151a6984c [1,1,0,0,0,0|1,0,1]=4 124 B24R2.642980 CNC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OCCOC 4df539093254e6aad96bbf8ebd6b0b08 [1,1,0,0,0,0|2,0,0]=4 125 B24R2.642980 COCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)NO b0da1ae2265e2aedf80800237d77efca [1,1,0,0,0,0|2,0,0]=4 126 B24R2.642980 COCCOc1ccc(cc1C#N)c2ccc(cn2)C(=O)OC 38b8b6daa2fd92baf5d0e506f9065cff [1,1,0,0,0,0|2,0,0]=4 127 B24R2.642980 COCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)CBr 97f909d76de14f103611a7db0d54c732 [1,1,0,0,0,0|2,0,0]=4 128 B24R2.642980 COCCOc1ccc(cc1C#N)c2ncc(cn2)C(=O)OC 64b5365d3b611b86796d38392eedf494 [1,1,0,0,0,0|1,0,0]=3 129 B24R2.642985 CCCCOc1ccc(cc1C#N)c2ccc(cc2C)C(=O)O 69471cdb73242de2c953606c6e95ef34 [1,1,0,0,0,0|2,0,0]=4 130 B24R2.642985 CCCCOc1ccc(cc1C#N)c2ccc(cc2F)C(=O)O d3d1dca284858e8b8102bbe8e6c5a1d1 [1,1,0,0,0,0|2,0,0]=4 131 B24R2.642985 COCCOc1ccc(cc1C#N)c2ncc(cc2C)C(=O)O 29d8aa7500c8bddb09f7823ff7889e94 [1,1,0,0,0,0|2,0,0]=4 132 B24R2.642985 COCCOc1ccc(cc1C#N)c2ncc(cc2F)C(=O)O 9664b664ca1930f3355756c0b01f1859 [1,1,0,0,0,0|2,0,0]=4 133 B24R2.642985 COCCOc1ccc(cc1C#N)c2ncc(cc2N)C(=O)O 9b789f62d07ce96904da49ead7d4f98e [1,1,0,0,0,0|2,0,0]=4 134 B24R2.643013 CCCCOc1ccc(cc1C#N)c2ccc(c(c2)F)C(=O)O 200c6fd68b8b3c67cf74393b062727b9 [1,1,0,0,0,0|2,0,0]=4 135 B24R2.643013 CCCCOc1ccc(cc1C=O)c2ncc(c(n2)C)C(=O)O fd0becd2e17d4abe0976fd82d27579cc [1,1,0,0,0,0|1,0,1]=4 136 B24R2.643013 CCCCOc1ccc(cc1C=O)c2ncc(c(n2)N)C(=O)O 7d6e5ef56779495a98e3871b42057563 [1,1,0,0,0,0|1,0,1]=4 137 B24R2.643013 COCCOc1ccc(cc1C#N)c2cc(c(cn2)C(=O)O)C 5c168178fb0ffe87814e6f43957b597d [1,1,0,0,0,0|2,0,0]=4 138 B24R2.643013 COCCOc1ccc(cc1C#N)c2cc(c(cn2)C(=O)O)F 49a578cb13ab8dad4c97c31d547181d3 [1,1,0,0,0,0|2,0,0]=4 139 B24R2.643013 COCCOc1ccc(cc1C#N)c2cc(c(cn2)C(=O)O)N f20836316e913d82a9cf11ff6e708a76 [1,1,0,0,0,0|2,0,0]=4 140 B24R2.643013 COCCOc1ccc(cc1C#N)c2ccc(c(n2)C)C(=O)O 19d29f4b0fd8fccd48dbe096bcbba602 [1,1,0,0,0,0|2,0,0]=4 141 B24R2.643013 COCCOc1ccc(cc1C#N)c2ccc(c(n2)F)C(=O)O 2d28cc579ab4a0fa1c2a89ac7c2cb2bb [1,1,0,0,0,0|2,0,0]=4 142 B24R2.643013 COCCOc1ccc(cc1C#N)c2ccc(c(n2)N)C(=O)O 276a681d09a1ac1c06ff100b50294070 [1,1,0,0,0,0|2,0,0]=4 143 B24R2.643013 COCCOc1ccc(cc1C#N)c2ccc(c(n2)O)C(=O)O 39fa658739bfd422b193e71421387901 [1,1,0,0,0,0|2,0,0]=4 144 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)CO 9762ed748503a48984b70e7d9cd418f0 [0,1,0,0,1,0|2,0,0]=4 145 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)NO d0eb86e684acf4733b07d4c53252c569 [0,1,0,0,1,0|2,0,0]=4 146 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)ON f3ca78e2fe53f49992236d68663d280a [0,1,0,0,1,0|2,0,0]=4 147 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)CBr 69c8555a7dfdee0e8dd5a6fc3d80efcd [0,1,0,0,1,0|2,0,0]=4 148 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)CCl 305cd04a16877e4506ebde615df3013e [0,1,0,0,1,0|2,0,0]=4 149 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)NO afce041f2f34d4653c2e5f23e729a0ae [0,1,0,0,1,0|1,0,0]=3 150 B24R2.74548 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(=O)CBr f1c11ed1a28a5e7297672a67bb3b6cc1 [0,1,0,0,1,0|1,0,0]=3 151 B24R2.74548 CCC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C 8b383186ba5c045e3121a399bf109464 [0,1,0,0,1,0|2,0,0]=4 152 B24R2.74548 CNC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C c12dab2c96ed10e7cd4c0e5894ae1bbf [0,1,0,0,1,0|2,0,0]=4 153 B24R2.74548 CNC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C 3f181e0b5f34820e3dfd4b4b87f9d679 [0,1,0,0,1,0|1,0,0]=3 154 B24R2.74548 COC(=O)c1ccc(cc1)c2ccc(c(c2)C#N)OCC(C)C 6058779160537f7edeedc09dd46ca9a5 [0,1,0,0,1,0|2,0,0]=4 155 B24R2.74548 COC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C 2ea7b98197d52697d808e9da5a44c48b [0,1,0,0,1,0|1,0,0]=3 156 B24R2.74548 COC(=O)c1ccc(nn1)c2ccc(c(c2)C#N)OCC(C)C 6fbf157745efe650ba7e12b5a336f440 [0,1,0,0,1,0|2,0,0]=4 157 B24R2.74548 COC(=O)c1cnc(cn1)c2ccc(c(c2)C#N)OCC(C)C 5a1d35df7764c3c72bb77557bab8a1f1 [0,1,0,0,1,0|2,0,0]=4 158 B24R2.74548 COC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C 08e2348c2463c3c6e729e99dabeeca7e [0,1,0,0,1,0|0,0,0]=2 159 B24R2.74549 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(C)(C)O 708933278ae0c33c692c822455c38cac [0,1,0,0,1,0|1,0,1]=4 160 B24R2.74549 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)S(=O)(=O)C 0997bb12907b5908e307fd0409214a8f [0,1,0,0,1,0|1,0,1]=4 161 B24R2.74549 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)S(=O)(=O)N cf2c343692af66e7c9ea0e6ad3e20320 [0,1,0,0,1,0|1,0,1]=4 162 B24R2.18471401 CC(=O)c1cnc(c(c1)C)c2ccc(c(c2)C#N)OCC(C)C 031c3eee88caafd174000e7a862dcec1 [0,1,0,0,1,0|2,0,0]=4 163 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ccc(cc2F)C(=O)O 1840ed9ba1f725ef888f06e6df7f1dc2 [0,1,0,0,1,0|2,0,0]=4 164 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ccc(cc2N)C(=O)O ea433cf6b6c416186a338c020d0ab9da [0,1,0,0,1,0|2,0,0]=4 165 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ccc(cc2O)C(=O)O 96b9035f3ba74d8a93f5c95122a3f839 [0,1,0,0,1,0|2,0,0]=4 166 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ncc(cc2F)C(=O)N 4ea447647f7e0d53a07b2da88e2e7bd8 [0,1,0,0,1,0|2,0,0]=4 167 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ncc(cc2F)C(=O)O 7bc108f81a717c636490ac25cd6125ea [0,1,0,0,1,0|1,0,0]=3 168 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ncc(cc2N)C(=O)O e86b9531418836c6927321791ab5b7a0 [0,1,0,0,1,0|1,0,0]=3 169 B24R2.18471401 CC(C)COc1ccc(cc1C#N)c2ncc(cc2O)C(=O)O e5462f471ffa4493a28c92c4a89c2160 [0,1,0,0,1,0|1,0,0]=3 170 B24R2.18471401 Cc1cc(ccc1c2ccc(c(c2)C#N)OCC(C)C)C(=O)O cb40cb1fd66c5f95d9bed931162d7cb5 [0,1,0,0,1,0|2,0,0]=4 171 B24R2.18471401 Cc1cc(cnc1c2ccc(c(c2)C#N)OCC(C)C)C(=O)N 54dbb4a2645264e94a02a732433a8076 [0,1,0,0,1,0|2,0,0]=4 172 B24R2.18471401 Cc1cc(cnc1c2ccc(c(c2)C#N)OCC(C)C)C(=O)O ee6083ea3f1a1df7d91e7a2943991670 [0,1,0,0,1,0|1,0,0]=3 173 B24R2.18471401 Cc1nc(cnc1c2ccc(c(c2)C#N)OCC(C)C)C(=O)O f83a0e58856d2b3b4fe70f90d3513fdb [0,1,0,0,1,0|2,0,0]=4 174 B24R2.18471415 CC(=O)c1ccc(nc1C)c2ccc(c(c2)C#N)OCC(C)C 6c932cc7b9c4cf9ea22c60d1e169e782 [0,1,0,0,1,0|2,0,0]=4 175 B24R2.18471415 CC(=O)c1ccc(nc1F)c2ccc(c(c2)C#N)OCC(C)C ef5364fa6425a07cf45129d5f1bd6d05 [0,1,0,0,1,0|2,0,0]=4 176 B24R2.18471415 CC(=O)c1ccc(nc1N)c2ccc(c(c2)C#N)OCC(C)C 5ce5dd14b2fd461d612dbcc1bf39ef72 [0,1,0,0,1,0|2,0,0]=4 177 B24R2.18471415 CC(=O)c1ccc(nc1O)c2ccc(c(c2)C#N)OCC(C)C 0dd113f178c6a4fc6122cf07d720b28b [0,1,0,0,1,0|2,0,0]=4 178 B24R2.18471415 CC(=O)c1cnc(cc1C)c2ccc(c(c2)C#N)OCC(C)C 8f9bd3890890b2426ac93e0795edc1c7 [0,1,0,0,1,0|2,0,0]=4 179 B24R2.18471415 CC(=O)c1cnc(cc1O)c2ccc(c(c2)C#N)OCC(C)C 00372f2e14150abd5cfabfb43d46f159 [0,1,0,0,1,0|2,0,0]=4 180 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2cc(c(cn2)C(=O)O)F 0d189246227c5a803f7aa73450fd85d6 [0,1,0,0,1,0|1,0,0]=3 181 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2cc(c(cn2)C(=O)O)N b47bb7e008e63077bd9077e00b45dec2 [0,1,0,0,1,0|1,0,0]=3 182 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(c2)F)C(=O)O 3d34a20acce6b6405bfbb71c7b15e867 [0,1,0,0,1,0|2,0,0]=4 183 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(c2)N)C(=O)O f0dbe5d87c5f7520cba32e3703dee1f8 [0,1,0,0,1,0|2,0,0]=4 184 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(c2)O)C(=O)O 13ec787b97826be39b6a8092bea75339 [0,1,0,0,1,0|2,0,0]=4 185 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(c2)S)C(=O)O 918eb22684eeffd782653288fde8e681 [0,1,0,0,1,0|2,0,0]=4 186 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(n2)F)C(=O)N f24f720bc0c6adac1b60b56d7919da2c [0,1,0,0,1,0|2,0,0]=4 187 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(n2)F)C(=O)O dfbc4839c36e4463d242630111a0308e [0,1,0,0,1,0|1,0,0]=3 188 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(n2)N)C(=O)N c5a22a103b2acaacc0453f6889477713 [0,1,0,0,1,0|2,0,0]=4 189 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(n2)N)C(=O)O 18aca7e17650ad2579ecc6f48b532a9f [0,1,0,0,1,0|1,0,0]=3 190 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2ccc(c(n2)O)C(=O)O fce3d2ba75801f9af25414216ac5ba20 [0,1,0,0,1,0|1,0,0]=3 191 B24R2.18471415 CC(C)COc1ccc(cc1C#N)c2cnc(c(n2)N)C(=O)O 92381c23be1803ffa46c8fb59aa96c54 [0,1,0,0,1,0|2,0,0]=4 192 B24R2.18471415 Cc1cc(ccc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C 49ad5b9f3a0c87c3bffe5aa223342938 [0,1,0,0,1,0|2,0,0]=4 193 B24R2.18471415 Cc1cc(ncc1C(=O)N)c2ccc(c(c2)C#N)OCC(C)C 1760d0cbc5bd2c8ddc81d33b57ac6876 [0,1,0,0,1,0|2,0,0]=4 194 B24R2.18471415 Cc1cc(ncc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C ecd9a884a6d8929468962bcef182776d [0,1,0,0,1,0|1,0,0]=3 195 B24R2.18471415 Cc1nc(ccc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C 0d4f7a51f78d2c01b3ed138e1df45d14 [0,1,0,0,1,0|1,0,0]=3 196 B26R2.5435055 COC(=O)c1cnc(nc1)Nc2ccc(c(c2)C=O)OCCC(C)C 74b2053c1c536a956186426cfa96ab38 [0,1,0,0,0,1|1,0,1]=4 197 B26R2.5435072 CC(C)CCOc1ccc(cc1C=O)Nc2ncc(c(n2)O)C(=O)O ab4898a0f73d459040d062010e15ef0d [0,1,0,0,0,1|1,0,1]=4 198 B26R2.5435072 Cc1nc(ncc1C(=O)O)Nc2ccc(c(c2)C=O)OCCC(C)C 999c139de87d6004aea65d7dae6a270d [0,1,0,0,0,1|1,0,1]=4 199 B26R2.36043878 CC(C)CCOc1ccc(cc1C=O)N(C)c2ncc(cn2)C(=O)O 5ce5cce68edbca8c837b47bfa0024819 [0,1,0,0,0,1|1,0,1]=4 200 B24R3.2057506 CC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OCC3CC3 ff3313326f6acc2ca4307e2601c00574 [1,0,0,1,0,0|2,0,0]=4 201 B24R3.2057506 CC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OCC3CC3 a5dc521bca3ced8a59bf69b93bed26ec [1,0,0,1,0,0|1,0,0]=3 202 B24R3.2057506 CC(O)c1cnc(nc1)c2ccc(c(c2)C#N)OCC3CC3 632fe3ed7da0824e287dde6497d066ec [1,0,0,1,0,0|1,0,1]=4 203 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ccc(cc3)C(=O)O 716727b1560e0ba5d27cd27a563f477a [1,0,0,1,0,0|2,0,0]=4 204 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ccc(cn3)C(=O)N f66d104bf90ceae8f29c3868eb0452cc [1,0,0,1,0,0|2,0,0]=4 205 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ccc(cn3)C(=O)O a143660dde45e919aba776d1c4763857 [1,0,0,1,0,0|1,0,0]=3 206 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ccc(nn3)C(=O)O c7e59bb9832866ec406b1004dca7e57b [1,0,0,1,0,0|2,0,0]=4 207 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3cnc(cn3)C(=O)O f04a729742d821dcc2fc5755d6ef4dec [1,0,0,1,0,0|2,0,0]=4 208 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ncc(cn3)C(=O)N d69bafa0cf079f1391f56cefb3fd6adb [1,0,0,1,0,0|1,0,0]=3 209 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ncc(cn3)C(=O)O 9790d084d794d7a424c59d78ddb4412f [1,0,0,1,0,0|0,0,0]=2 210 B24R3.2057506 N#Cc1cc(ccc1OCC2CC2)c3ncc(cn3)[N+](=O)[O-] 39bc59579e485c62447e9301877373a4 [1,0,0,1,0,0|1,0,1]=4 211 B24R3.2058071 CC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)N3CCCC3 dd07d866660028d950f3a6284636936c [1,0,0,1,0,0|2,0,0]=4 212 B24R3.2058071 N#Cc1cc(ccc1N2CCCC2)c3ccc(cn3)C(=O)O a6154b85cf4c90b7f87cc1b01ca5d414 [1,0,0,1,0,0|2,0,0]=4 213 B24R3.2058071 N#Cc1cc(ccc1N2CCCC2)c3ncc(cn3)C(=O)N 1e99bdc626e76382520dede5b690b148 [1,0,0,1,0,0|2,0,0]=4 214 B24R3.2058071 N#Cc1cc(ccc1N2CCCC2)c3ncc(cn3)C(=O)O 39a4409bfe292696f65f57f14e82891a [1,0,0,1,0,0|1,0,0]=3 215 B24R3.2058071 N#Cc1cc(cnc1N2CCCC2)c3ncc(cn3)C(=O)O ef02db576456dcc7fbe2f47277c421ce [1,0,0,1,0,0|2,0,0]=4 216 B24R3.40797086 N#Cc1cc(ccc1OC2CCC2)c3ccc(cc3)C(=O)O c540cf16435b264c5f31a38edede46cc [1,0,0,1,0,0|2,0,0]=4 217 B22R2.7519 C=Cc1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C 8fd9895f82ed20f5af1190c0cf41de28 [1,0,0,0,1,0|2,0,0]=4 218 B22R2.7519 C=Cc1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C d4bef2d7e39e08eb23bd5f9198cd2044 [1,0,0,0,1,0|1,0,0]=3 219 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C=O c44ffc4cc4eee94cc1147b3728c4635b [1,0,0,0,1,0|2,0,0]=4 220 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C=O 91d4c52e0bf18a688d29452969a85213 [1,0,0,0,1,0|1,0,0]=3 221 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)CO 08bb5362fb6c4da754b1982cb4874bb0 [1,0,0,0,1,0|1,0,1]=4 222 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ccc(nn2)C=O e367b0a2a191dc03f0c11f6573b7ebda [1,0,0,0,1,0|2,0,0]=4 223 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2cnc(cn2)C=O dccc291195d71738ef3575616d19ef46 [1,0,0,0,1,0|2,0,0]=4 224 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C#N 5a0e2e7f4ce3f19fa0757bf571946c28 [1,0,0,0,1,0|1,0,1]=4 225 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C=O eee43c6edae579a3f9c9f060cc1715e1 [1,0,0,0,1,0|0,0,0]=2 226 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)CBr 9ec33d9dff84283c2828c0d6afde48c8 [1,0,0,0,1,0|1,0,1]=4 227 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)CCl ce4c2c232d45fcbb83bb649d47325e30 [1,0,0,0,1,0|1,0,1]=4 228 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)CN dcee33be27a5e109c3b1b624c59775ab [1,0,0,0,1,0|1,0,1]=4 229 B22R2.7519 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)CO b9290d21743f1386d270ce2adbb4710c [1,0,0,0,1,0|0,0,1]=3 230 B22R2.7519 CCc1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C 75a3186eb03de59d0e2a48e730f3b4b9 [1,0,0,0,1,0|1,0,1]=4 231 B22R2.7519 COc1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C 3fe73d15d1b2736eff3449fb0375a3d3 [1,0,0,0,1,0|2,0,0]=4 232 B22R2.123853 CC(=O)c1cnc(nc1)c2ccc(c(c2)C)OCC(C)C 5c4f6dce59128e6296f60b236e1a27ea [1,0,0,0,1,0|1,0,1]=4 233 B22R2.123853 CC(C)COc1ncc(cc1Cl)c2ncc(cn2)C(=O)O fc30e6e7cfe36370d4a16468d62ece41 [1,0,0,0,1,0|2,0,0]=4 234 B22R2.123853 Cc1cc(ccc1OCC(C)C)c2ccc(cn2)C(=O)O 06172c4452a308dd2fc42dd2f8a33a33 [1,0,0,0,1,0|1,0,1]=4 235 B22R2.123853 Cc1cc(ccc1OCC(C)C)c2ncc(cn2)C(=O)O 1d771fad158c480dc3b2c189fe1c4a19 [1,0,0,0,1,0|0,0,1]=3 236 B22R2.123853 Cc1cc(cnc1OCC(C)C)c2ncc(cn2)C(=O)O d56b14abc159542e7ec8f0d0b91eebb0 [1,0,0,0,1,0|1,0,1]=4 237 B22R2.6028472 Cc1cc(ccc1OCCC(C)C)c2cc(co2)C(=O)O fb0221e709f3370fb8b08681f2289bf1 [1,0,0,0,1,0|1,0,1]=4 238 B22R2.6028472 Cc1cc(ccc1OCCC(C)C)c2cc(cs2)C(=O)O 0d5b882f4c2e1b45568828820bb81569 [1,0,0,0,1,0|1,0,1]=4 239 B22R2.376015 CCCCOc1ccc(cc1C#N)c2cc(cs2)C(=O)C 0f4606e3330fa58e9e49091c343283f3 [1,0,0,0,1,0|2,0,0]=4 240 B22R2.376015 CCCCOc1ccc(cc1C#N)c2ccc(o2)C(=O)O 0e170002f4216d7e136db76b3fce0bf0 [1,0,0,0,1,0|2,0,0]=4 241 B22R2.376015 CCCCOc1ccc(cc1C#N)c2ccc(s2)C(=O)O 5d554fe40c44137c6b719da07ae63d5c [1,0,0,0,1,0|2,0,0]=4 242 B22R2.376015 CCCCOc1ccc(cc1C#N)c2csc(c2)C(=O)O f165c4c54ef156029f3c83e54d32c1fe [1,0,0,0,1,0|2,0,0]=4 243 B22R2.376015 CCCCOc1ccc(cc1C#N)n2cc(cn2)C(=O)C 407dbc4439a9e7d8022d6fc035eb7aa6 [1,0,0,0,1,0|2,0,0]=4 244 B22R2.376015 CCCCOc1ccc(cc1C#N)n2cc(cn2)C(=O)N e29bdb1c337a02b4dbca72e9e9344267 [1,0,0,0,1,0|2,0,0]=4 245 B22R2.376015 COCCOc1ccc(cc1C#N)c2cc(co2)C(=O)O ca37390a4bba385ada971ae05204b1eb [1,0,0,0,1,0|2,0,0]=4 246 B22R2.376015 COCCOc1ccc(cc1C#N)c2cc(cs2)C(=O)O 982dd87cda5071ac5e4864ff8142241e [1,0,0,0,1,0|2,0,0]=4 247 B22R2.376015 COCCOc1ccc(cc1C#N)c2cc(on2)C(=O)O f7b05d6be38ce05ab1738584aa943ee9 [1,0,0,0,1,0|2,0,0]=4 248 B22R2.376015 COCCOc1ccc(cc1C#N)c2cc(sn2)C(=O)O cc7e582786ea88d43738a5e6ffb87dbb [1,0,0,0,1,0|2,0,0]=4 249 B22R2.376015 COCCOc1ccc(cc1C#N)c2nc(co2)C(=O)O c0152c8f1eb1b7007ccc99afa7f6a5d4 [1,0,0,0,1,0|2,0,0]=4 250 B22R2.376015 COCCOc1ccc(cc1C#N)c2nc(cs2)C(=O)O f9de7dd1ec50a5fda9cccaf40446d0a1 [1,0,0,0,1,0|2,0,0]=4 251 B22R2.376015 COCCOc1ccc(cc1C#N)c2ncc([nH]2)C(=O)O a6359fa1be1bf9f652b2c2735e083319 [1,0,0,0,1,0|1,0,1]=4 252 B22R2.376015 COCCOc1ccc(cc1C#N)c2ncc(o2)C(=O)O e28ca51050dba1b6fb0eacbdde7980ca [1,0,0,0,1,0|2,0,0]=4 253 B22R2.376015 COCCOc1ccc(cc1C#N)c2ncc(s2)C(=O)O 32ae7ef974cf59a974203bf6266b185a [1,0,0,0,1,0|2,0,0]=4 254 B22R2.55479 CC(=O)Oc1ccc(cc1C#N)c2ncc(cn2)C(=O)O 7989b182a4b59104eef14136e13a3ff4 [0,0,0,0,2,0|1,0,1]=4 255 B22R2.55479 CC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OC(C)C e757f371c244747345f4bff34e964368 [0,0,0,0,2,0|2,0,0]=4 256 B22R2.55479 CC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OC(C)C a87e56d0c10acb27bceca7a0051187ea [0,0,0,0,2,0|1,0,0]=3 257 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ccc(cc2)C(=O)O 93f7395f88cc55f9abc46b2ecabfe4a9 [0,0,0,0,2,0|2,0,0]=4 258 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ccc(cn2)C(=O)N a5d05edfabaef919cfef41f10c6f0b02 [0,0,0,0,2,0|2,0,0]=4 259 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ccc(cn2)C(=O)O 39549df57df646f86bfcd4bace6737ec [0,0,0,0,2,0|1,0,0]=3 260 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ccc(nn2)C(=O)O 569383373cd9682d7e9b044970e33bce [0,0,0,0,2,0|2,0,0]=4 261 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2cnc(cn2)C(=O)O 7fdb457de033785e124261691fd114a0 [0,0,0,0,2,0|2,0,0]=4 262 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ncc(cn2)C(=O)N db47b998e2ea30a7dc370b69d5bf017b [0,0,0,0,2,0|1,0,0]=3 263 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ncc(cn2)C(=O)O fa4c652b49e516cac1c414e8cd46e856 [0,0,0,0,2,0|0,0,0]=2 264 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ncc(cn2)C(C)O 50823e442ff62f62686fe17314e547c6 [0,0,0,0,2,0|1,0,1]=4 265 B22R2.55479 CC(C)Oc1ccc(cc1C#N)c2ncc(cn2)[N+](=O)[O-] f31d85b768eb8aeaa455137a45dfeba3 [0,0,0,0,2,0|1,0,1]=4 266 B22R2.55479 CC(C)Oc1ccc(cc1C=O)c2ncc(cn2)C(=O)O 14f571e83a5e271f60095a574371bc41 [0,0,0,0,2,0|1,0,1]=4 267 B22R2.55479 CCc1cc(ccc1OC(C)C)c2ncc(cn2)C(=O)O e2be00ec5a7bf5e0a686084244fd05a3 [0,0,0,0,2,0|1,0,1]=4 268 B22R2.55479 COc1cc(ccc1OC(C)C)c2ncc(cn2)C(=O)O f487f8d49d4c5e3c824aece31273ecc5 [0,0,0,0,2,0|2,0,0]=4 269 B22R2.8946400 CC(=O)c1cc(no1)c2ccc(c(c2)C#N)OCC(C)C 37bd6fec68120b7d726500ccf2616d61 [0,0,0,0,2,0|2,0,0]=4 270 B22R2.8946400 CC(=O)c1cnc(s1)c2ccc(c(c2)C#N)OCC(C)C c8c608cc5b2e9d4864c8287b52f51310 [0,0,0,0,2,0|2,0,0]=4 271 B22R2.8946400 CC(=O)c1csc(c1)c2ccc(c(c2)C#N)OCC(C)C 4f2c0d14e7fc0f8ce2c2779af7360676 [0,0,0,0,2,0|2,0,0]=4 272 B22R2.8946400 CC(=O)c1csc(n1)c2ccc(c(c2)C#N)OCC(C)C 74efb948f8a49beb43af0190b3fd8d3b [0,0,0,0,2,0|2,0,0]=4 273 B22R2.8946400 CC(=O)n1cnc(c1)c2ccc(c(c2)C#N)OCC(C)C f5ecc5bbb8ff66a1f9404077bf23ac65 [0,0,0,0,2,0|2,0,0]=4 274 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2c[nH]c(c2)C(=O)O 955a87b84f0ae54bc3bff7e64d7374a1 [0,0,0,0,2,0|2,0,0]=4 275 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2c[nH]c(n2)C(=O)O dd2c2281bccd0b47bf2b167b5b4c6e1c [0,0,0,0,2,0|2,0,0]=4 276 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(co2)C(=O)N 8a4c4bf8e0f75b58c0e96fe38d1baa42 [0,0,0,0,2,0|2,0,0]=4 277 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(co2)C(=O)O d563b0db943fde0c9cf9536d49663137 [0,0,0,0,2,0|1,0,0]=3 278 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(cs2)C(=O)N d991f90c0b562fbd4c7c440836b2f6fe [0,0,0,0,2,0|2,0,0]=4 279 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(cs2)C(=O)O 3543eb41e34fcb22381927c4361ec9ba [0,0,0,0,2,0|1,0,0]=3 280 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(n[nH]2)C(=O)O 67d9a3a7fd81b4a2afc7a7231d72b30f [0,0,0,0,2,0|1,0,1]=4 281 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(no2)C(=O)O ea9aaef49b784a3e9e712a4cf94ff960 [0,0,0,0,2,0|2,0,0]=4 282 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(ns2)C(=O)O 75340295f55e1c77d7add8fcaa6b1078 [0,0,0,0,2,0|2,0,0]=4 283 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(on2)C(=O)N 45cdcbbdda7842c7dde48ff20d771090 [0,0,0,0,2,0|2,0,0]=4 284 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(on2)C(=O)O fbd2510d294f780db25e03674e689e31 [0,0,0,0,2,0|1,0,0]=3 285 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(sn2)C(=O)N 523d03bd6ccb3711aa71752eb0b9b1ac [0,0,0,0,2,0|2,0,0]=4 286 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(sn2)C(=O)O 8bdbd5a6abb717ae36cab5424abb3f66 [0,0,0,0,2,0|1,0,0]=3 287 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ccc([nH]2)C(=O)O 39d3eec2ce12bd88e4fdabcd23452597 [0,0,0,0,2,0|1,0,1]=4 288 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ccc(o2)C(=O)O 06566ab756271d7a46b09ab855243b3b [0,0,0,0,2,0|2,0,0]=4 289 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ccc(s2)C(=O)O 0ac0c119ddc5b3e6f6b25494c9e16bfa [0,0,0,0,2,0|2,0,0]=4 290 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2coc(c2)C(=O)O dd0563e834111673af83b30ebbc00824 [0,0,0,0,2,0|2,0,0]=4 291 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2coc(n2)C(=O)O 48ed4018f04bf2b09d9e2856d19405d4 [0,0,0,0,2,0|2,0,0]=4 292 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2csc(c2)C(=O)O 88280f1a1b814c05cb60d4ebb4b2b8f4 [0,0,0,0,2,0|2,0,0]=4 293 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2csc(n2)C(=O)O 81423407f011b2ec63b8e3d5a36c4e21 [0,0,0,0,2,0|2,0,0]=4 294 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2n[nH]c(n2)C(=O)N 89ff391dab58bb75f2b882f00c1e41c9 [0,0,0,0,2,0|2,0,0]=4 295 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(co2)C(=O)N 6724c4f2cefeabb10202c5e8657e36b4 [0,0,0,0,2,0|2,0,0]=4 296 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(co2)C(=O)O 95892c0c95f9f21f2060afe6a2664219 [0,0,0,0,2,0|1,0,0]=3 297 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(cs2)C(=O)N 251908ad83411bdbb8654e70272d5a02 [0,0,0,0,2,0|2,0,0]=4 298 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(cs2)C(=O)O 6039188a500e5169cd5f13035b2cdf57 [0,0,0,0,2,0|1,0,0]=3 299 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(n[nH]2)C(=O)O 1b5cb501cff1ff47f61a36562ab1c417 [0,0,0,0,2,0|1,0,1]=4 300 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc([nH]2)C(=O)O ae0ed5c81af2da7b463665a36907c209 [0,0,0,0,2,0|0,0,1]=3 301 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(o2)C(=O)N 53fd34e6357427fa38d9c8339c7511fa [0,0,0,0,2,0|2,0,0]=4 302 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(o2)C(=O)O 4f06c6a03eee034625a890f020a2479e [0,0,0,0,2,0|1,0,0]=3 303 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(s2)C(=O)N c2461b2b7f9d8802f154791c15e816d7 [0,0,0,0,2,0|2,0,0]=4 304 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(s2)C(=O)O b2efcf07f1db2d2d2066189e81fccaf3 [0,0,0,0,2,0|1,0,0]=3 305 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nnc(s2)C(=O)O f2fdaf89fbae44182aa0806b36f63c93 [0,0,0,0,2,0|2,0,0]=4 306 B24R2.272407 CC(C)CCOc1ccc(cc1C=O)Nc2ncc(cn2)C=O 647f66c56bba2fcc02a92f2a519fe8f9 [1,0,0,0,0,1|1,0,1]=4 307 B24R2.173137 CN(C)CCOc1ccc(cc1F)c2ncc(cn2)CC(=O)O 5b11e59b52a938b8eac9d2a61389a916 [1,0,0,0,0,1|2,0,0]=4 308 B24R2.6034499 CC(=O)c1cnc(nc1)Nc2ccc(c(c2)C)OCCC(C)C a69feb8aca6b3caab6da143cc8acd9cd [1,0,0,0,0,1|1,0,1]=4 309 B24R2.6034499 CC(=O)c1cnc(nc1)Nc2ccc(c(c2)F)OCCC(C)C 4a356d94170c414645c69bd99c024401 [1,0,0,0,0,1|2,0,0]=4 310 B24R2.6034499 Cc1cc(ccc1OCCC(C)C)Nc2ccc(cn2)C(=O)O dbb0053b317a03c3c8040afa28b64b55 [1,0,0,0,0,1|1,0,1]=4 311 B24R2.6034499 Cc1cc(ccc1OCCC(C)C)Nc2ncc(cn2)C(=O)O a5843bf0d0945605393aeb152a0bf9d5 [1,0,0,0,0,1|0,0,1]=3 312 B24R2.642983 CCCCOc1ccc(cc1C#N)c2ccc(cc2)CC(=O)O c04b2786f908735b49b2227271394600 [1,0,0,0,0,1|2,0,0]=4 313 B24R2.642983 CCCCOc1ccc(cc1C=O)c2ncc(cn2)CC(=O)O 0ba4a4f838ac484ba7d6352152f8c85f [1,0,0,0,0,1|1,0,1]=4 314 B24R2.642983 COCCOc1ccc(cc1C#N)c2ccc(cn2)CC(=O)O f22b6b8200201dab6539b978805bb906 [1,0,0,0,0,1|2,0,0]=4 315 B24R2.642983 COCCOc1ccc(cc1C#N)c2ncc(cn2)CC(=O)O 6ea0760c622cc516b05977fb35a400f8 [1,0,0,0,0,1|1,0,0]=3 316 B24R2.642987 CCCCOc1ccc(cc1C#N)Nc2ccc(cn2)C(=O)C 917555c8dbe6c78cbf630ebba074f49b [1,0,0,0,0,1|2,0,0]=4 317 B24R2.642987 CCCCOc1ccc(cc1C#N)Nc2ccc(cn2)C(=O)O a58787cd2df4fd66fc16e4a3344f2ad3 [1,0,0,0,0,1|1,0,0]=3 318 B24R2.642987 CCCCOc1ccc(cc1C#N)Nc2cnc(cn2)C(=O)O ccb10f902cd7632492fe80be9e89561f [1,0,0,0,0,1|2,0,0]=4 319 B24R2.642987 CCCCOc1ccc(cc1C#N)Nc2ncc(cn2)C(=O)C e59e89a92dd2fdf660e9a1b58fb6ee6c [1,0,0,0,0,1|1,0,0]=3 320 B24R2.642987 CCCCOc1ccc(cc1CO)Nc2ncc(cn2)C(=O)O a1a783ff5faef77f93a4044bdb2eb376 [1,0,0,0,0,1|1,0,1]=4 321 B24R2.642987 CCCCOc1ccc(cc1OC)Nc2ncc(cn2)C(=O)O 43bad38b1e21705ae54cd1a50769a082 [1,0,0,0,0,1|2,0,0]=4 322 B24R2.74547 CC(=O)Nc1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C 194605e17d32f7d9a4c4332a7a03790a [0,0,0,0,1,1|2,0,0]=4 323 B24R2.74547 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)CC(=O)O e38a4b628bfe1d8de5a2fac101491c60 [0,0,0,0,1,1|2,0,0]=4 324 B24R2.74547 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)CC(=O)N bc2d0bd8be87578716143407bea00518 [0,0,0,0,1,1|2,0,0]=4 325 B24R2.74547 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)CC(=O)O be9370d24b61bc2e2120b44ae80ee3e7 [0,0,0,0,1,1|1,0,0]=3 326 B24R2.74547 CC(C)COc1ccc(cc1C#N)c2ccc(nn2)CC(=O)O 6b239193c9d26f560c525d25b3492f83 [0,0,0,0,1,1|2,0,0]=4 327 B24R2.74547 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)CC(=O)O 35fda5de2049bc4e151606f3c4f70bf3 [0,0,0,0,1,1|0,0,0]=2 328 B24R2.19812925 CC(=O)c1ccc(nc1)Nc2ccc(c(c2)C#N)OCC(C)C 599e1492c7a9e77a306ff0575888a0c1 [0,0,0,0,1,1|2,0,0]=4 329 B24R2.19812925 CC(C)COc1ccc(cc1C#N)Nc2ccc(cn2)C(=O)O 8ff04605994099522d3d312d73eeb60c [0,0,0,0,1,1|1,0,0]=3 330 B24R2.19812925 CC(C)COc1ccc(cc1C#N)Nc2ccc(nn2)C(=O)O a663e9bd56a774992233e8c8ac1dbd97 [0,0,0,0,1,1|2,0,0]=4 331 B24R2.19812925 CC(C)COc1ccc(cc1C#N)Nc2cnc(cn2)C(=O)O b76ebac5ad81976d7ccba024cec8e007 [0,0,0,0,1,1|2,0,0]=4 332 B24R2.19812925 CC(C)COc1ccc(cc1C=O)Nc2ncc(cn2)C(=O)O e6a57771ed9957794bffe63b0ea43d75 [0,0,0,0,1,1|1,0,1]=4 333 B24R2.59739 CC(C)CCOc1cc(ccc1C#N)c2ccc(cc2)C(=O)O 3065544da490b24e48385a265bcccd70 [0,0,0,0,1,1|2,0,0]=4 334 B24R2.19812138 CC(C)CCOc1ccc(cc1C=O)c2cncc(c2)C(=O)O 4ce5607550c1eb8c00c2df17fdd15abf [0,0,0,0,1,1|1,0,1]=4 335 B26R2.5392216 COc1cc(ccc1OCCC(C)C)CNc2ncc(cn2)C(=O)O e206d3d55d85216aa3890f2d737173fd [0,0,0,0,0,2|2,0,0]=4